*HEADER    ANTIBIOTIC                              25-JAN-02   1KV4              
*TITLE     SOLUTION STRUCTURE OF ANTIBACTERIAL PEPTIDE (MORICIN)                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MORICIN;                                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BOMBYX MORI;                                    
*SOURCE   3 ORGANISM_COMMON: DOMESTIC SILKWORM;                                  
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: PXA1                                      
*KEYWDS    HELIX, ANTIBIOTIC, INSECT IMMUNITY                                    
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    H.HEMMI, J.ISHIBASHI, S.HARA, M.YAMAKAWA                              
*REVDAT   1   22-MAY-02 1KV4    0                                                

!A1
assign (resid    1 and  name HA   )(resid    2 and  name HN   ) 2.0 0.2 0.7
assign (resid    1 and  name HB#  )(resid    2 and  name HN   ) 2.0 0.2 4.0

!K2
assign (resid    2 and  name HA   )(resid    3 and  name HN   ) 2.0 0.2 3.0
assign (resid    2 and  name HB#  )(resid    2 and  name HN   ) 2.0 0.2 2.5
assign (resid    2 and  name HD#  )(resid    2 and  name HN   ) 2.0 0.2 2.5
assign (resid    2 and  name HG#  )(resid    2 and  name HN   ) 2.0 0.2 4.0
assign (resid    2 and  name HG#  )(resid    3 and  name HN   ) 2.0 0.2 4.0
assign (resid    2 and  name HD#  )(resid    3 and  name HN   ) 2.0 0.2 2.5


!I3
assign (resid    3 and  name HN   )(resid    4 and  name HD#  ) 2.0 0.2 2.5
assign (resid    3 and  name HN   )(resid    4 and  name HG#  ) 2.0 0.2 2.5
assign (resid    3 and  name HN   )(resid    3 and  name HB   ) 2.0 0.2 1.5
assign (resid    3 and  name HN   )(resid    3 and  name HG1# ) 2.0 0.2 2.5
assign (resid    3 and  name HN   )(resid    3 and  name HG2# ) 2.0 0.2 4.0
assign (resid    3 and  name HN   )(resid    3 and  name HD1# ) 2.0 0.2 4.0
assign (resid    3 and  name HA   )(resid    4 and  name HG#  ) 2.0 0.2 4.0


!P4
assign (resid    4 and  name HA   )(resid    4 and  name HD#  ) 2.0 0.2 4.0
assign (resid    4 and  name HA   )(resid    5 and  name HN   ) 2.0 0.2 1.5
assign (resid    4 and  name HA   )(resid    6 and  name HN   ) 2.0 0.2 3.0
assign (resid    4 and  name HA   )(resid    7 and  name HN   ) 2.0 0.2 1.5
assign (resid    4 and  name HA   )(resid    7 and  name HB#  ) 2.0 0.2 3.0
assign (resid    4 and  name HA   )(resid    8 and  name HN   ) 2.0 0.2 3.0
assign (resid    4 and  name HB#  )(resid    4 and  name HD#  ) 2.0 0.2 2.5
assign (resid    4 and  name HG#  )(resid    5 and  name HN   ) 2.0 0.2 2.5
assign (resid    4 and  name HD#  )(resid    5 and  name HN   ) 2.0 0.2 3.0
assign (resid    4 and  name HG#  )(resid    7 and  name HB#  ) 2.0 0.2 4.5

!I5
assign (resid    5 and  name HA   )(resid    6 and  name HN   ) 2.0 0.2 1.5
assign (resid    5 and  name HA   )(resid    7 and  name HN   ) 2.0 0.2 3.0
assign (resid    5 and  name HA   )(resid    8 and  name HN   ) 2.0 0.2 1.5
assign (resid    5 and  name HA   )(resid    8 and  name HG1# ) 2.0 0.2 4.0
assign (resid    5 and  name HA   )(resid    8 and  name HD1# ) 2.0 0.2 4.0
assign (resid    5 and  name HA   )(resid    9 and  name HN   ) 2.0 0.2 3.0
assign (resid    5 and  name HB   )(resid    5 and  name HN   ) 2.0 0.2 1.5
assign (resid    5 and  name HG2# )(resid    5 and  name HN   ) 2.0 0.2 4.0
assign (resid    5 and  name HD1# )(resid    5 and  name HN   ) 2.0 0.2 4.0
assign (resid    5 and  name HG1# )(resid    6 and  name HN   ) 2.0 0.2 4.0
assign (resid    5 and  name HG2# )(resid    6 and  name HN   ) 2.0 0.2 2.5
assign (resid    5 and  name HD1# )(resid    6 and  name HN   ) 2.0 0.2 2.5
assign (resid    5 and  name HN   )(resid    6 and  name HN   ) 2.0 0.2 1.5

!K6
assign (resid    6 and  name HA   )(resid    7 and  name HN   ) 2.0 0.2 1.5
assign (resid    6 and  name HA   )(resid    8 and  name HN   ) 2.0 0.2 3.0
assign (resid    6 and  name HA   )(resid    9 and  name HN   ) 2.0 0.2 1.5 
assign (resid    6 and  name HA   )(resid   10 and  name HN   ) 2.0 0.2 3.0
assign (resid    6 and  name HB#  )(resid    6 and  name HN   ) 2.0 0.2 2.5
assign (resid    6 and  name HB#  )(resid    7 and  name HN   ) 2.0 0.2 3.0
assign (resid    6 and  name HD#  )(resid    6 and  name HN   ) 2.0 0.2 2.5
assign (resid    6 and  name HG#  )(resid    6 and  name HN   ) 2.0 0.2 2.5
assign (resid    6 and  name HN   )(resid    7 and  name HN   ) 2.0 0.2 1.5
assign (resid    6 and  name HN   )(resid    7 and  name HB#  ) 2.0 0.2 4.0

!A7
assign (resid    7 and  name HA   )(resid    8 and  name HN   ) 2.0 0.2 1.5
assign (resid    7 and  name HA   )(resid   10 and  name HN   ) 2.0 0.2 1.5
assign (resid    7 and  name HA   )(resid   11 and  name HN   ) 2.0 0.2 3.0
assign (resid    7 and  name HB#  )(resid    7 and  name HN   ) 2.0 0.2 3.0
assign (resid    7 and  name HN   )(resid    8 and  name HG2# ) 2.0 0.2 4.0
assign (resid    7 and  name HN   )(resid    8 and  name HN   ) 2.0 0.2 1.5
assign (resid    7 and  name HA   )(resid   10 and  name HB   ) 2.0 0.2 3.0
assign (resid    7 and  name HA   )(resid   10 and  name HG2# ) 2.0 0.2 4.5
assign (resid    7 and  name HA   )(resid   11 and  name HG#  ) 2.0 0.2 5.4
assign (resid    7 and  name HB#  )(resid    8 and  name HA   ) 2.0 0.2 4.0
assign (resid    7 and  name HB#  )(resid    8 and  name HN   ) 2.0 0.2 4.0
assign (resid    7 and  name HB#  )(resid   10 and  name HN   ) 2.0 0.2 4.0
assign (resid    7 and  name HB#  )(resid   10 and  name HB   ) 2.0 0.2 4.0

!I8
assign (resid    8 and  name HA   )(resid    9 and  name HN   ) 2.0 0.2 1.5
assign (resid    8 and  name HA   )(resid   10 and  name HN   ) 2.0 0.2 3.0
assign (resid    8 and  name HA   )(resid   11 and  name HN   ) 2.0 0.2 1.5
assign (resid    8 and  name HA   )(resid   12 and  name HN   ) 2.0 0.2 3.0
assign (resid    8 and  name HB   )(resid    8 and  name HN   ) 2.0 0.2 1.5
assign (resid    8 and  name HD1# )(resid    8 and  name HN   ) 2.0 0.2 4.0
assign (resid    8 and  name HG1# )(resid    8 and  name HN   ) 2.0 0.2 2.5
assign (resid    8 and  name HG1# )(resid    9 and  name HN   ) 2.0 0.2 2.5
assign (resid    8 and  name HG2# )(resid    8 and  name HN   ) 2.0 0.2 2.5
assign (resid    8 and  name HN   )(resid    9 and  name HN   ) 2.0 0.2 1.5

!K9
assign (resid    9 and  name HA   )(resid   10 and  name HN   ) 2.0 0.2 1.5
assign (resid    9 and  name HA   )(resid   12 and  name HN   ) 2.0 0.2 1.5
assign (resid    9 and  name HA   )(resid   13 and  name HN   ) 2.0 0.2 3.0
assign (resid    9 and  name HB#  )(resid    9 and  name HN   ) 2.0 0.2 2.5
assign (resid    9 and  name HB#  )(resid   10 and  name HN   ) 2.0 0.2 2.5
assign (resid    9 and  name HD#  )(resid    9 and  name HN   ) 2.0 0.2 2.5
assign (resid    9 and  name HE#  )(resid    9 and  name HN   ) 2.0 0.2 3.0
assign (resid    9 and  name HG#  )(resid    9 and  name HN   ) 2.0 0.2 2.5
assign (resid    9 and  name HN   )(resid   10 and  name HN   ) 2.0 0.2 1.5

!T10
assign (resid   10 and  name HA   )(resid   11 and  name HN   ) 2.0 0.2 1.5
assign (resid   10 and  name HA   )(resid   13 and  name HN   ) 2.0 0.2 1.5
assign (resid   10 and  name HA   )(resid   14 and  name HN   ) 2.0 0.2 3.0
assign (resid   10 and  name HB   )(resid   10 and  name HN   ) 2.0 0.2 1.5
assign (resid   10 and  name HG2# )(resid   10 and  name HN   ) 2.0 0.2 2.5
assign (resid   10 and  name HG2# )(resid   11 and  name HN   ) 2.0 0.2 2.5
assign (resid   10 and  name HG2# )(resid   11 and  name HA   ) 2.0 0.2 3.0
assign (resid   10 and  name HG2# )(resid   13 and  name HN   ) 2.0 0.2 4.0
assign (resid   10 and  name HN   )(resid   11 and  name HN   ) 2.0 0.2 1.5
assign (resid   10 and  name HN   )(resid   11 and  name HG#  ) 2.0 0.2 5.4
assign (resid   10 and  name HB   )(resid   11 and  name HG#  ) 2.0 0.2 5.4
assign (resid   10 and  name HN   )(resid   13 and  name HG#  ) 2.0 0.2 4.0

!V11
assign (resid   11 and  name HA   )(resid   12 and  name HN   ) 2.0 0.2 1.5
assign (resid   11 and  name HA   )(resid   13 and  name HN   ) 2.0 0.2 3.0
assign (resid   11 and  name HA   )(resid   14 and  name HB#  ) 2.0 0.2 2.5
assign (resid   11 and  name HA   )(resid   14 and  name HN   ) 2.0 0.2 1.5
assign (resid   11 and  name HA   )(resid   15 and  name HN   ) 2.0 0.2 3.0
assign (resid   11 and  name HB   )(resid   11 and  name HN   ) 2.0 0.2 1.5
assign (resid   11 and  name HB   )(resid   12 and  name HN   ) 2.0 0.2 1.5
assign (resid   11 and  name HG#  )(resid   11 and  name HN   ) 2.0 0.2 3.9
assign (resid   11 and  name HG1# )(resid   12 and  name HN   ) 2.0 0.2 4.0
assign (resid   11 and  name HG2# )(resid   12 and  name HN   ) 2.0 0.2 4.0
assign (resid   11 and  name HG#  )(resid   13 and  name HN   ) 2.0 0.2 3.9
assign (resid   11 and  name HG#  )(resid   14 and  name HB#  ) 2.0 0.2 5.4
assign (resid   11 and  name HG1# )(resid   14 and  name HN   ) 2.0 0.2 4.0
assign (resid   11 and  name HG2# )(resid   14 and  name HN   ) 2.0 0.2 4.0
assign (resid   11 and  name HN   )(resid   12 and  name HN   ) 2.0 0.2 1.5

!G12
assign (resid   12 and  name HA#  )(resid   13 and  name HN   ) 2.0 0.2 2.5
assign (resid   12 and  name HA#  )(resid   15 and  name HG#  ) 2.0 0.2 6.4
assign (resid   12 and  name HA#  )(resid   15 and  name HN   ) 2.0 0.2 2.5
assign (resid   12 and  name HA#  )(resid   16 and  name HN   ) 2.0 0.2 4.0
assign (resid   12 and  name HN   )(resid   13 and  name HN   ) 2.0 0.2 1.5
assign (resid   12 and  name HA#  )(resid   13 and  name HD#  ) 2.0 0.2 5.0

!K13
assign (resid   13 and  name HA   )(resid   14 and  name HN   ) 2.0 0.2 1.5
assign (resid   13 and  name HA   )(resid   16 and  name HN   ) 2.0 0.2 1.5
assign (resid   13 and  name HA   )(resid   17 and  name HN   ) 2.0 0.2 3.0
assign (resid   13 and  name HB#  )(resid   14 and  name HN   ) 2.0 0.2 2.5
assign (resid   13 and  name HD#  )(resid   14 and  name HN   ) 2.0 0.2 4.0
assign (resid   13 and  name HB#  )(resid   13 and  name HN   ) 2.0 0.2 2.5
assign (resid   13 and  name HD#  )(resid   13 and  name HN   ) 2.0 0.2 2.5
assign (resid   13 and  name HE#  )(resid   13 and  name HN   ) 2.0 0.2 4.0
assign (resid   13 and  name HG#  )(resid   13 and  name HN   ) 2.0 0.2 2.5
assign (resid   13 and  name HN   )(resid   14 and  name HN   ) 2.0 0.2 1.5
assign (resid   13 and  name HN   )(resid   14 and  name HB#  ) 2.0 0.2 4.0

!A14
assign (resid   14 and  name HA   )(resid   15 and  name HN   ) 2.0 0.2 1.5
assign (resid   14 and  name HA   )(resid   16 and  name HN   ) 2.0 0.2 3.0
assign (resid   14 and  name HA   )(resid   17 and  name HN   ) 2.0 0.2 1.5
assign (resid   14 and  name HA   )(resid   18 and  name HN   ) 2.0 0.2 3.0
assign (resid   14 and  name HB#  )(resid   14 and  name HN   ) 2.0 0.2 2.5
assign (resid   14 and  name HB#  )(resid   15 and  name HN   ) 2.0 0.2 3.0
assign (resid   14 and  name HB#  )(resid   17 and  name HN   ) 2.0 0.2 4.5
assign (resid   14 and  name HN   )(resid   15 and  name HN   ) 2.0 0.2 1.5
assign (resid   14 and  name HB#  )(resid   15 and  name HA   ) 2.0 0.2 4.0
assign (resid   14 and  name HB#  )(resid   16 and  name HN   ) 2.0 0.2 4.0

!V15
assign (resid   15 and  name HA   )(resid   16 and  name HN   ) 2.0 0.2 1.5
assign (resid   15 and  name HA   )(resid   18 and  name HN   ) 2.0 0.2 1.5
assign (resid   15 and  name HA   )(resid   19 and  name HN   ) 2.0 0.2 3.0
assign (resid   15 and  name HB   )(resid   15 and  name HN   ) 2.0 0.2 1.5
assign (resid   15 and  name HB   )(resid   16 and  name HN   ) 2.0 0.2 1.5
assign (resid   15 and  name HG1# )(resid   15 and  name HN   ) 2.0 0.2 2.5
assign (resid   15 and  name HG2# )(resid   15 and  name HN   ) 2.0 0.2 2.5
assign (resid   15 and  name HG1# )(resid   16 and  name HN   ) 2.0 0.2 4.0
assign (resid   15 and  name HG2# )(resid   16 and  name HN   ) 2.0 0.2 4.0
assign (resid   15 and  name HG#  )(resid   18 and  name HN   ) 2.0 0.2 5.4
assign (resid   15 and  name HG#  )(resid   19 and  name HN   ) 2.0 0.2 5.4
assign (resid   15 and  name HN   )(resid   16 and  name HN   ) 2.0 0.2 1.5

!G16
assign (resid   16 and  name HA#  )(resid   17 and  name HN   ) 2.0 0.2 2.5
assign (resid   16 and  name HN   )(resid   17 and  name HN   ) 2.0 0.2 1.5
assign (resid   16 and  name HA#  )(resid   19 and  name HN   ) 2.0 0.2 2.5
assign (resid   16 and  name HA#  )(resid   20 and  name HN   ) 2.0 0.2 4.0

!K17
assign (resid   17 and  name HA   )(resid   18 and  name HN   ) 2.0 0.2 1.5
assign (resid   17 and  name HA   )(resid   20 and  name HN   ) 2.0 0.2 1.5
assign (resid   17 and  name HA   )(resid   21 and  name HN   ) 2.0 0.2 3.0
assign (resid   17 and  name HB#  )(resid   17 and  name HN   ) 2.0 0.2 2.5
assign (resid   17 and  name HD#  )(resid   17 and  name HN   ) 2.0 0.2 2.5
assign (resid   17 and  name HG#  )(resid   17 and  name HN   ) 2.0 0.2 2.5
assign (resid   17 and  name HN   )(resid   18 and  name HN   ) 2.0 0.2 1.5
assign (resid   17 and  name HB#  )(resid   18 and  name HN   ) 2.0 0.2 4.0
assign (resid   17 and  name HD#  )(resid   18 and  name HN   ) 2.0 0.2 4.0
assign (resid   17 and  name HG#  )(resid   18 and  name HN   ) 2.0 0.2 4.0

!G18
assign (resid   18 and  name HA#  )(resid   19 and  name HN   ) 2.0 0.2 2.5
assign (resid   18 and  name HA#  )(resid   21 and  name HB#  ) 2.0 0.2 4.0
assign (resid   18 and  name HA#  )(resid   21 and  name HN   ) 2.0 0.2 2.5
assign (resid   18 and  name HA#  )(resid   22 and  name HN   ) 2.0 0.2 4.0
assign (resid   18 and  name HN   )(resid   19 and  name HN   ) 2.0 0.2 1.5
assign (resid   18 and  name HN   )(resid   20 and  name HB#  ) 2.0 0.2 4.0
assign (resid   18 and  name HA#  )(resid   22 and  name HD1# ) 2.0 0.2 5.0
assign (resid   18 and  name HN   )(resid   21 and  name HB#  ) 2.0 0.2 4.5

!L19
assign (resid   19 and  name HA   )(resid   20 and  name HN   ) 2.0 0.2 1.5
assign (resid   19 and  name HA   )(resid   22 and  name HG1# ) 2.0 0.2 4.0
assign (resid   19 and  name HA   )(resid   22 and  name HG2# ) 2.0 0.2 4.0
assign (resid   19 and  name HA   )(resid   22 and  name HD1# ) 2.0 0.2 4.0
assign (resid   19 and  name HA   )(resid   22 and  name HN   ) 2.0 0.2 1.5
assign (resid   19 and  name HA   )(resid   23 and  name HN   ) 2.0 0.2 3.0
assign (resid   19 and  name HB#  )(resid   19 and  name HN   ) 2.0 0.2 2.5
assign (resid   19 and  name HD#  )(resid   19 and  name HN   ) 2.0 0.2 3.9
assign (resid   19 and  name HD#  )(resid   20 and  name HN   ) 2.0 0.2 5.4
assign (resid   19 and  name HG   )(resid   20 and  name HN   ) 2.0 0.2 3.0
assign (resid   19 and  name HG   )(resid   20 and  name HE   ) 2.0 0.2 3.0
assign (resid   19 and  name HN   )(resid   20 and  name HN   ) 2.0 0.2 1.5
assign (resid   19 and  name HD#  )(resid   23 and  name HN   ) 2.0 0.2 5.4
assign (resid   19 and  name HD#  )(resid   23 and  name HD2# ) 2.0 0.2 6.4
assign (resid   19 and  name HD#  )(resid   20 and  name HE   ) 2.0 0.2 5.4
assign (resid   19 and  name HN   )(resid   21 and  name HB#  ) 2.0 0.2 4.0

!R20
assign (resid   20 and  name HA   )(resid   21 and  name HN   ) 2.0 0.2 1.5
assign (resid   20 and  name HA   )(resid   23 and  name HB1  ) 2.0 0.2 1.5
assign (resid   20 and  name HA   )(resid   23 and  name HB2  ) 2.0 0.2 3.0
assign (resid   20 and  name HA   )(resid   23 and  name HD2# ) 2.0 0.2 4.0
assign (resid   20 and  name HA   )(resid   23 and  name HN   ) 2.0 0.2 1.5
assign (resid   20 and  name HA   )(resid   24 and  name HN   ) 2.0 0.2 3.0
assign (resid   20 and  name HB#  )(resid   20 and  name HE   ) 2.0 0.2 4.0
assign (resid   20 and  name HB#  )(resid   20 and  name HN   ) 2.0 0.2 4.0
assign (resid   20 and  name HB#  )(resid   23 and  name HN   ) 2.0 0.2 4.0
assign (resid   20 and  name HB#  )(resid   21 and  name HN   ) 2.0 0.2 2.5
assign (resid   20 and  name HD#  )(resid   23 and  name HN   ) 2.0 0.2 2.5
assign (resid   20 and  name HG#  )(resid   20 and  name HN   ) 2.0 0.2 2.5
assign (resid   20 and  name HG#  )(resid   24 and  name HN   ) 2.0 0.2 4.0
assign (resid   20 and  name HD#  )(resid   24 and  name HN   ) 2.0 0.2 4.0
assign (resid   20 and  name HN   )(resid   21 and  name HN   ) 2.0 0.2 1.5
assign (resid   20 and  name HN   )(resid   21 and  name HB#  ) 2.0 0.2 4.5

!A21
assign (resid   21 and  name HA   )(resid   22 and  name HN   ) 2.0 0.2 1.5
assign (resid   21 and  name HA   )(resid   24 and  name HN   ) 2.0 0.2 1.5
assign (resid   21 and  name HB#  )(resid   21 and  name HN   ) 2.0 0.2 2.5
assign (resid   21 and  name HN   )(resid   22 and  name HN   ) 2.0 0.2 1.5
assign (resid   21 and  name HN   )(resid   22 and  name HB   ) 2.0 0.2 3.0
assign (resid   21 and  name HB#  )(resid   22 and  name HA   ) 2.0 0.2 4.0
assign (resid   21 and  name HB#  )(resid   23 and  name HN   ) 2.0 0.2 4.5
assign (resid   21 and  name HB#  )(resid   24 and  name HN   ) 2.0 0.2 4.5

!I22
assign (resid   22 and  name HA   )(resid   23 and  name HN   ) 2.0 0.2 1.5
assign (resid   22 and  name HA   )(resid   25 and  name HB#  ) 2.0 0.2 2.5
assign (resid   22 and  name HA   )(resid   25 and  name HN   ) 2.0 0.2 1.5
assign (resid   22 and  name HB   )(resid   22 and  name HN   ) 2.0 0.2 1.5
assign (resid   22 and  name HB   )(resid   23 and  name HN   ) 2.0 0.2 1.5
assign (resid   22 and  name HG2# )(resid   22 and  name HN   ) 2.0 0.2 2.5
assign (resid   22 and  name HD1# )(resid   22 and  name HN   ) 2.0 0.2 2.5
assign (resid   22 and  name HG2# )(resid   23 and  name HN   ) 2.0 0.2 2.5
assign (resid   22 and  name HN   )(resid   23 and  name HN   ) 2.0 0.2 1.5
assign (resid   22 and  name HN   )(resid   23 and  name HA   ) 2.0 0.2 3.0


!N23
assign (resid   23 and  name HA   )(resid   24 and  name HN   ) 2.0 0.2 1.5
assign (resid   23 and  name HA   )(resid   25 and  name HN   ) 2.0 0.2 3.0
assign (resid   23 and  name HA   )(resid   26 and  name HN   ) 2.0 0.2 1.5
assign (resid   23 and  name HA   )(resid   27 and  name HN   ) 2.0 0.2 3.0
assign (resid   23 and  name HA   )(resid   24 and  name HG2# ) 2.0 0.2 4.5
assign (resid   23 and  name HA   )(resid   24 and  name HD1# ) 2.0 0.2 4.5
assign (resid   23 and  name HA   )(resid   26 and  name HB#  ) 2.0 0.2 4.0
assign (resid   23 and  name HB#  )(resid   23 and  name HN   ) 2.0 0.2 2.5
assign (resid   23 and  name HB1  )(resid   24 and  name HN   ) 2.0 0.2 1.5
assign (resid   23 and  name HB2  )(resid   24 and  name HN   ) 2.0 0.2 1.5
assign (resid   23 and  name HN   )(resid   24 and  name HN   ) 2.0 0.2 1.5
assign (resid   23 and  name HN   )(resid   24 and  name HD1# ) 2.0 0.2 4.0
assign (resid   23 and  name HB1  )(resid   26 and  name HN   ) 2.0 0.2 3.0
assign (resid   23 and  name HB2  )(resid   26 and  name HN   ) 2.0 0.2 3.0

!I24
assign (resid   24 and  name HA   )(resid   25 and  name HN   ) 2.0 0.2 1.5
assign (resid   24 and  name HA   )(resid   27 and  name HN   ) 2.0 0.2 1.5
assign (resid   24 and  name HA   )(resid   27 and  name HB   ) 2.0 0.2 3.0
assign (resid   24 and  name HA   )(resid   27 and  name HG2# ) 2.0 0.2 4.0
assign (resid   24 and  name HB   )(resid   24 and  name HN   ) 2.0 0.2 1.5
assign (resid   24 and  name HG2# )(resid   24 and  name HN   ) 2.0 0.2 2.5
assign (resid   24 and  name HD1# )(resid   24 and  name HN   ) 2.0 0.2 2.5
assign (resid   24 and  name HD1# )(resid   26 and  name HN   ) 2.0 0.2 4.0
assign (resid   24 and  name HN   )(resid   25 and  name HN   ) 2.0 0.2 1.5
assign (resid   24 and  name HN   )(resid   25 and  name HA   ) 2.0 0.2 3.0
assign (resid   24 and  name HN   )(resid   25 and  name HB#  ) 2.0 0.2 4.5


!A25
assign (resid   25 and  name HA   )(resid   26 and  name HN   ) 2.0 0.2 1.5
assign (resid   25 and  name HA   )(resid   28 and  name HN   ) 2.0 0.2 1.5
assign (resid   25 and  name HA   )(resid   29 and  name HN   ) 2.0 0.2 3.0
assign (resid   25 and  name HB#  )(resid   26 and  name HN   ) 2.0 0.2 2.5
assign (resid   25 and  name HB#  )(resid   25 and  name HN   ) 2.0 0.2 2.5
assign (resid   25 and  name HB#  )(resid   29 and  name HD2# ) 2.0 0.2 5.5
assign (resid   25 and  name HN   )(resid   26 and  name HB#  ) 2.0 0.2 4.0

!S26
assign (resid   26 and  name HA   )(resid   27 and  name HN   ) 2.0 0.2 3.0
assign (resid   26 and  name HB#  )(resid   26 and  name HN   ) 2.0 0.2 2.5
assign (resid   26 and  name HB#  )(resid   27 and  name HN   ) 2.0 0.2 2.5
assign (resid   26 and  name HA   )(resid   29 and  name HB#  ) 2.0 0.2 2.5
assign (resid   26 and  name HA   )(resid   29 and  name HD2# ) 2.0 0.2 2.5
assign (resid   26 and  name HA   )(resid   29 and  name HN   ) 2.0 0.2 1.5

!T27
assign (resid   27 and  name HA   )(resid   28 and  name HN   ) 2.0 0.2 1.5
assign (resid   27 and  name HA   )(resid   29 and  name HN   ) 2.0 0.2 3.0
assign (resid   27 and  name HA   )(resid   30 and  name HB#  ) 2.0 0.2 2.5
assign (resid   27 and  name HA   )(resid   31 and  name HG#  ) 2.0 0.2 5.4
assign (resid   27 and  name HB   )(resid   27 and  name HN   ) 2.0 0.2 1.5
assign (resid   27 and  name HB   )(resid   28 and  name HN   ) 2.0 0.2 1.5
assign (resid   27 and  name HB   )(resid   31 and  name HG#  ) 2.0 0.2 5.4
assign (resid   27 and  name HG2# )(resid   27 and  name HN   ) 2.0 0.2 2.5
assign (resid   27 and  name HG2# )(resid   28 and  name HN   ) 2.0 0.2 4.0
assign (resid   27 and  name HG2# )(resid   31 and  name HN   ) 2.0 0.2 4.0
assign (resid   27 and  name HN   )(resid   28 and  name HN   ) 2.0 0.2 1.5
assign (resid   27 and  name HN   )(resid   28 and  name HB#  ) 2.0 0.2 4.0
assign (resid   27 and  name HG2# )(resid   29 and  name HN   ) 2.0 0.2 4.0
assign (resid   27 and  name HG2# )(resid   30 and  name HB#  ) 2.0 0.2 5.0
assign (resid   27 and  name HG2# )(resid   31 and  name HG#  ) 2.0 0.2 6.4

!A28
assign (resid   28 and  name HA   )(resid   29 and  name HN   ) 2.0 0.2 1.5
assign (resid   28 and  name HA   )(resid   31 and  name HB   ) 2.0 0.2 1.5
assign (resid   28 and  name HA   )(resid   31 and  name HG1# ) 2.0 0.2 2.5
assign (resid   28 and  name HA   )(resid   31 and  name HG2# ) 2.0 0.2 2.5
assign (resid   28 and  name HB#  )(resid   29 and  name HN   ) 2.0 0.2 2.5
assign (resid   28 and  name HB#  )(resid   28 and  name HN   ) 2.0 0.2 2.5
assign (resid   28 and  name HB#  )(resid   31 and  name HG#  ) 2.0 0.2 6.4
assign (resid   28 and  name HN   )(resid   29 and  name HN   ) 2.0 0.2 1.5
assign (resid   28 and  name HA   )(resid   32 and  name HN   ) 2.0 0.2 3.0
assign (resid   28 and  name HA   )(resid   32 and  name HD#  ) 2.0 0.2 5.4
assign (resid   28 and  name HB#  )(resid   29 and  name HA   ) 2.0 0.2 4.0

!N29
assign (resid   29 and  name HA   )(resid   30 and  name HN   ) 2.0 0.2 1.5
assign (resid   29 and  name HA   )(resid   30 and  name HB#  ) 2.0 0.2 4.0
assign (resid   29 and  name HA   )(resid   32 and  name HD#  ) 2.0 0.2 3.9
assign (resid   29 and  name HA   )(resid   32 and  name HN   ) 2.0 0.2 1.5
assign (resid   29 and  name HB#  )(resid   29 and  name HN   ) 2.0 0.2 2.5
assign (resid   29 and  name HB#  )(resid   30 and  name HN   ) 2.0 0.2 4.0
assign (resid   29 and  name HD2# )(resid   29 and  name HN   ) 2.0 0.2 2.5
assign (resid   29 and  name HB#  )(resid   32 and  name HN   ) 2.0 0.2 4.0
assign (resid   29 and  name HD2# )(resid   30 and  name HN   ) 2.0 0.2 4.0

!D30
assign (resid   30 and  name HA   )(resid   31 and  name HN   ) 2.0 0.2 1.5
assign (resid   30 and  name HA   )(resid   31 and  name HG#  ) 2.0 0.2 5.4
assign (resid   30 and  name HA   )(resid   32 and  name HN   ) 2.0 0.2 3.0
assign (resid   30 and  name HA   )(resid   32 and  name HD#  ) 2.0 0.2 5.4
assign (resid   30 and  name HB#  )(resid   30 and  name HN   ) 2.0 0.2 2.5
assign (resid   30 and  name HB#  )(resid   31 and  name HN   ) 2.0 0.2 2.5
assign (resid   30 and  name HB#  )(resid   31 and  name HG#  ) 2.0 0.2 5.4
assign (resid   30 and  name HA   )(resid   33 and  name HB#  ) 2.0 0.2 2.5
assign (resid   30 and  name HA   )(resid   33 and  name HD2# ) 2.0 0.2 4.0
assign (resid   30 and  name HB#  )(resid   33 and  name HN   ) 2.0 0.2 4.0

!V31
assign (resid   31 and  name HA   )(resid   32 and  name HN   ) 2.0 0.2 1.5
assign (resid   31 and  name HA   )(resid   34 and  name HB#  ) 2.0 0.2 2.5
assign (resid   31 and  name HA   )(resid   34 and  name HD#  ) 2.0 0.2 5.4
assign (resid   31 and  name HA   )(resid   34 and  name HN   ) 2.0 0.2 1.5
assign (resid   31 and  name HA   )(resid   35 and  name HN   ) 2.0 0.2 3.0
assign (resid   31 and  name HB   )(resid   31 and  name HN   ) 2.0 0.2 1.5
assign (resid   31 and  name HB   )(resid   32 and  name HN   ) 2.0 0.2 1.5
assign (resid   31 and  name HB   )(resid   33 and  name HN   ) 2.0 0.2 3.0
assign (resid   31 and  name HG#  )(resid   31 and  name HN   ) 2.0 0.2 3.9
assign (resid   31 and  name HG1# )(resid   32 and  name HN   ) 2.0 0.2 2.5
assign (resid   31 and  name HG2# )(resid   32 and  name HN   ) 2.0 0.2 2.5
assign (resid   31 and  name HG#  )(resid   32 and  name HD#  ) 2.0 0.2 7.8
assign (resid   31 and  name HG#  )(resid   33 and  name HN   ) 2.0 0.2 5.4
assign (resid   31 and  name HB   )(resid   32 and  name HB#  ) 2.0 0.2 4.0
assign (resid   31 and  name HN   )(resid   32 and  name HN   ) 2.0 0.2 3.0
assign (resid   31 and  name HB   )(resid   32 and  name HA   ) 2.0 0.2 3.0

!F32
assign (resid   32 and  name HA   )(resid   33 and  name HB#  ) 2.0 0.2 4.0
assign (resid   32 and  name HA   )(resid   33 and  name HN   ) 2.0 0.2 1.5
assign (resid   32 and  name HA   )(resid   34 and  name HN   ) 2.0 0.2 3.0
assign (resid   32 and  name HA   )(resid   35 and  name HD#  ) 2.0 0.2 3.9
assign (resid   32 and  name HA   )(resid   35 and  name HN   ) 2.0 0.2 3.0
assign (resid   32 and  name HB#  )(resid   32 and  name HN   ) 2.0 0.2 2.5
assign (resid   32 and  name HB#  )(resid   33 and  name HN   ) 2.0 0.2 2.5
assign (resid   32 and  name HD#  )(resid   32 and  name HN   ) 2.0 0.2 5.4
assign (resid   32 and  name HD#  )(resid   33 and  name HN   ) 2.0 0.2 5.4
assign (resid   32 and  name HN   )(resid   33 and  name HB#  ) 2.0 0.2 4.0
assign (resid   32 and  name HD#  )(resid   36 and  name HB#  ) 2.0 0.2 6.4
assign (resid   32 and  name HD#  )(resid   36 and  name HG#  ) 2.0 0.2 6.4
assign (resid   32 and  name HD#  )(resid   36 and  name HD#  ) 2.0 0.2 6.4
assign (resid   32 and  name HD#  )(resid   35 and  name HG   ) 2.0 0.2 5.4
assign (resid   32 and  name HE#  )(resid   36 and  name HB#  ) 2.0 0.2 6.4
assign (resid   32 and  name HN   )(resid   33 and  name HN   ) 2.0 0.2 3.0

!N33
assign (resid   33 and  name HA   )(resid   34 and  name HN   ) 2.0 0.2 1.5
assign (resid   33 and  name HA   )(resid   35 and  name HN   ) 2.0 0.2 3.0
assign (resid   33 and  name HB#  )(resid   33 and  name HN   ) 2.0 0.2 2.5
assign (resid   33 and  name HB#  )(resid   34 and  name HN   ) 2.0 0.2 2.5
assign (resid   33 and  name HD2# )(resid   34 and  name HN   ) 2.0 0.2 4.0
assign (resid   33 and  name HA   )(resid   36 and  name HN   ) 2.0 0.2 3.0
assign (resid   33 and  name HA   )(resid   36 and  name HB#  ) 2.0 0.2 2.5
assign (resid   33 and  name HA   )(resid   36 and  name HD#  ) 2.0 0.2 4.0
assign (resid   33 and  name HA   )(resid   36 and  name HE#  ) 2.0 0.2 4.0

!F34
assign (resid   34 and  name HA   )(resid   35 and  name HN   ) 2.0 0.2 1.5
assign (resid   34 and  name HB#  )(resid   34 and  name HN   ) 2.0 0.2 1.5
assign (resid   34 and  name HB#  )(resid   35 and  name HN   ) 2.0 0.2 2.5
assign (resid   34 and  name HD#  )(resid   34 and  name HN   ) 2.0 0.2 5.4
assign (resid   34 and  name HN   )(resid   35 and  name HN   ) 2.0 0.2 1.5
assign (resid   34 and  name HD#  )(resid   35 and  name HA   ) 2.0 0.2 5.4
assign (resid   34 and  name HD#  )(resid   35 and  name HB#  ) 2.0 0.2 6.4
assign (resid   34 and  name HD#  )(resid   35 and  name HD#  ) 2.0 0.2 7.8
assign (resid   34 and  name HN   )(resid   35 and  name HD#  ) 2.0 0.2 5.4
assign (resid   34 and  name HN   )(resid   35 and  name HB#  ) 2.0 0.2 4.0

!L35
assign (resid   35 and  name HA   )(resid   36 and  name HN   ) 2.0 0.2 1.5
assign (resid   35 and  name HB#  )(resid   35 and  name HN   ) 2.0 0.2 2.5
assign (resid   35 and  name HB#  )(resid   36 and  name HN   ) 2.0 0.2 4.0
assign (resid   35 and  name HD#  )(resid   36 and  name HN   ) 2.0 0.2 3.9
assign (resid   35 and  name HD#  )(resid   35 and  name HN   ) 2.0 0.2 3.9
assign (resid   35 and  name HN   )(resid   36 and  name HN   ) 2.0 0.2 1.5
assign (resid   35 and  name HG   )(resid   36 and  name HN   ) 2.0 0.2 3.0

!K36
assign (resid   36 and  name HA   )(resid   37 and  name HB#  ) 2.0 0.2 4.0
assign (resid   36 and  name HA   )(resid   37 and  name HG#  ) 2.0 0.2 4.0
assign (resid   36 and  name HA   )(resid   37 and  name HD#  ) 2.0 0.2 4.0
assign (resid   36 and  name HB#  )(resid   36 and  name HN   ) 2.0 0.2 2.5
assign (resid   36 and  name HG#  )(resid   36 and  name HN   ) 2.0 0.2 2.5
assign (resid   36 and  name HD#  )(resid   36 and  name HN   ) 2.0 0.2 2.5
assign (resid   36 and  name HN   )(resid   37 and  name HD#  ) 2.0 0.2 1.5
assign (resid   36 and  name HB#  )(resid   37 and  name HD#  ) 2.0 0.2 5.0
assign (resid   36 and  name HD#  )(resid   37 and  name HD#  ) 2.0 0.2 5.0

!P37
assign (resid   37 and  name HA   )(resid   38 and  name HN   ) 2.0 0.2 1.5
assign (resid   37 and  name HG#  )(resid   40 and  name HN   ) 2.0 0.2 4.0
assign (resid   37 and  name HD#  )(resid   40 and  name HN   ) 2.0 0.2 4.0

!K38
assign (resid   38 and  name HA   )(resid   39 and  name HN   ) 2.0 0.2 1.5
assign (resid   38 and  name HB#  )(resid   38 and  name HN   ) 2.0 0.2 2.5
assign (resid   38 and  name HG#  )(resid   38 and  name HN   ) 2.0 0.2 2.5
assign (resid   38 and  name HD#  )(resid   38 and  name HN   ) 2.0 0.2 2.5
assign (resid   38 and  name HN   )(resid   39 and  name HN   ) 2.0 0.2 3.0
assign (resid   38 and  name HB#  )(resid   39 and  name HN   ) 2.0 0.2 4.0

!K39
assign (resid   39 and  name HA   )(resid   40 and  name HN   ) 2.0 0.2 3.0
assign (resid   39 and  name HB#  )(resid   39 and  name HN   ) 2.0 0.2 2.5
assign (resid   39 and  name HG#  )(resid   39 and  name HN   ) 2.0 0.2 2.5
assign (resid   39 and  name HD#  )(resid   39 and  name HN   ) 2.0 0.2 2.5
assign (resid   39 and  name HE#  )(resid   39 and  name HN   ) 2.0 0.2 3.0
assign (resid   39 and  name HN   )(resid   40 and  name HN   ) 2.0 0.2 3.0

!R40
assign (resid   40 and  name HA   )(resid   41 and  name HN   ) 2.0 0.2 3.0
assign (resid   40 and  name HB#  )(resid   40 and  name HN   ) 2.0 0.2 2.5
assign (resid   40 and  name HG#  )(resid   40 and  name HN   ) 2.0 0.2 4.0

!K41
assign (resid   41 and  name HA   )(resid   42 and  name HN   ) 2.0 0.2 3.0
assign (resid   41 and  name HN   )(resid   41 and  name HB#  ) 2.0 0.2 2.5
assign (resid   41 and  name HN   )(resid   41 and  name HG#  ) 2.0 0.2 2.5
assign (resid   41 and  name HN   )(resid   41 and  name HD#  ) 2.0 0.2 2.5

!A42
assign (resid   42 and  name HN   )(resid   42 and  name HB#  ) 2.0 0.2 3.0

!H-bond


!I8
assign (resid    8 and  name HN   )(resid    4 and  name O    ) 2.0 0.3 0.4
assign (resid    8 and  name N    )(resid    4 and  name O    ) 3.0 0.3 0.4

!K9
assign (resid    9 and  name HN   )(resid    5 and  name O    ) 2.0 0.3 0.4
assign (resid    9 and  name N    )(resid    5 and  name O    ) 3.0 0.3 0.4


!T10
assign (resid   10 and  name HN   )(resid    6 and  name O    ) 2.0 0.3 0.4
assign (resid   10 and  name N    )(resid    6 and  name O    ) 3.0 0.3 0.4


!V11
assign (resid   11 and  name HN   )(resid    7 and  name O    ) 2.0 0.3 0.4
assign (resid   11 and  name N    )(resid    7 and  name O    ) 3.0 0.3 0.4


!G12
assign (resid   12 and  name HN   )(resid    8 and  name O    ) 2.0 0.3 0.4
assign (resid   12 and  name N    )(resid    8 and  name O    ) 3.0 0.3 0.4


!K13
assign (resid   13 and  name HN   )(resid    9 and  name O    ) 2.0 0.3 0.4
assign (resid   13 and  name N    )(resid    9 and  name O    ) 3.0 0.3 0.4


!A14
assign (resid   14 and  name HN   )(resid   10 and  name O    ) 2.0 0.3 0.4
assign (resid   14 and  name N    )(resid   10 and  name O    ) 3.0 0.3 0.4


!V15
assign (resid   15 and  name HN   )(resid   11 and  name O    ) 2.0 0.3 0.4
assign (resid   15 and  name N    )(resid   11 and  name O    ) 3.0 0.3 0.4


!G16
assign (resid   16 and  name HN   )(resid   12 and  name O    ) 2.0 0.3 0.4
assign (resid   16 and  name N    )(resid   12 and  name O    ) 3.0 0.3 0.4


!K17
assign (resid   17 and  name HN   )(resid   13 and  name O    ) 2.0 0.3 0.4
assign (resid   17 and  name N    )(resid   13 and  name O    ) 3.0 0.3 0.4

!G18
assign (resid   18 and  name HN   )(resid   14 and  name O    ) 2.0 0.3 0.4
assign (resid   18 and  name N    )(resid   14 and  name O    ) 3.0 0.3 0.4


!L19
assign (resid   19 and  name HN   )(resid   15 and  name O    ) 2.0 0.3 0.4
assign (resid   19 and  name N    )(resid   15 and  name O    ) 3.0 0.3 0.4


!R20
assign (resid   20 and  name HN   )(resid   16 and  name O    ) 2.0 0.3 0.4
assign (resid   20 and  name N    )(resid   16 and  name O    ) 3.0 0.3 0.4


!A21
assign (resid   21 and  name HN   )(resid   17 and  name O    ) 2.0 0.3 0.4
assign (resid   21 and  name N    )(resid   17 and  name O    ) 3.0 0.3 0.4


!I22
assign (resid   22 and  name HN   )(resid   18 and  name O    ) 2.0 0.3 0.4
assign (resid   22 and  name N    )(resid   18 and  name O    ) 3.0 0.3 0.4


!N23
assign (resid   23 and  name HN   )(resid   19 and  name O    ) 2.0 0.3 0.4
assign (resid   23 and  name N    )(resid   19 and  name O    ) 3.0 0.3 0.4


!I24
assign (resid   24 and  name HN   )(resid   20 and  name O    ) 2.0 0.3 0.4
assign (resid   24 and  name N    )(resid   20 and  name O    ) 3.0 0.3 0.4


!A25
assign (resid   25 and  name HN   )(resid   21 and  name O    ) 2.0 0.3 0.4
assign (resid   25 and  name N    )(resid   21 and  name O    ) 3.0 0.3 0.4


!S26
assign (resid   26 and  name HN   )(resid   22 and  name O    ) 2.0 0.3 0.4
assign (resid   26 and  name N    )(resid   22 and  name O    ) 3.0 0.3 0.4


!T27
assign (resid   27 and  name HN   )(resid   23 and  name O    ) 2.0 0.3 0.4
assign (resid   27 and  name N    )(resid   23 and  name O    ) 3.0 0.3 0.4


!A28
assign (resid   28 and  name HN   )(resid   24 and  name O    ) 2.0 0.3 0.4
assign (resid   28 and  name N    )(resid   24 and  name O    ) 3.0 0.3 0.4


!F32
assign (resid   32 and  name HN   )(resid   28 and  name O    ) 2.0 0.3 0.4
assign (resid   32 and  name N    )(resid   28 and  name O    ) 3.0 0.3 0.4

!N33
assign (resid   33 and  name HN   )(resid   29 and  name O    ) 2.0 0.3 0.4
assign (resid   33 and  name N    )(resid   29 and  name O    ) 3.0 0.3 0.4


!F34
assign (resid   34 and  name HN   )(resid   30 and  name O    ) 2.0 0.3 0.4
assign (resid   34 and  name N    )(resid   30 and  name O    ) 3.0 0.3 0.4


!L35
assign (resid   35 and  name HN   )(resid   31 and  name O    ) 2.0 0.3 0.4
assign (resid   35 and  name N    )(resid   31 and  name O    ) 3.0 0.3 0.4


set message=on echo=on end

restraints dihedral reset


!I5
assign (resid  4 and name c)(resid  5 and name n)
        (resid  5 and name ca)(resid  5 and name c) 1.0 -60.0 30.0 2 !Phi

!K6
assign (resid  5 and name c)(resid  6 and name n)
        (resid  6 and name ca)(resid  6 and name c) 1.0 -60.0 30.0 2 !Phi

!A7
assign (resid  6 and name c)(resid  7 and name n)
        (resid  7 and name ca)(resid  7 and name c) 1.0 -60.0 30.0 2 !Phi

!I8
assign (resid  7 and name c)(resid  8 and name n)
        (resid  8 and name ca)(resid  8 and name c) 1.0 -60.0 30.0 2 !Phi


!T10
assign (resid  9 and name c)(resid 10 and name n)
        (resid 10 and name ca)(resid 10 and name c) 1.0 -60.0 30.0 2 !Phi

!V11
assign (resid 10 and name c)(resid 11 and name n)
        (resid 11 and name ca)(resid 11 and name c) 1.0 -60.0 30.0 2 !Phi


!K13
assign (resid 12 and name c)(resid 13 and name n)
        (resid 13 and name ca)(resid 13 and name c) 1.0 -60.0 30.0 2 !Phi

!A14
assign (resid 13 and name c)(resid 14 and name n)
        (resid 14 and name ca)(resid 14 and name c) 1.0 -60.0 30.0 2 !Phi

!V15
assign (resid 14 and name c)(resid 15 and name n)
        (resid 15 and name ca)(resid 15 and name c) 1.0 -60.0 30.0 2 !Phi


!K17
assign (resid 16 and name c)(resid 17 and name n)
        (resid 17 and name ca)(resid 17 and name c) 1.0 -60.0 30.0 2 !Phi


!L19
assign (resid 18 and name c)(resid 19 and name n)
        (resid 19 and name ca)(resid 19 and name c) 1.0 -60.0 30.0 2 !Phi


!R20
assign (resid 19 and name c)(resid 20 and name n)
        (resid 20 and name ca)(resid 20 and name c) 1.0 -60.0 30.0 2 !Phi

!A21
assign (resid 20 and name c)(resid 21 and name n)
        (resid 21 and name ca)(resid 21 and name c) 1.0 -60.0 30.0 2 !Phi

!I22
assign (resid 21 and name c)(resid 22 and name n)
        (resid 22 and name ca)(resid 22 and name c) 1.0 -60.0 30.0 2 !Phi

!N23
assign (resid 22 and name c)(resid 23 and name n)
        (resid 23 and name ca)(resid 23 and name c) 1.0 -60.0 30.0 2 !Phi
assign  (resid 23 and name n)(resid 23 and name ca)
        (resid 23 and name cb)(resid 23 and name cg) 1.0 60.0 60.0  2    !Chi 1


!I24
assign (resid 23 and name c)(resid 24 and name n)
        (resid 24 and name ca)(resid 24 and name c) 1.0 -60.0 30.0 2 !Phi

!A25
assign (resid 24 and name c)(resid 25 and name n)
        (resid 25 and name ca)(resid 25 and name c) 1.0 -60.0 30.0 2 !Phi

!S26
assign (resid 25 and name c)(resid 26 and name n)
        (resid 26 and name ca)(resid 26 and name c) 1.0 -60.0 30.0 2 !Phi
assign  (resid 26 and name n)(resid 26 and name ca)
        (resid 26 and name cb)(resid 26 and name og) 1.0  -60.0 60.0  2    !Chi 1


!T27
assign (resid 26 and name c)(resid 27 and name n)
        (resid 27 and name ca)(resid 27 and name c) 1.0 -60.0 30.0 2 !Phi

!A28
assign (resid 27 and name c)(resid 28 and name n)
        (resid 28 and name ca)(resid 28 and name c) 1.0 -60.0 30.0 2 !Phi


!V31
assign (resid 30 and name c)(resid 31 and name n)
        (resid 31 and name ca)(resid 31 and name c) 1.0 -60.0 30.0 2 !Phi

!F32
assign (resid 31 and name c)(resid 32 and name n)
        (resid 32 and name ca)(resid 32 and name c) 1.0 -60.0 30.0 2 !Phi


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ALA   1          1HT       ALA   1 -30.764   6.267   0.475
    2   2H    ALA   1          2HT       ALA   1 -32.451   6.501   0.685
    3   3H    ALA   1          3HT       ALA   1 -31.422   7.849   0.418
    4    HA   ALA   1           HA       ALA   1 -32.853   6.717  -1.450
    5   1HB   ALA   1          1HB       ALA   1 -31.812   8.741  -1.910
    6   2HB   ALA   1          2HB       ALA   1 -31.024   7.625  -3.025
    7   3HB   ALA   1          3HB       ALA   1 -30.206   8.113  -1.541
    8    H    LYS   2           H        LYS   2 -32.425   5.433  -3.350
    9    HA   LYS   2           HA       LYS   2 -31.481   2.885  -2.797
   10   1HB   LYS   2          2HB       LYS   2 -33.048   3.468  -4.635
   11   2HB   LYS   2          1HB       LYS   2 -31.701   4.168  -5.524
   12   1HG   LYS   2          2HG       LYS   2 -32.180   1.954  -6.349
   13   2HG   LYS   2          1HG       LYS   2 -30.603   1.973  -5.558
   14   1HD   LYS   2          2HD       LYS   2 -32.090   1.278  -3.463
   15   2HD   LYS   2          1HD       LYS   2 -33.125   0.645  -4.742
   16   1HE   LYS   2          2HE       LYS   2 -30.591  -0.172  -5.482
   17   2HE   LYS   2          1HE       LYS   2 -30.590  -0.350  -3.728
   18   1HZ   LYS   2          1HZ       LYS   2 -32.552  -1.716  -3.874
   19   2HZ   LYS   2          2HZ       LYS   2 -31.352  -2.357  -4.879
   20   3HZ   LYS   2          3HZ       LYS   2 -32.641  -1.490  -5.549
   21    H    ILE   3           H        ILE   3 -29.408   3.218  -1.827
   22    HA   ILE   3           HA       ILE   3 -27.260   2.740  -3.582
   23    HB   ILE   3           HB       ILE   3 -27.314   5.080  -4.071
   24   1HG1  ILE   3          2HG1      ILE   3 -25.117   5.116  -2.085
   25   2HG1  ILE   3          1HG1      ILE   3 -25.113   3.766  -3.215
   26   1HG2  ILE   3          1HG2      ILE   3 -28.122   5.311  -1.352
   27   2HG2  ILE   3          2HG2      ILE   3 -28.134   6.540  -2.616
   28   3HG2  ILE   3          3HG2      ILE   3 -26.701   6.323  -1.610
   29   1HD1  ILE   3          1HD1      ILE   3 -24.756   6.675  -3.734
   30   2HD1  ILE   3          2HD1      ILE   3 -25.399   5.636  -5.006
   31   3HD1  ILE   3          3HD1      ILE   3 -23.813   5.301  -4.310
   32    HA   PRO   4           HA       PRO   4 -26.491   1.809   0.898
   33   1HB   PRO   4          2HB       PRO   4 -27.494  -0.682   1.110
   34   2HB   PRO   4          1HB       PRO   4 -28.497   0.759   1.297
   35   1HG   PRO   4          2HG       PRO   4 -28.422  -1.187  -0.899
   36   2HG   PRO   4          1HG       PRO   4 -29.692  -0.039  -0.458
   37   1HD   PRO   4          2HD       PRO   4 -27.677   0.206  -2.514
   38   2HD   PRO   4          1HD       PRO   4 -29.017   1.306  -2.143
   39    H    ILE   5           H        ILE   5 -26.578  -1.149  -1.064
   40    HA   ILE   5           HA       ILE   5 -24.202  -2.226  -0.178
   41    HB   ILE   5           HB       ILE   5 -26.016  -3.277  -1.687
   42   1HG1  ILE   5          2HG1      ILE   5 -23.659  -4.176  -0.896
   43   2HG1  ILE   5          1HG1      ILE   5 -24.623  -5.070  -2.067
   44   1HG2  ILE   5          1HG2      ILE   5 -25.846  -1.688  -3.524
   45   2HG2  ILE   5          2HG2      ILE   5 -25.485  -3.323  -4.075
   46   3HG2  ILE   5          3HG2      ILE   5 -24.175  -2.174  -3.806
   47   1HD1  ILE   5          1HD1      ILE   5 -23.164  -4.709  -3.739
   48   2HD1  ILE   5          2HD1      ILE   5 -22.033  -4.501  -2.402
   49   3HD1  ILE   5          3HD1      ILE   5 -22.750  -3.089  -3.178
   50    H    LYS   6           H        LYS   6 -24.754  -0.205  -3.033
   51    HA   LYS   6           HA       LYS   6 -22.024  -0.110  -3.811
   52   1HB   LYS   6          2HB       LYS   6 -24.103   1.975  -4.465
   53   2HB   LYS   6          1HB       LYS   6 -22.688   1.524  -5.407
   54   1HG   LYS   6          2HG       LYS   6 -24.737  -0.561  -4.885
   55   2HG   LYS   6          1HG       LYS   6 -25.111   0.709  -6.051
   56   1HD   LYS   6          2HD       LYS   6 -22.546  -0.042  -6.730
   57   2HD   LYS   6          1HD       LYS   6 -23.310  -1.567  -6.281
   58   1HE   LYS   6          2HE       LYS   6 -24.234  -1.612  -8.303
   59   2HE   LYS   6          1HE       LYS   6 -25.211  -0.226  -7.819
   60   1HZ   LYS   6          1HZ       LYS   6 -22.515   0.377  -8.715
   61   2HZ   LYS   6          2HZ       LYS   6 -23.968   1.183  -9.032
   62   3HZ   LYS   6          3HZ       LYS   6 -23.567  -0.208  -9.906
   63    H    ALA   7           H        ALA   7 -23.862   1.457  -1.400
   64    HA   ALA   7           HA       ALA   7 -22.247   3.812  -1.164
   65   1HB   ALA   7          1HB       ALA   7 -24.575   2.666   0.204
   66   2HB   ALA   7          2HB       ALA   7 -24.203   4.344  -0.190
   67   3HB   ALA   7          3HB       ALA   7 -23.497   3.597   1.243
   68    H    ILE   8           H        ILE   8 -22.540   0.781   0.649
   69    HA   ILE   8           HA       ILE   8 -20.427   1.393   2.461
   70    HB   ILE   8           HB       ILE   8 -22.041  -0.215   3.172
   71   1HG1  ILE   8          2HG1      ILE   8 -19.378  -0.612   3.412
   72   2HG1  ILE   8          1HG1      ILE   8 -20.583  -1.635   4.183
   73   1HG2  ILE   8          1HG2      ILE   8 -21.400  -1.583   0.587
   74   2HG2  ILE   8          2HG2      ILE   8 -22.968  -1.102   1.237
   75   3HG2  ILE   8          3HG2      ILE   8 -22.108  -2.476   1.933
   76   1HD1  ILE   8          1HD1      ILE   8 -18.859  -2.961   3.114
   77   2HD1  ILE   8          2HD1      ILE   8 -19.202  -2.190   1.566
   78   3HD1  ILE   8          3HD1      ILE   8 -20.417  -3.217   2.327
   79    H    LYS   9           H        LYS   9 -20.677  -0.305  -0.596
   80    HA   LYS   9           HA       LYS   9 -18.044  -1.350  -0.620
   81   1HB   LYS   9          2HB       LYS   9 -20.144  -0.891  -2.717
   82   2HB   LYS   9          1HB       LYS   9 -18.528  -1.410  -3.174
   83   1HG   LYS   9          2HG       LYS   9 -20.395  -2.868  -1.317
   84   2HG   LYS   9          1HG       LYS   9 -20.033  -3.303  -2.989
   85   1HD   LYS   9          2HD       LYS   9 -18.146  -4.336  -2.401
   86   2HD   LYS   9          1HD       LYS   9 -17.628  -2.978  -1.401
   87   1HE   LYS   9          2HE       LYS   9 -17.988  -5.196  -0.219
   88   2HE   LYS   9          1HE       LYS   9 -18.783  -3.785   0.478
   89   1HZ   LYS   9          1HZ       LYS   9 -20.820  -4.567  -0.035
   90   2HZ   LYS   9          2HZ       LYS   9 -20.037  -6.065   0.014
   91   3HZ   LYS   9          3HZ       LYS   9 -20.316  -5.308  -1.472
   92    H    THR  10           H        THR  10 -19.493   1.671  -1.686
   93    HA   THR  10           HA       THR  10 -17.275   2.624  -3.156
   94    HB   THR  10           HB       THR  10 -19.646   3.939  -1.866
   95    HG1  THR  10           1HG      THR  10 -20.299   4.149  -3.914
   96   1HG2  THR  10          1HG2      THR  10 -18.723   5.939  -3.381
   97   2HG2  THR  10          2HG2      THR  10 -17.196   5.283  -2.790
   98   3HG2  THR  10          3HG2      THR  10 -18.428   5.815  -1.646
   99    H    VAL  11           H        VAL  11 -18.277   3.061   0.211
  100    HA   VAL  11           HA       VAL  11 -16.052   4.707   0.903
  101    HB   VAL  11           HB       VAL  11 -18.053   3.175   2.553
  102   1HG1  VAL  11          1HG1      VAL  11 -15.587   4.622   3.447
  103   2HG1  VAL  11          2HG1      VAL  11 -16.217   3.061   3.974
  104   3HG1  VAL  11          3HG1      VAL  11 -17.015   4.550   4.479
  105   1HG2  VAL  11          1HG2      VAL  11 -19.238   5.028   2.247
  106   2HG2  VAL  11          2HG2      VAL  11 -17.894   5.800   1.405
  107   3HG2  VAL  11          3HG2      VAL  11 -18.016   5.911   3.161
  108    H    GLY  12           H        GLY  12 -16.759   1.267   1.027
  109   1HA   GLY  12          2HA       GLY  12 -14.499   0.462   2.517
  110   2HA   GLY  12          1HA       GLY  12 -15.411  -0.556   1.408
  111    H    LYS  13           H        LYS  13 -14.974   1.281  -0.836
  112    HA   LYS  13           HA       LYS  13 -12.529   0.172  -1.790
  113   1HB   LYS  13          2HB       LYS  13 -14.301   2.323  -2.961
  114   2HB   LYS  13          1HB       LYS  13 -12.989   1.519  -3.812
  115   1HG   LYS  13          2HG       LYS  13 -14.901  -0.345  -2.661
  116   2HG   LYS  13          1HG       LYS  13 -15.627   0.766  -3.825
  117   1HD   LYS  13          2HD       LYS  13 -13.073  -0.677  -4.439
  118   2HD   LYS  13          1HD       LYS  13 -14.639  -1.452  -4.685
  119   1HE   LYS  13          2HE       LYS  13 -15.300   0.490  -6.100
  120   2HE   LYS  13          1HE       LYS  13 -13.654   1.102  -5.947
  121   1HZ   LYS  13          1HZ       LYS  13 -13.030  -1.232  -6.832
  122   2HZ   LYS  13          2HZ       LYS  13 -13.567  -0.050  -7.916
  123   3HZ   LYS  13          3HZ       LYS  13 -14.624  -1.265  -7.398
  124    H    ALA  14           H        ALA  14 -13.534   3.291  -0.518
  125    HA   ALA  14           HA       ALA  14 -11.176   4.701  -1.227
  126   1HB   ALA  14          1HB       ALA  14 -12.815   5.436   1.161
  127   2HB   ALA  14          2HB       ALA  14 -13.489   5.603  -0.460
  128   3HB   ALA  14          3HB       ALA  14 -12.026   6.481  -0.018
  129    H    VAL  15           H        VAL  15 -12.244   3.398   1.904
  130    HA   VAL  15           HA       VAL  15  -9.801   3.841   3.233
  131    HB   VAL  15           HB       VAL  15 -10.737   1.754   4.632
  132   1HG1  VAL  15          1HG1      VAL  15 -12.211   3.489   5.832
  133   2HG1  VAL  15          2HG1      VAL  15 -11.588   4.625   4.634
  134   3HG1  VAL  15          3HG1      VAL  15 -10.477   3.791   5.721
  135   1HG2  VAL  15          1HG2      VAL  15 -13.313   2.895   3.641
  136   2HG2  VAL  15          2HG2      VAL  15 -13.008   1.371   4.474
  137   3HG2  VAL  15          3HG2      VAL  15 -12.555   1.556   2.779
  138    H    GLY  16           H        GLY  16 -10.940   1.294   1.150
  139   1HA   GLY  16          2HA       GLY  16  -8.975  -0.647   1.823
  140   2HA   GLY  16          1HA       GLY  16  -9.943  -0.620   0.356
  141    H    LYS  17           H        LYS  17  -9.150   1.837  -0.711
  142    HA   LYS  17           HA       LYS  17  -6.564   1.093  -1.762
  143   1HB   LYS  17          2HB       LYS  17  -8.126   3.599  -2.393
  144   2HB   LYS  17          1HB       LYS  17  -6.887   2.828  -3.374
  145   1HG   LYS  17          2HG       LYS  17  -9.132   1.067  -2.796
  146   2HG   LYS  17          1HG       LYS  17  -9.599   2.530  -3.667
  147   1HD   LYS  17          2HD       LYS  17  -7.406   1.855  -5.062
  148   2HD   LYS  17          1HD       LYS  17  -7.922   0.253  -4.531
  149   1HE   LYS  17          2HE       LYS  17  -9.280   2.191  -6.337
  150   2HE   LYS  17          1HE       LYS  17  -9.084   0.446  -6.500
  151   1HZ   LYS  17          1HZ       LYS  17 -11.079   1.954  -4.960
  152   2HZ   LYS  17          2HZ       LYS  17 -10.632   0.412  -4.428
  153   3HZ   LYS  17          3HZ       LYS  17 -11.290   0.615  -5.973
  154    H    GLY  18           H        GLY  18  -7.847   3.342   0.543
  155   1HA   GLY  18          2HA       GLY  18  -5.581   5.090   0.600
  156   2HA   GLY  18          1HA       GLY  18  -6.857   5.000   1.806
  157    H    LEU  19           H        LEU  19  -6.680   2.413   2.658
  158    HA   LEU  19           HA       LEU  19  -4.487   2.527   4.438
  159   1HB   LEU  19          2HB       LEU  19  -6.121   1.302   5.422
  160   2HB   LEU  19          1HB       LEU  19  -6.732   0.700   3.895
  161    HG   LEU  19           HG       LEU  19  -4.636  -0.830   3.911
  162   1HD1  LEU  19          1HD1      LEU  19  -3.295  -0.796   5.674
  163   2HD1  LEU  19          2HD1      LEU  19  -4.658  -1.037   6.767
  164   3HD1  LEU  19          3HD1      LEU  19  -4.191   0.594   6.286
  165   1HD2  LEU  19          1HD2      LEU  19  -7.252  -1.156   4.707
  166   2HD2  LEU  19          2HD2      LEU  19  -6.329  -1.800   6.064
  167   3HD2  LEU  19          3HD2      LEU  19  -6.077  -2.444   4.442
  168    H    ARG  20           H        ARG  20  -5.078   0.797   1.432
  169    HA   ARG  20           HA       ARG  20  -2.730  -0.791   1.586
  170   1HB   ARG  20          2HB       ARG  20  -4.848  -0.291  -0.382
  171   2HB   ARG  20          1HB       ARG  20  -3.278  -0.618  -1.101
  172   1HG   ARG  20          2HG       ARG  20  -5.050  -2.525  -0.438
  173   2HG   ARG  20          1HG       ARG  20  -3.307  -2.786  -0.507
  174   1HD   ARG  20          2HD       ARG  20  -3.083  -2.803   1.779
  175   2HD   ARG  20          1HD       ARG  20  -4.501  -1.791   2.032
  176    HE   ARG  20           HE       ARG  20  -5.861  -3.680   1.906
  177   1HH1  ARG  20          1HH1      ARG  20  -2.520  -4.497   1.319
  178   2HH1  ARG  20          2HH1      ARG  20  -2.766  -6.195   1.543
  179   1HH2  ARG  20          1HH2      ARG  20  -6.187  -5.914   2.202
  180   2HH2  ARG  20          2HH2      ARG  20  -4.848  -7.001   2.043
  181    H    ALA  21           H        ALA  21  -3.506   2.278   0.009
  182    HA   ALA  21           HA       ALA  21  -1.134   2.684  -1.357
  183   1HB   ALA  21          1HB       ALA  21  -3.354   4.286  -0.566
  184   2HB   ALA  21          2HB       ALA  21  -2.175   4.595  -1.841
  185   3HB   ALA  21          3HB       ALA  21  -1.873   5.172  -0.202
  186    H    ILE  22           H        ILE  22  -1.876   3.022   2.055
  187    HA   ILE  22           HA       ILE  22   0.674   4.177   2.714
  188    HB   ILE  22           HB       ILE  22  -1.386   2.864   4.497
  189   1HG1  ILE  22          2HG1      ILE  22  -0.843   5.756   3.795
  190   2HG1  ILE  22          1HG1      ILE  22  -2.304   4.835   3.452
  191   1HG2  ILE  22          1HG2      ILE  22   0.479   2.776   5.813
  192   2HG2  ILE  22          2HG2      ILE  22  -0.079   4.407   6.185
  193   3HG2  ILE  22          3HG2      ILE  22   1.232   4.165   5.031
  194   1HD1  ILE  22          1HD1      ILE  22  -2.661   4.639   5.909
  195   2HD1  ILE  22          2HD1      ILE  22  -2.753   6.283   5.278
  196   3HD1  ILE  22          3HD1      ILE  22  -1.308   5.747   6.134
  197    H    ASN  23           H        ASN  23  -0.654   1.020   2.282
  198    HA   ASN  23           HA       ASN  23   1.374  -0.401   3.715
  199   1HB   ASN  23          2HB       ASN  23   0.197  -2.271   3.196
  200   2HB   ASN  23          1HB       ASN  23  -1.064  -1.094   2.909
  201   1HD2  ASN  23          1HD2      ASN  23   1.539  -2.840   1.283
  202   2HD2  ASN  23          2HD2      ASN  23   0.718  -3.021  -0.226
  203    H    ILE  24           H        ILE  24   0.656   0.014   0.278
  204    HA   ILE  24           HA       ILE  24   2.972  -1.262  -0.661
  205    HB   ILE  24           HB       ILE  24   2.243  -0.801  -2.733
  206   1HG1  ILE  24          2HG1      ILE  24   3.147   1.563  -2.550
  207   2HG1  ILE  24          1HG1      ILE  24   1.809   1.341  -3.670
  208   1HG2  ILE  24          1HG2      ILE  24   0.169  -1.223  -1.373
  209   2HG2  ILE  24          2HG2      ILE  24  -0.076  -0.444  -2.937
  210   3HG2  ILE  24          3HG2      ILE  24  -0.135   0.513  -1.456
  211   1HD1  ILE  24          1HD1      ILE  24   2.013   3.047  -1.367
  212   2HD1  ILE  24          2HD1      ILE  24   0.602   1.993  -1.260
  213   3HD1  ILE  24          3HD1      ILE  24   0.818   3.038  -2.665
  214    H    ALA  25           H        ALA  25   2.384   1.806   0.734
  215    HA   ALA  25           HA       ALA  25   4.900   2.915  -0.154
  216   1HB   ALA  25          1HB       ALA  25   2.497   3.941   1.125
  217   2HB   ALA  25          2HB       ALA  25   3.681   4.771   0.116
  218   3HB   ALA  25          3HB       ALA  25   3.978   4.572   1.843
  219    H    SER  26           H        SER  26   3.592   1.113   2.483
  220    HA   SER  26           HA       SER  26   5.753   1.754   4.308
  221   1HB   SER  26          2HB       SER  26   3.173   0.512   4.501
  222   2HB   SER  26          1HB       SER  26   4.387  -0.582   5.164
  223    HG   SER  26           HG       SER  26   3.779   2.063   5.949
  224    H    THR  27           H        THR  27   4.815  -0.873   2.168
  225    HA   THR  27           HA       THR  27   6.919  -2.635   2.950
  226    HB   THR  27           HB       THR  27   5.405  -2.657   0.335
  227    HG1  THR  27           1HG      THR  27   4.635  -3.974   2.716
  228   1HG2  THR  27          1HG2      THR  27   6.865  -4.362   0.056
  229   2HG2  THR  27          2HG2      THR  27   5.618  -5.216   0.967
  230   3HG2  THR  27          3HG2      THR  27   7.064  -4.627   1.788
  231    H    ALA  28           H        ALA  28   6.496  -0.134   0.540
  232    HA   ALA  28           HA       ALA  28   8.784  -0.693  -1.017
  233   1HB   ALA  28          1HB       ALA  28   6.736   1.281  -0.954
  234   2HB   ALA  28          2HB       ALA  28   7.866   0.907  -2.256
  235   3HB   ALA  28          3HB       ALA  28   8.296   2.101  -1.030
  236    H    ASN  29           H        ASN  29   8.303   0.881   2.033
  237    HA   ASN  29           HA       ASN  29  10.767   2.300   2.120
  238   1HB   ASN  29          2HB       ASN  29   8.611   1.620   4.040
  239   2HB   ASN  29          1HB       ASN  29  10.190   1.982   4.730
  240   1HD2  ASN  29          1HD2      ASN  29   8.381   3.288   1.973
  241   2HD2  ASN  29          2HD2      ASN  29   8.444   4.935   2.494
  242    H    ASP  30           H        ASP  30   9.824  -0.397   4.228
  243    HA   ASP  30           HA       ASP  30  12.323  -1.146   5.059
  244   1HB   ASP  30          2HB       ASP  30   9.709  -2.298   5.107
  245   2HB   ASP  30          1HB       ASP  30  10.859  -3.555   4.661
  246    H    VAL  31           H        VAL  31  10.641  -2.126   2.118
  247    HA   VAL  31           HA       VAL  31  12.574  -3.968   1.200
  248    HB   VAL  31           HB       VAL  31  10.548  -2.322  -0.318
  249   1HG1  VAL  31          1HG1      VAL  31  11.696  -2.856  -2.154
  250   2HG1  VAL  31          2HG1      VAL  31  11.160  -4.513  -1.874
  251   3HG1  VAL  31          3HG1      VAL  31  12.732  -3.982  -1.277
  252   1HG2  VAL  31          1HG2      VAL  31  10.495  -5.270   0.261
  253   2HG2  VAL  31          2HG2      VAL  31   9.180  -4.240  -0.307
  254   3HG2  VAL  31          3HG2      VAL  31   9.779  -4.076   1.344
  255    H    PHE  32           H        PHE  32  12.011  -0.553   0.479
  256    HA   PHE  32           HA       PHE  32  14.010  -0.101  -1.369
  257   1HB   PHE  32          2HB       PHE  32  12.475   1.654  -0.951
  258   2HB   PHE  32          1HB       PHE  32  12.836   1.666   0.771
  259    HD1  PHE  32           1HD      PHE  32  14.243   2.454  -2.562
  260    HD2  PHE  32           2HD      PHE  32  14.499   3.058   1.643
  261    HE1  PHE  32           1HE      PHE  32  15.880   4.256  -2.924
  262    HE2  PHE  32           2HE      PHE  32  16.135   4.859   1.289
  263    HZ   PHE  32           HZ       PHE  32  16.828   5.461  -0.997
  264    H    ASN  33           H        ASN  33  14.286  -0.797   1.984
  265    HA   ASN  33           HA       ASN  33  17.128  -0.039   1.971
  266   1HB   ASN  33          2HB       ASN  33  15.358   0.729   3.791
  267   2HB   ASN  33          1HB       ASN  33  15.727  -0.849   4.480
  268   1HD2  ASN  33          1HD2      ASN  33  17.152  -0.697   6.038
  269   2HD2  ASN  33          2HD2      ASN  33  18.519   0.358   6.077
  270    H    PHE  34           H        PHE  34  15.074  -2.673   1.685
  271    HA   PHE  34           HA       PHE  34  16.612  -4.644   3.062
  272   1HB   PHE  34          2HB       PHE  34  14.390  -5.272   2.758
  273   2HB   PHE  34          1HB       PHE  34  14.354  -4.706   1.092
  274    HD1  PHE  34           1HD      PHE  34  15.675  -7.372   3.297
  275    HD2  PHE  34           2HD      PHE  34  14.772  -6.170  -0.685
  276    HE1  PHE  34           1HE      PHE  34  16.066  -9.674   2.517
  277    HE2  PHE  34           2HE      PHE  34  15.161  -8.469  -1.471
  278    HZ   PHE  34           HZ       PHE  34  15.807 -10.224   0.131
  279    H    LEU  35           H        LEU  35  16.592  -3.339  -0.188
  280    HA   LEU  35           HA       LEU  35  18.515  -5.325  -1.105
  281   1HB   LEU  35          2HB       LEU  35  18.238  -4.399  -3.283
  282   2HB   LEU  35          1HB       LEU  35  16.647  -4.563  -2.566
  283    HG   LEU  35           HG       LEU  35  17.652  -1.938  -2.009
  284   1HD1  LEU  35          1HD1      LEU  35  18.404  -2.989  -4.591
  285   2HD1  LEU  35          2HD1      LEU  35  18.811  -1.447  -3.839
  286   3HD1  LEU  35          3HD1      LEU  35  17.308  -1.615  -4.746
  287   1HD2  LEU  35          1HD2      LEU  35  15.597  -1.258  -3.062
  288   2HD2  LEU  35          2HD2      LEU  35  15.288  -2.683  -2.069
  289   3HD2  LEU  35          3HD2      LEU  35  15.417  -2.840  -3.821
  290    H    LYS  36           H        LYS  36  19.319  -3.557   1.007
  291    HA   LYS  36           HA       LYS  36  21.467  -2.075  -0.358
  292   1HB   LYS  36          2HB       LYS  36  19.553  -1.175   1.587
  293   2HB   LYS  36          1HB       LYS  36  21.172  -1.065   2.265
  294   1HG   LYS  36          2HG       LYS  36  21.365   0.874   1.214
  295   2HG   LYS  36          1HG       LYS  36  21.442  -0.042  -0.293
  296   1HD   LYS  36          2HD       LYS  36  19.118   0.220  -0.677
  297   2HD   LYS  36          1HD       LYS  36  18.845   0.816   0.962
  298   1HE   LYS  36          2HE       LYS  36  18.781   2.732  -0.386
  299   2HE   LYS  36          1HE       LYS  36  20.389   2.745   0.338
  300   1HZ   LYS  36          1HZ       LYS  36  19.743   1.776  -2.395
  301   2HZ   LYS  36          2HZ       LYS  36  21.284   1.822  -1.700
  302   3HZ   LYS  36          3HZ       LYS  36  20.461   3.263  -2.024
  303    HA   PRO  37           HA       PRO  37  23.256  -5.655   2.087
  304   1HB   PRO  37          2HB       PRO  37  25.385  -5.786   0.294
  305   2HB   PRO  37          1HB       PRO  37  23.939  -6.796   0.246
  306   1HG   PRO  37          2HG       PRO  37  24.575  -4.323  -1.303
  307   2HG   PRO  37          1HG       PRO  37  23.737  -5.795  -1.830
  308   1HD   PRO  37          2HD       PRO  37  22.380  -3.562  -1.276
  309   2HD   PRO  37          1HD       PRO  37  21.733  -5.157  -0.833
  310    H    LYS  38           H        LYS  38  25.666  -5.840   2.740
  311    HA   LYS  38           HA       LYS  38  26.378  -3.453   4.092
  312   1HB   LYS  38          2HB       LYS  38  27.865  -6.048   3.679
  313   2HB   LYS  38          1HB       LYS  38  28.471  -4.738   4.682
  314   1HG   LYS  38          2HG       LYS  38  27.335  -5.558   6.389
  315   2HG   LYS  38          1HG       LYS  38  25.831  -5.240   5.520
  316   1HD   LYS  38          2HD       LYS  38  25.823  -7.546   6.101
  317   2HD   LYS  38          1HD       LYS  38  26.152  -7.455   4.369
  318   1HE   LYS  38          2HE       LYS  38  28.322  -8.141   4.606
  319   2HE   LYS  38          1HE       LYS  38  28.463  -7.492   6.239
  320   1HZ   LYS  38          1HZ       LYS  38  26.561  -9.465   6.405
  321   2HZ   LYS  38          2HZ       LYS  38  28.161  -9.557   6.948
  322   3HZ   LYS  38          3HZ       LYS  38  27.759 -10.117   5.404
  323    H    LYS  39           H        LYS  39  26.923  -4.477   0.930
  324    HA   LYS  39           HA       LYS  39  29.383  -3.842   0.116
  325   1HB   LYS  39          2HB       LYS  39  26.931  -2.654  -1.191
  326   2HB   LYS  39          1HB       LYS  39  28.476  -2.985  -1.961
  327   1HG   LYS  39          2HG       LYS  39  28.083  -5.420  -1.375
  328   2HG   LYS  39          1HG       LYS  39  26.427  -4.947  -0.988
  329   1HD   LYS  39          2HD       LYS  39  26.233  -4.000  -3.283
  330   2HD   LYS  39          1HD       LYS  39  27.827  -4.665  -3.643
  331   1HE   LYS  39          2HE       LYS  39  27.034  -6.749  -3.874
  332   2HE   LYS  39          1HE       LYS  39  25.967  -6.598  -2.480
  333   1HZ   LYS  39          1HZ       LYS  39  24.325  -5.555  -3.789
  334   2HZ   LYS  39          2HZ       LYS  39  24.843  -6.893  -4.684
  335   3HZ   LYS  39          3HZ       LYS  39  25.376  -5.342  -5.098
  336    H    ARG  40           H        ARG  40  26.988  -1.217   0.010
  337    HA   ARG  40           HA       ARG  40  27.106   0.961   0.684
  338   1HB   ARG  40          2HB       ARG  40  28.135   1.153   2.655
  339   2HB   ARG  40          1HB       ARG  40  29.020  -0.332   2.357
  340   1HG   ARG  40          2HG       ARG  40  30.847   0.852   1.401
  341   2HG   ARG  40          1HG       ARG  40  29.929   2.359   1.365
  342   1HD   ARG  40          2HD       ARG  40  30.858   2.830   3.335
  343   2HD   ARG  40          1HD       ARG  40  29.818   1.580   4.015
  344    HE   ARG  40           HE       ARG  40  31.939   0.160   3.182
  345   1HH1  ARG  40          1HH1      ARG  40  31.677   3.077   5.067
  346   2HH1  ARG  40          2HH1      ARG  40  33.111   2.766   5.988
  347   1HH2  ARG  40          1HH2      ARG  40  33.827  -0.263   4.394
  348   2HH2  ARG  40          2HH2      ARG  40  34.331   0.866   5.607
  349    H    LYS  41           H        LYS  41  30.369  -0.134  -0.262
  350    HA   LYS  41           HA       LYS  41  30.909   2.250  -1.739
  351   1HB   LYS  41          2HB       LYS  41  32.334  -0.159  -0.975
  352   2HB   LYS  41          1HB       LYS  41  32.670   0.281  -2.643
  353   1HG   LYS  41          2HG       LYS  41  34.265   1.549  -1.706
  354   2HG   LYS  41          1HG       LYS  41  32.936   2.684  -1.466
  355   1HD   LYS  41          2HD       LYS  41  32.576   1.477   0.772
  356   2HD   LYS  41          1HD       LYS  41  34.187   0.804   0.513
  357   1HE   LYS  41          2HE       LYS  41  33.519   3.746   0.559
  358   2HE   LYS  41          1HE       LYS  41  34.207   2.841   1.908
  359   1HZ   LYS  41          1HZ       LYS  41  35.738   4.157   0.293
  360   2HZ   LYS  41          2HZ       LYS  41  35.576   2.789  -0.689
  361   3HZ   LYS  41          3HZ       LYS  41  36.220   2.639   0.867
  362    H    ALA  42           H        ALA  42  30.043   2.740  -3.635
  363    HA   ALA  42           HA       ALA  42  29.106   2.569  -5.703
  364   1HB   ALA  42          1HB       ALA  42  30.079   0.851  -7.206
  365   2HB   ALA  42          2HB       ALA  42  30.923   0.167  -5.816
  366   3HB   ALA  42          3HB       ALA  42  31.289   1.807  -6.351
  Start of MODEL    2
    1   1H    ALA   1          1HT       ALA   1  30.761  -7.365   2.655
    2   2H    ALA   1          2HT       ALA   1  29.137  -7.894   2.819
    3   3H    ALA   1          3HT       ALA   1  29.751  -6.670   3.853
    4    HA   ALA   1           HA       ALA   1  29.758  -5.100   2.246
    5   1HB   ALA   1          1HB       ALA   1  30.564  -7.208   0.602
    6   2HB   ALA   1          2HB       ALA   1  30.433  -5.504   0.169
    7   3HB   ALA   1          3HB       ALA   1  29.076  -6.592  -0.119
    8    H    LYS   2           H        LYS   2  27.826  -4.971   3.636
    9    HA   LYS   2           HA       LYS   2  25.446  -4.956   2.011
   10   1HB   LYS   2          2HB       LYS   2  24.528  -6.205   4.359
   11   2HB   LYS   2          1HB       LYS   2  24.556  -6.871   2.732
   12   1HG   LYS   2          2HG       LYS   2  25.622  -8.392   4.266
   13   2HG   LYS   2          1HG       LYS   2  26.817  -7.738   3.144
   14   1HD   LYS   2          2HD       LYS   2  27.912  -6.591   4.767
   15   2HD   LYS   2          1HD       LYS   2  26.438  -6.265   5.681
   16   1HE   LYS   2          2HE       LYS   2  28.173  -7.856   6.706
   17   2HE   LYS   2          1HE       LYS   2  26.480  -8.348   6.725
   18   1HZ   LYS   2          1HZ       LYS   2  26.862  -9.763   4.848
   19   2HZ   LYS   2          2HZ       LYS   2  28.011 -10.131   6.032
   20   3HZ   LYS   2          3HZ       LYS   2  28.454  -9.213   4.682
   21    H    ILE   3           H        ILE   3  26.527  -2.732   2.803
   22    HA   ILE   3           HA       ILE   3  24.801  -1.844   4.995
   23    HB   ILE   3           HB       ILE   3  27.673  -0.952   4.785
   24   1HG1  ILE   3          2HG1      ILE   3  27.327  -3.363   5.496
   25   2HG1  ILE   3          1HG1      ILE   3  28.175  -2.339   6.651
   26   1HG2  ILE   3          1HG2      ILE   3  26.949  -0.249   7.230
   27   2HG2  ILE   3          2HG2      ILE   3  25.359  -0.193   6.469
   28   3HG2  ILE   3          3HG2      ILE   3  26.675   0.794   5.835
   29   1HD1  ILE   3          1HD1      ILE   3  26.581  -3.755   7.782
   30   2HD1  ILE   3          2HD1      ILE   3  25.276  -3.136   6.769
   31   3HD1  ILE   3          3HD1      ILE   3  26.091  -2.067   7.911
   32    HA   PRO   4           HA       PRO   4  25.433   1.862   2.170
   33   1HB   PRO   4          2HB       PRO   4  27.543   2.015   0.490
   34   2HB   PRO   4          1HB       PRO   4  27.685   2.339   2.220
   35   1HG   PRO   4          2HG       PRO   4  28.719   0.088   0.676
   36   2HG   PRO   4          1HG       PRO   4  29.126   0.596   2.322
   37   1HD   PRO   4          2HD       PRO   4  27.281  -1.491   1.433
   38   2HD   PRO   4          1HD       PRO   4  27.926  -1.184   3.054
   39    H    ILE   5           H        ILE   5  27.114   0.021  -0.323
   40    HA   ILE   5           HA       ILE   5  25.629   0.644  -2.479
   41    HB   ILE   5           HB       ILE   5  25.998  -1.983  -3.029
   42   1HG1  ILE   5          2HG1      ILE   5  28.359  -1.436  -1.287
   43   2HG1  ILE   5          1HG1      ILE   5  26.884  -2.026  -0.528
   44   1HG2  ILE   5          1HG2      ILE   5  28.535  -0.860  -3.343
   45   2HG2  ILE   5          2HG2      ILE   5  27.400   0.485  -3.451
   46   3HG2  ILE   5          3HG2      ILE   5  27.226  -0.903  -4.524
   47   1HD1  ILE   5          1HD1      ILE   5  28.551  -3.378  -2.625
   48   2HD1  ILE   5          2HD1      ILE   5  26.936  -3.925  -2.174
   49   3HD1  ILE   5          3HD1      ILE   5  28.228  -3.909  -0.975
   50    H    LYS   6           H        LYS   6  25.029  -2.310  -0.620
   51    HA   LYS   6           HA       LYS   6  22.582  -2.971  -1.762
   52   1HB   LYS   6          2HB       LYS   6  24.214  -3.978   0.278
   53   2HB   LYS   6          1HB       LYS   6  22.664  -3.669   1.048
   54   1HG   LYS   6          2HG       LYS   6  21.531  -5.108  -0.459
   55   2HG   LYS   6          1HG       LYS   6  22.953  -5.244  -1.496
   56   1HD   LYS   6          2HD       LYS   6  23.790  -6.906  -0.266
   57   2HD   LYS   6          1HD       LYS   6  23.539  -6.011   1.234
   58   1HE   LYS   6          2HE       LYS   6  21.123  -6.676   1.115
   59   2HE   LYS   6          1HE       LYS   6  21.547  -7.730  -0.233
   60   1HZ   LYS   6          1HZ       LYS   6  21.713  -8.292   2.482
   61   2HZ   LYS   6          2HZ       LYS   6  23.304  -8.203   1.916
   62   3HZ   LYS   6          3HZ       LYS   6  22.209  -9.269   1.192
   63    H    ALA   7           H        ALA   7  23.379  -0.529   0.532
   64    HA   ALA   7           HA       ALA   7  20.778  -0.223   1.662
   65   1HB   ALA   7          1HB       ALA   7  21.953   0.993   3.098
   66   2HB   ALA   7          2HB       ALA   7  22.200   2.213   1.849
   67   3HB   ALA   7          3HB       ALA   7  23.364   0.905   2.046
   68    H    ILE   8           H        ILE   8  22.554   1.367  -0.949
   69    HA   ILE   8           HA       ILE   8  20.560   3.303  -1.504
   70    HB   ILE   8           HB       ILE   8  22.905   3.562  -2.221
   71   1HG1  ILE   8          2HG1      ILE   8  21.563   3.606  -4.833
   72   2HG1  ILE   8          1HG1      ILE   8  20.636   4.358  -3.538
   73   1HG2  ILE   8          1HG2      ILE   8  23.114   2.242  -4.616
   74   2HG2  ILE   8          2HG2      ILE   8  22.342   1.046  -3.577
   75   3HG2  ILE   8          3HG2      ILE   8  23.882   1.761  -3.104
   76   1HD1  ILE   8          1HD1      ILE   8  23.341   5.108  -4.578
   77   2HD1  ILE   8          2HD1      ILE   8  22.755   5.664  -3.010
   78   3HD1  ILE   8          3HD1      ILE   8  21.880   6.091  -4.481
   79    H    LYS   9           H        LYS   9  21.109   0.022  -2.610
   80    HA   LYS   9           HA       LYS   9  19.139   0.171  -4.700
   81   1HB   LYS   9          2HB       LYS   9  20.090  -2.410  -3.503
   82   2HB   LYS   9          1HB       LYS   9  19.657  -2.055  -5.169
   83   1HG   LYS   9          2HG       LYS   9  21.705  -0.604  -5.284
   84   2HG   LYS   9          1HG       LYS   9  22.158  -1.260  -3.710
   85   1HD   LYS   9          2HD       LYS   9  21.646  -2.899  -6.189
   86   2HD   LYS   9          1HD       LYS   9  23.240  -2.446  -5.584
   87   1HE   LYS   9          2HE       LYS   9  23.234  -4.199  -4.225
   88   2HE   LYS   9          1HE       LYS   9  21.773  -3.597  -3.442
   89   1HZ   LYS   9          1HZ       LYS   9  22.007  -5.883  -4.944
   90   2HZ   LYS   9          2HZ       LYS   9  21.183  -4.802  -5.950
   91   3HZ   LYS   9          3HZ       LYS   9  20.568  -5.165  -4.417
   92    H    THR  10           H        THR  10  19.317  -1.089  -1.414
   93    HA   THR  10           HA       THR  10  16.738  -2.227  -1.331
   94    HB   THR  10           HB       THR  10  18.505  -1.171   0.881
   95    HG1  THR  10           1HG      THR  10  18.663  -3.575   1.144
   96   1HG2  THR  10          1HG2      THR  10  17.217  -2.364   2.459
   97   2HG2  THR  10          2HG2      THR  10  16.211  -3.079   1.199
   98   3HG2  THR  10          3HG2      THR  10  16.100  -1.353   1.545
   99    H    VAL  11           H        VAL  11  17.936   1.027  -0.809
  100    HA   VAL  11           HA       VAL  11  15.590   2.061   0.413
  101    HB   VAL  11           HB       VAL  11  17.934   3.339  -0.968
  102   1HG1  VAL  11          1HG1      VAL  11  15.309   4.531  -0.501
  103   2HG1  VAL  11          2HG1      VAL  11  16.651   5.097  -1.496
  104   3HG1  VAL  11          3HG1      VAL  11  16.633   5.432   0.236
  105   1HG2  VAL  11          1HG2      VAL  11  18.746   3.139   1.095
  106   2HG2  VAL  11          2HG2      VAL  11  17.173   2.671   1.741
  107   3HG2  VAL  11          3HG2      VAL  11  17.588   4.378   1.581
  108    H    GLY  12           H        GLY  12  16.757   1.971  -2.925
  109   1HA   GLY  12          2HA       GLY  12  14.697   3.462  -4.106
  110   2HA   GLY  12          1HA       GLY  12  15.663   2.243  -4.926
  111    H    LYS  13           H        LYS  13  14.833   0.111  -3.116
  112    HA   LYS  13           HA       LYS  13  12.393  -0.600  -4.479
  113   1HB   LYS  13          2HB       LYS  13  13.196  -2.384  -2.315
  114   2HB   LYS  13          1HB       LYS  13  12.976  -2.723  -4.026
  115   1HG   LYS  13          2HG       LYS  13  15.233  -1.678  -4.409
  116   2HG   LYS  13          1HG       LYS  13  15.431  -1.669  -2.655
  117   1HD   LYS  13          2HD       LYS  13  15.783  -3.889  -2.558
  118   2HD   LYS  13          1HD       LYS  13  14.566  -4.236  -3.789
  119   1HE   LYS  13          2HE       LYS  13  16.058  -3.980  -5.526
  120   2HE   LYS  13          1HE       LYS  13  17.122  -2.928  -4.594
  121   1HZ   LYS  13          1HZ       LYS  13  18.333  -4.666  -3.995
  122   2HZ   LYS  13          2HZ       LYS  13  17.416  -5.639  -5.031
  123   3HZ   LYS  13          3HZ       LYS  13  16.980  -5.492  -3.403
  124    H    ALA  14           H        ALA  14  13.329   0.538  -1.325
  125    HA   ALA  14           HA       ALA  14  10.871  -0.145  -0.025
  126   1HB   ALA  14          1HB       ALA  14  12.123   0.266   1.762
  127   2HB   ALA  14          2HB       ALA  14  12.138   1.980   1.347
  128   3HB   ALA  14          3HB       ALA  14  13.403   0.914   0.737
  129    H    VAL  15           H        VAL  15  12.098   2.643  -1.757
  130    HA   VAL  15           HA       VAL  15   9.991   4.403  -0.956
  131    HB   VAL  15           HB       VAL  15  12.017   4.552  -3.186
  132   1HG1  VAL  15          1HG1      VAL  15  11.268   6.852  -3.575
  133   2HG1  VAL  15          2HG1      VAL  15   9.949   6.615  -2.429
  134   3HG1  VAL  15          3HG1      VAL  15   9.992   5.687  -3.928
  135   1HG2  VAL  15          1HG2      VAL  15  13.194   5.036  -1.290
  136   2HG2  VAL  15          2HG2      VAL  15  11.780   5.654  -0.436
  137   3HG2  VAL  15          3HG2      VAL  15  12.570   6.643  -1.663
  138    H    GLY  16           H        GLY  16  10.616   2.332  -3.742
  139   1HA   GLY  16          2HA       GLY  16   8.349   3.148  -5.249
  140   2HA   GLY  16          1HA       GLY  16   9.270   1.670  -5.485
  141    H    LYS  17           H        LYS  17   8.884   0.601  -2.861
  142    HA   LYS  17           HA       LYS  17   6.230  -0.483  -3.237
  143   1HB   LYS  17          2HB       LYS  17   8.668  -1.318  -1.955
  144   2HB   LYS  17          1HB       LYS  17   7.324  -1.459  -0.829
  145   1HG   LYS  17          2HG       LYS  17   7.771  -3.517  -2.137
  146   2HG   LYS  17          1HG       LYS  17   6.131  -2.890  -2.326
  147   1HD   LYS  17          2HD       LYS  17   7.938  -1.767  -4.290
  148   2HD   LYS  17          1HD       LYS  17   7.919  -3.531  -4.359
  149   1HE   LYS  17          2HE       LYS  17   5.355  -1.993  -4.217
  150   2HE   LYS  17          1HE       LYS  17   6.201  -2.170  -5.755
  151   1HZ   LYS  17          1HZ       LYS  17   4.714  -4.125  -4.231
  152   2HZ   LYS  17          2HZ       LYS  17   6.188  -4.692  -4.838
  153   3HZ   LYS  17          3HZ       LYS  17   5.029  -4.056  -5.892
  154    H    GLY  18           H        GLY  18   7.925   1.546  -0.910
  155   1HA   GLY  18          2HA       GLY  18   5.959   1.647   1.083
  156   2HA   GLY  18          1HA       GLY  18   7.140   2.910   0.761
  157    H    LEU  19           H        LEU  19   6.314   3.455  -1.910
  158    HA   LEU  19           HA       LEU  19   4.199   5.290  -1.381
  159   1HB   LEU  19          2HB       LEU  19   6.009   5.785  -2.962
  160   2HB   LEU  19          1HB       LEU  19   5.476   4.470  -3.992
  161    HG   LEU  19           HG       LEU  19   4.797   6.677  -4.845
  162   1HD1  LEU  19          1HD1      LEU  19   2.258   5.368  -4.027
  163   2HD1  LEU  19          2HD1      LEU  19   3.411   4.460  -5.005
  164   3HD1  LEU  19          3HD1      LEU  19   2.758   5.986  -5.602
  165   1HD2  LEU  19          1HD2      LEU  19   3.985   8.249  -3.509
  166   2HD2  LEU  19          2HD2      LEU  19   4.126   7.139  -2.146
  167   3HD2  LEU  19          3HD2      LEU  19   2.628   7.210  -3.073
  168    H    ARG  20           H        ARG  20   4.462   2.539  -3.621
  169    HA   ARG  20           HA       ARG  20   1.781   2.525  -4.381
  170   1HB   ARG  20          2HB       ARG  20   3.736   1.274  -5.455
  171   2HB   ARG  20          1HB       ARG  20   3.480   0.041  -4.228
  172   1HG   ARG  20          2HG       ARG  20   2.369  -0.133  -6.604
  173   2HG   ARG  20          1HG       ARG  20   1.525  -0.678  -5.153
  174   1HD   ARG  20          2HD       ARG  20   0.019   0.636  -6.504
  175   2HD   ARG  20          1HD       ARG  20   0.398   1.519  -5.028
  176    HE   ARG  20           HE       ARG  20   1.521   3.106  -6.281
  177   1HH1  ARG  20          1HH1      ARG  20   0.647   0.381  -8.268
  178   2HH1  ARG  20          2HH1      ARG  20   1.015   1.183  -9.758
  179   1HH2  ARG  20          1HH2      ARG  20   2.004   4.174  -8.238
  180   2HH2  ARG  20          2HH2      ARG  20   1.784   3.342  -9.741
  181    H    ALA  21           H        ALA  21   3.327   1.350  -1.521
  182    HA   ALA  21           HA       ALA  21   1.220  -0.423  -0.743
  183   1HB   ALA  21          1HB       ALA  21   3.612  -0.572   0.045
  184   2HB   ALA  21          2HB       ALA  21   2.389  -0.690   1.310
  185   3HB   ALA  21          3HB       ALA  21   3.275   0.818   1.078
  186    H    ILE  22           H        ILE  22   1.966   2.962  -0.263
  187    HA   ILE  22           HA       ILE  22   0.013   3.398   1.775
  188    HB   ILE  22           HB       ILE  22   1.419   5.293  -0.111
  189   1HG1  ILE  22          2HG1      ILE  22   1.686   5.295   2.869
  190   2HG1  ILE  22          1HG1      ILE  22   2.521   4.051   1.943
  191   1HG2  ILE  22          1HG2      ILE  22  -0.466   6.531   0.261
  192   2HG2  ILE  22          2HG2      ILE  22   0.485   6.991   1.672
  193   3HG2  ILE  22          3HG2      ILE  22  -0.787   5.779   1.823
  194   1HD1  ILE  22          1HD1      ILE  22   3.584   6.437   2.550
  195   2HD1  ILE  22          2HD1      ILE  22   2.870   6.809   0.981
  196   3HD1  ILE  22          3HD1      ILE  22   4.037   5.495   1.129
  197    H    ASN  23           H        ASN  23  -0.027   3.018  -1.625
  198    HA   ASN  23           HA       ASN  23  -2.450   4.417  -2.165
  199   1HB   ASN  23          2HB       ASN  23  -1.731   4.083  -4.244
  200   2HB   ASN  23          1HB       ASN  23  -0.442   3.077  -3.631
  201   1HD2  ASN  23          1HD2      ASN  23  -3.752   3.067  -4.796
  202   2HD2  ASN  23          2HD2      ASN  23  -3.750   1.431  -5.350
  203    H    ILE  24           H        ILE  24  -1.753   0.939  -2.245
  204    HA   ILE  24           HA       ILE  24  -4.403   0.102  -2.283
  205    HB   ILE  24           HB       ILE  24  -3.664  -2.041  -2.045
  206   1HG1  ILE  24          2HG1      ILE  24  -2.886  -1.576   0.385
  207   2HG1  ILE  24          1HG1      ILE  24  -2.137  -2.900  -0.494
  208   1HG2  ILE  24          1HG2      ILE  24  -1.540  -2.325  -3.087
  209   2HG2  ILE  24          2HG2      ILE  24  -1.006  -0.731  -2.557
  210   3HG2  ILE  24          3HG2      ILE  24  -2.292  -0.877  -3.755
  211   1HD1  ILE  24          1HD1      ILE  24  -0.126  -1.917  -0.532
  212   2HD1  ILE  24          2HD1      ILE  24  -0.765  -1.054   0.867
  213   3HD1  ILE  24          3HD1      ILE  24  -0.796  -0.297  -0.726
  214    H    ALA  25           H        ALA  25  -2.483   1.439   0.190
  215    HA   ALA  25           HA       ALA  25  -4.153   0.498   2.332
  216   1HB   ALA  25          1HB       ALA  25  -1.600   1.077   2.391
  217   2HB   ALA  25          2HB       ALA  25  -2.622   1.412   3.789
  218   3HB   ALA  25          3HB       ALA  25  -2.189   2.714   2.680
  219    H    SER  26           H        SER  26  -3.900   3.236   0.210
  220    HA   SER  26           HA       SER  26  -5.707   4.834   1.856
  221   1HB   SER  26          2HB       SER  26  -3.751   5.414  -0.140
  222   2HB   SER  26          1HB       SER  26  -5.308   6.013  -0.713
  223    HG   SER  26           HG       SER  26  -4.985   6.599   1.893
  224    H    THR  27           H        THR  27  -5.824   2.614  -0.729
  225    HA   THR  27           HA       THR  27  -8.391   3.514  -1.728
  226    HB   THR  27           HB       THR  27  -6.692   1.096  -2.373
  227    HG1  THR  27           1HG      THR  27  -6.329   2.232  -4.296
  228   1HG2  THR  27          1HG2      THR  27  -8.159   0.917  -4.397
  229   2HG2  THR  27          2HG2      THR  27  -9.296   1.983  -3.573
  230   3HG2  THR  27          3HG2      THR  27  -8.895   0.414  -2.875
  231    H    ALA  28           H        ALA  28  -7.074   1.155   0.472
  232    HA   ALA  28           HA       ALA  28  -9.336  -0.516   0.712
  233   1HB   ALA  28          1HB       ALA  28  -6.831  -0.079   2.180
  234   2HB   ALA  28          2HB       ALA  28  -7.641  -1.582   1.739
  235   3HB   ALA  28          3HB       ALA  28  -8.165  -0.682   3.162
  236    H    ASN  29           H        ASN  29  -8.452   2.547   2.190
  237    HA   ASN  29           HA       ASN  29 -10.598   2.462   4.108
  238   1HB   ASN  29          2HB       ASN  29  -8.862   4.781   3.231
  239   2HB   ASN  29          1HB       ASN  29  -9.940   4.778   4.623
  240   1HD2  ASN  29          1HD2      ASN  29  -6.948   5.016   4.232
  241   2HD2  ASN  29          2HD2      ASN  29  -6.287   3.881   5.354
  242    H    ASP  30           H        ASP  30  -9.917   4.494   1.269
  243    HA   ASP  30           HA       ASP  30 -12.340   5.823   1.142
  244   1HB   ASP  30          2HB       ASP  30 -10.115   5.320  -0.667
  245   2HB   ASP  30          1HB       ASP  30 -11.649   5.413  -1.527
  246    H    VAL  31           H        VAL  31 -11.476   2.613   0.035
  247    HA   VAL  31           HA       VAL  31 -13.798   2.052  -1.462
  248    HB   VAL  31           HB       VAL  31 -11.746   0.341  -0.092
  249   1HG1  VAL  31          1HG1      VAL  31 -14.209  -0.676  -1.502
  250   2HG1  VAL  31          2HG1      VAL  31 -13.798  -0.899   0.199
  251   3HG1  VAL  31          3HG1      VAL  31 -12.817  -1.661  -1.053
  252   1HG2  VAL  31          1HG2      VAL  31 -11.294   1.488  -2.266
  253   2HG2  VAL  31          2HG2      VAL  31 -12.557   0.489  -2.985
  254   3HG2  VAL  31          3HG2      VAL  31 -11.115  -0.266  -2.304
  255    H    PHE  32           H        PHE  32 -12.916   1.081   1.830
  256    HA   PHE  32           HA       PHE  32 -15.122  -0.186   2.706
  257   1HB   PHE  32          2HB       PHE  32 -13.062   0.402   4.046
  258   2HB   PHE  32          1HB       PHE  32 -13.794   1.975   4.341
  259    HD1  PHE  32           1HD      PHE  32 -16.246  -0.570   4.145
  260    HD2  PHE  32           2HD      PHE  32 -13.379   1.181   6.756
  261    HE1  PHE  32           1HE      PHE  32 -17.449  -1.498   6.081
  262    HE2  PHE  32           2HE      PHE  32 -14.575   0.255   8.697
  263    HZ   PHE  32           HZ       PHE  32 -16.613  -1.086   8.361
  264    H    ASN  33           H        ASN  33 -14.805   3.287   2.293
  265    HA   ASN  33           HA       ASN  33 -17.363   3.898   3.406
  266   1HB   ASN  33          2HB       ASN  33 -15.278   5.428   1.902
  267   2HB   ASN  33          1HB       ASN  33 -16.874   6.132   2.143
  268   1HD2  ASN  33          1HD2      ASN  33 -15.880   7.774   3.390
  269   2HD2  ASN  33          2HD2      ASN  33 -15.413   7.482   5.028
  270    H    PHE  34           H        PHE  34 -16.106   3.639   0.101
  271    HA   PHE  34           HA       PHE  34 -18.480   4.393  -1.207
  272   1HB   PHE  34          2HB       PHE  34 -15.974   3.950  -2.055
  273   2HB   PHE  34          1HB       PHE  34 -16.705   2.423  -2.541
  274    HD1  PHE  34           1HD      PHE  34 -18.000   5.919  -2.532
  275    HD2  PHE  34           2HD      PHE  34 -17.035   2.460  -4.816
  276    HE1  PHE  34           1HE      PHE  34 -18.911   6.999  -4.545
  277    HE2  PHE  34           2HE      PHE  34 -17.944   3.535  -6.834
  278    HZ   PHE  34           HZ       PHE  34 -18.884   5.808  -6.700
  279    H    LEU  35           H        LEU  35 -17.298   1.276  -0.086
  280    HA   LEU  35           HA       LEU  35 -19.934   0.131  -0.732
  281   1HB   LEU  35          2HB       LEU  35 -18.296  -2.048  -0.652
  282   2HB   LEU  35          1HB       LEU  35 -18.829  -1.238  -2.113
  283    HG   LEU  35           HG       LEU  35 -16.347  -0.254  -0.790
  284   1HD1  LEU  35          1HD1      LEU  35 -15.338  -2.045  -2.546
  285   2HD1  LEU  35          2HD1      LEU  35 -16.719  -2.942  -1.914
  286   3HD1  LEU  35          3HD1      LEU  35 -15.487  -2.329  -0.811
  287   1HD2  LEU  35          1HD2      LEU  35 -17.512   0.737  -2.848
  288   2HD2  LEU  35          2HD2      LEU  35 -16.895  -0.673  -3.709
  289   3HD2  LEU  35          3HD2      LEU  35 -15.774   0.451  -2.940
  290    H    LYS  36           H        LYS  36 -19.854   1.246   1.622
  291    HA   LYS  36           HA       LYS  36 -18.823  -0.473   3.677
  292   1HB   LYS  36          2HB       LYS  36 -18.819   1.638   4.508
  293   2HB   LYS  36          1HB       LYS  36 -20.183   2.140   3.524
  294   1HG   LYS  36          2HG       LYS  36 -21.620   0.764   5.129
  295   2HG   LYS  36          1HG       LYS  36 -20.200   0.740   6.174
  296   1HD   LYS  36          2HD       LYS  36 -20.307   3.362   5.585
  297   2HD   LYS  36          1HD       LYS  36 -22.022   2.957   5.488
  298   1HE   LYS  36          2HE       LYS  36 -21.956   2.034   7.733
  299   2HE   LYS  36          1HE       LYS  36 -20.223   2.341   7.830
  300   1HZ   LYS  36          1HZ       LYS  36 -20.560   4.628   7.927
  301   2HZ   LYS  36          2HZ       LYS  36 -21.783   4.009   8.917
  302   3HZ   LYS  36          3HZ       LYS  36 -22.147   4.531   7.349
  303    HA   PRO  37           HA       PRO  37 -23.353  -1.636   4.404
  304   1HB   PRO  37          2HB       PRO  37 -25.348  -0.327   3.233
  305   2HB   PRO  37          1HB       PRO  37 -24.465   0.393   4.585
  306   1HG   PRO  37          2HG       PRO  37 -24.172   0.906   1.648
  307   2HG   PRO  37          1HG       PRO  37 -24.217   2.069   2.986
  308   1HD   PRO  37          2HD       PRO  37 -21.904   1.154   1.805
  309   2HD   PRO  37          1HD       PRO  37 -22.001   1.783   3.462
  310    H    LYS  38           H        LYS  38 -21.843  -2.828   2.477
  311    HA   LYS  38           HA       LYS  38 -22.828  -3.213  -0.051
  312   1HB   LYS  38          2HB       LYS  38 -21.148  -4.708   1.795
  313   2HB   LYS  38          1HB       LYS  38 -22.068  -5.770   0.739
  314   1HG   LYS  38          2HG       LYS  38 -20.920  -5.159  -1.103
  315   2HG   LYS  38          1HG       LYS  38 -20.734  -3.488  -0.566
  316   1HD   LYS  38          2HD       LYS  38 -18.743  -3.897   0.387
  317   2HD   LYS  38          1HD       LYS  38 -19.286  -5.428   1.078
  318   1HE   LYS  38          2HE       LYS  38 -19.078  -5.616  -1.789
  319   2HE   LYS  38          1HE       LYS  38 -17.559  -5.055  -1.090
  320   1HZ   LYS  38          1HZ       LYS  38 -17.882  -6.990   0.533
  321   2HZ   LYS  38          2HZ       LYS  38 -17.379  -7.350  -1.041
  322   3HZ   LYS  38          3HZ       LYS  38 -18.993  -7.586  -0.596
  323    H    LYS  39           H        LYS  39 -24.239  -4.172   2.940
  324    HA   LYS  39           HA       LYS  39 -25.929  -6.225   1.889
  325   1HB   LYS  39          2HB       LYS  39 -25.325  -5.112   4.457
  326   2HB   LYS  39          1HB       LYS  39 -27.070  -5.141   4.245
  327   1HG   LYS  39          2HG       LYS  39 -27.095  -7.297   4.726
  328   2HG   LYS  39          1HG       LYS  39 -26.051  -7.624   3.341
  329   1HD   LYS  39          2HD       LYS  39 -24.816  -6.586   5.845
  330   2HD   LYS  39          1HD       LYS  39 -25.326  -8.275   5.792
  331   1HE   LYS  39          2HE       LYS  39 -23.733  -8.852   4.284
  332   2HE   LYS  39          1HE       LYS  39 -23.775  -7.285   3.478
  333   1HZ   LYS  39          1HZ       LYS  39 -22.183  -6.461   4.813
  334   2HZ   LYS  39          2HZ       LYS  39 -21.783  -8.087   5.049
  335   3HZ   LYS  39          3HZ       LYS  39 -22.736  -7.278   6.188
  336    H    ARG  40           H        ARG  40 -26.234  -2.761   2.420
  337    HA   ARG  40           HA       ARG  40 -27.831  -1.254   1.811
  338   1HB   ARG  40          2HB       ARG  40 -27.319  -2.522  -0.402
  339   2HB   ARG  40          1HB       ARG  40 -28.898  -3.256  -0.157
  340   1HG   ARG  40          2HG       ARG  40 -30.008  -1.369  -0.684
  341   2HG   ARG  40          1HG       ARG  40 -28.800  -0.320   0.059
  342   1HD   ARG  40          2HD       ARG  40 -27.803  -1.736  -2.285
  343   2HD   ARG  40          1HD       ARG  40 -29.180  -0.694  -2.642
  344    HE   ARG  40           HE       ARG  40 -27.647   0.963  -1.241
  345   1HH1  ARG  40          1HH1      ARG  40 -26.837  -1.232  -3.820
  346   2HH1  ARG  40          2HH1      ARG  40 -25.513  -0.274  -4.393
  347   1HH2  ARG  40          1HH2      ARG  40 -25.906   2.230  -1.985
  348   2HH2  ARG  40          2HH2      ARG  40 -24.984   1.696  -3.350
  349    H    LYS  41           H        LYS  41 -30.361  -1.116   1.324
  350    HA   LYS  41           HA       LYS  41 -31.860  -3.123   2.798
  351   1HB   LYS  41          2HB       LYS  41 -32.401  -0.347   3.688
  352   2HB   LYS  41          1HB       LYS  41 -32.498  -1.856   4.584
  353   1HG   LYS  41          2HG       LYS  41 -29.826  -0.802   3.790
  354   2HG   LYS  41          1HG       LYS  41 -30.676  -0.086   5.160
  355   1HD   LYS  41          2HD       LYS  41 -30.926  -2.816   5.566
  356   2HD   LYS  41          1HD       LYS  41 -29.280  -2.623   4.958
  357   1HE   LYS  41          2HE       LYS  41 -29.462  -0.570   6.742
  358   2HE   LYS  41          1HE       LYS  41 -30.457  -1.805   7.513
  359   1HZ   LYS  41          1HZ       LYS  41 -28.315  -2.198   8.296
  360   2HZ   LYS  41          2HZ       LYS  41 -27.596  -1.941   6.787
  361   3HZ   LYS  41          3HZ       LYS  41 -28.498  -3.344   7.065
  362    H    ALA  42           H        ALA  42 -32.160   0.185   1.495
  363    HA   ALA  42           HA       ALA  42 -33.915   1.170   0.377
  364   1HB   ALA  42          1HB       ALA  42 -33.459   0.654  -1.730
  365   2HB   ALA  42          2HB       ALA  42 -34.315  -0.879  -1.571
  366   3HB   ALA  42          3HB       ALA  42 -32.599  -0.781  -1.172
  Start of MODEL    3
    1   1H    ALA   1          1HT       ALA   1 -32.412   5.249   2.024
    2   2H    ALA   1          2HT       ALA   1 -32.244   5.961   3.576
    3   3H    ALA   1          3HT       ALA   1 -33.670   5.095   3.177
    4    HA   ALA   1           HA       ALA   1 -30.961   3.963   3.354
    5   1HB   ALA   1          1HB       ALA   1 -31.529   4.435   5.558
    6   2HB   ALA   1          2HB       ALA   1 -32.075   2.771   5.348
    7   3HB   ALA   1          3HB       ALA   1 -33.239   4.095   5.293
    8    H    LYS   2           H        LYS   2 -31.043   2.672   1.568
    9    HA   LYS   2           HA       LYS   2 -33.338   0.849   1.323
   10   1HB   LYS   2          2HB       LYS   2 -31.270   1.701  -0.709
   11   2HB   LYS   2          1HB       LYS   2 -32.486   0.465  -1.002
   12   1HG   LYS   2          2HG       LYS   2 -34.191   1.973  -1.140
   13   2HG   LYS   2          1HG       LYS   2 -33.399   3.131  -0.070
   14   1HD   LYS   2          2HD       LYS   2 -31.793   3.658  -1.854
   15   2HD   LYS   2          1HD       LYS   2 -32.620   2.523  -2.922
   16   1HE   LYS   2          2HE       LYS   2 -33.764   4.340  -3.585
   17   2HE   LYS   2          1HE       LYS   2 -34.690   4.071  -2.109
   18   1HZ   LYS   2          1HZ       LYS   2 -32.778   6.158  -2.740
   19   2HZ   LYS   2          2HZ       LYS   2 -32.664   5.525  -1.176
   20   3HZ   LYS   2          3HZ       LYS   2 -34.122   6.194  -1.712
   21    H    ILE   3           H        ILE   3 -30.328   0.136  -0.260
   22    HA   ILE   3           HA       ILE   3 -29.569  -1.790   1.791
   23    HB   ILE   3           HB       ILE   3 -29.238  -3.257  -0.524
   24   1HG1  ILE   3          2HG1      ILE   3 -30.938  -1.440  -1.420
   25   2HG1  ILE   3          1HG1      ILE   3 -31.090  -3.131  -1.884
   26   1HG2  ILE   3          1HG2      ILE   3 -31.462  -3.414   1.502
   27   2HG2  ILE   3          2HG2      ILE   3 -29.855  -4.124   1.661
   28   3HG2  ILE   3          3HG2      ILE   3 -30.963  -4.715   0.422
   29   1HD1  ILE   3          1HD1      ILE   3 -32.533  -2.492   0.558
   30   2HD1  ILE   3          2HD1      ILE   3 -33.075  -3.322  -0.901
   31   3HD1  ILE   3          3HD1      ILE   3 -33.073  -1.560  -0.838
   32    HA   PRO   4           HA       PRO   4 -26.067   0.058  -0.827
   33   1HB   PRO   4          2HB       PRO   4 -25.431   2.315   0.445
   34   2HB   PRO   4          1HB       PRO   4 -26.762   2.271  -0.720
   35   1HG   PRO   4          2HG       PRO   4 -26.863   2.184   2.274
   36   2HG   PRO   4          1HG       PRO   4 -27.875   3.107   1.148
   37   1HD   PRO   4          2HD       PRO   4 -28.624   0.722   2.292
   38   2HD   PRO   4          1HD       PRO   4 -29.258   1.337   0.752
   39    H    ILE   5           H        ILE   5 -26.630  -0.556   2.510
   40    HA   ILE   5           HA       ILE   5 -24.372  -0.211   3.885
   41    HB   ILE   5           HB       ILE   5 -25.760  -2.889   3.811
   42   1HG1  ILE   5          2HG1      ILE   5 -26.536  -1.075   5.944
   43   2HG1  ILE   5          1HG1      ILE   5 -26.895  -0.402   4.357
   44   1HG2  ILE   5          1HG2      ILE   5 -24.727  -3.415   5.756
   45   2HG2  ILE   5          2HG2      ILE   5 -24.656  -1.739   6.300
   46   3HG2  ILE   5          3HG2      ILE   5 -23.496  -2.330   5.110
   47   1HD1  ILE   5          1HD1      ILE   5 -28.548  -2.023   5.714
   48   2HD1  ILE   5          2HD1      ILE   5 -27.669  -3.210   4.751
   49   3HD1  ILE   5          3HD1      ILE   5 -28.527  -1.891   3.956
   50    H    LYS   6           H        LYS   6 -24.709  -3.406   2.391
   51    HA   LYS   6           HA       LYS   6 -22.155  -4.255   2.490
   52   1HB   LYS   6          2HB       LYS   6 -24.428  -5.124   1.223
   53   2HB   LYS   6          1HB       LYS   6 -23.348  -4.821  -0.130
   54   1HG   LYS   6          2HG       LYS   6 -22.544  -6.858   0.233
   55   2HG   LYS   6          1HG       LYS   6 -21.755  -6.181   1.659
   56   1HD   LYS   6          2HD       LYS   6 -22.888  -7.917   2.626
   57   2HD   LYS   6          1HD       LYS   6 -24.112  -6.652   2.754
   58   1HE   LYS   6          2HE       LYS   6 -25.190  -8.610   1.930
   59   2HE   LYS   6          1HE       LYS   6 -25.061  -7.472   0.589
   60   1HZ   LYS   6          1HZ       LYS   6 -24.443  -9.921   0.203
   61   2HZ   LYS   6          2HZ       LYS   6 -22.999  -9.538   0.995
   62   3HZ   LYS   6          3HZ       LYS   6 -23.424  -8.725  -0.425
   63    H    ALA   7           H        ALA   7 -23.383  -1.800   0.336
   64    HA   ALA   7           HA       ALA   7 -21.144  -1.806  -1.432
   65   1HB   ALA   7          1HB       ALA   7 -22.695   0.684  -1.166
   66   2HB   ALA   7          2HB       ALA   7 -23.615  -0.757  -1.598
   67   3HB   ALA   7          3HB       ALA   7 -22.263  -0.240  -2.605
   68    H    ILE   8           H        ILE   8 -22.062   0.180   1.358
   69    HA   ILE   8           HA       ILE   8 -19.842   1.920   1.212
   70    HB   ILE   8           HB       ILE   8 -20.394   2.438   3.597
   71   1HG1  ILE   8          2HG1      ILE   8 -22.832   0.728   3.264
   72   2HG1  ILE   8          1HG1      ILE   8 -21.347   0.027   3.900
   73   1HG2  ILE   8          1HG2      ILE   8 -23.022   2.731   2.517
   74   2HG2  ILE   8          2HG2      ILE   8 -21.828   2.981   1.243
   75   3HG2  ILE   8          3HG2      ILE   8 -21.759   3.946   2.718
   76   1HD1  ILE   8          1HD1      ILE   8 -22.557   2.492   5.095
   77   2HD1  ILE   8          2HD1      ILE   8 -21.398   1.370   5.806
   78   3HD1  ILE   8          3HD1      ILE   8 -23.073   0.873   5.566
   79    H    LYS   9           H        LYS   9 -20.245  -1.292   2.422
   80    HA   LYS   9           HA       LYS   9 -17.997  -1.259   4.191
   81   1HB   LYS   9          2HB       LYS   9 -19.176  -3.724   2.926
   82   2HB   LYS   9          1HB       LYS   9 -18.362  -3.579   4.478
   83   1HG   LYS   9          2HG       LYS   9 -20.510  -1.865   4.716
   84   2HG   LYS   9          1HG       LYS   9 -21.159  -3.229   3.802
   85   1HD   LYS   9          2HD       LYS   9 -19.510  -3.674   6.265
   86   2HD   LYS   9          1HD       LYS   9 -21.233  -3.310   6.384
   87   1HE   LYS   9          2HE       LYS   9 -21.125  -5.266   4.445
   88   2HE   LYS   9          1HE       LYS   9 -19.887  -5.769   5.596
   89   1HZ   LYS   9          1HZ       LYS   9 -22.035  -6.704   6.158
   90   2HZ   LYS   9          2HZ       LYS   9 -22.719  -5.159   6.252
   91   3HZ   LYS   9          3HZ       LYS   9 -21.534  -5.627   7.364
   92    H    THR  10           H        THR  10 -18.556  -2.374   0.881
   93    HA   THR  10           HA       THR  10 -15.929  -3.375   0.487
   94    HB   THR  10           HB       THR  10 -18.099  -2.529  -1.432
   95    HG1  THR  10           1HG      THR  10 -17.858  -4.636  -0.015
   96   1HG2  THR  10          1HG2      THR  10 -15.694  -4.089  -2.279
   97   2HG2  THR  10          2HG2      THR  10 -15.726  -2.329  -2.381
   98   3HG2  THR  10          3HG2      THR  10 -16.910  -3.286  -3.271
   99    H    VAL  11           H        VAL  11 -17.423  -0.243   0.162
  100    HA   VAL  11           HA       VAL  11 -15.373   0.993  -1.354
  101    HB   VAL  11           HB       VAL  11 -17.333   2.276   0.552
  102   1HG1  VAL  11          1HG1      VAL  11 -16.217   4.151   0.135
  103   2HG1  VAL  11          2HG1      VAL  11 -16.717   4.007  -1.550
  104   3HG1  VAL  11          3HG1      VAL  11 -15.172   3.336  -1.028
  105   1HG2  VAL  11          1HG2      VAL  11 -17.873   2.557  -2.282
  106   2HG2  VAL  11          2HG2      VAL  11 -18.936   2.033  -0.976
  107   3HG2  VAL  11          3HG2      VAL  11 -17.875   0.869  -1.770
  108    H    GLY  12           H        GLY  12 -16.063   0.857   2.122
  109   1HA   GLY  12          2HA       GLY  12 -13.959   2.488   2.988
  110   2HA   GLY  12          1HA       GLY  12 -14.707   1.214   3.943
  111    H    LYS  13           H        LYS  13 -14.036  -0.927   2.152
  112    HA   LYS  13           HA       LYS  13 -11.322  -1.370   3.037
  113   1HB   LYS  13          2HB       LYS  13 -13.190  -3.128   1.434
  114   2HB   LYS  13          1HB       LYS  13 -11.629  -3.628   2.072
  115   1HG   LYS  13          2HG       LYS  13 -14.008  -2.763   3.705
  116   2HG   LYS  13          1HG       LYS  13 -13.456  -4.422   3.468
  117   1HD   LYS  13          2HD       LYS  13 -11.828  -4.217   4.999
  118   2HD   LYS  13          1HD       LYS  13 -11.372  -2.610   4.431
  119   1HE   LYS  13          2HE       LYS  13 -13.585  -1.865   5.568
  120   2HE   LYS  13          1HE       LYS  13 -13.449  -3.391   6.439
  121   1HZ   LYS  13          1HZ       LYS  13 -12.032  -2.420   7.809
  122   2HZ   LYS  13          2HZ       LYS  13 -12.116  -0.973   6.938
  123   3HZ   LYS  13          3HZ       LYS  13 -10.960  -2.139   6.530
  124    H    ALA  14           H        ALA  14 -12.943  -0.403   0.150
  125    HA   ALA  14           HA       ALA  14 -10.914  -1.154  -1.698
  126   1HB   ALA  14          1HB       ALA  14 -12.077   0.483  -3.213
  127   2HB   ALA  14          2HB       ALA  14 -13.169   0.832  -1.872
  128   3HB   ALA  14          3HB       ALA  14 -13.102  -0.793  -2.554
  129    H    VAL  15           H        VAL  15 -11.699   1.868  -0.024
  130    HA   VAL  15           HA       VAL  15  -9.560   3.352  -1.168
  131    HB   VAL  15           HB       VAL  15  -9.983   4.819   0.948
  132   1HG1  VAL  15          1HG1      VAL  15 -12.280   4.518  -0.966
  133   2HG1  VAL  15          2HG1      VAL  15 -10.726   5.199  -1.448
  134   3HG1  VAL  15          3HG1      VAL  15 -11.682   5.986  -0.192
  135   1HG2  VAL  15          1HG2      VAL  15 -12.641   3.480   0.985
  136   2HG2  VAL  15          2HG2      VAL  15 -11.833   4.422   2.240
  137   3HG2  VAL  15          3HG2      VAL  15 -11.317   2.768   1.908
  138    H    GLY  16           H        GLY  16  -9.967   1.403   1.727
  139   1HA   GLY  16          2HA       GLY  16  -7.516   2.140   2.969
  140   2HA   GLY  16          1HA       GLY  16  -8.474   0.711   3.336
  141    H    LYS  17           H        LYS  17  -8.422  -0.416   0.707
  142    HA   LYS  17           HA       LYS  17  -5.956  -1.813   0.861
  143   1HB   LYS  17          2HB       LYS  17  -8.301  -1.824  -0.990
  144   2HB   LYS  17          1HB       LYS  17  -6.816  -2.607  -1.511
  145   1HG   LYS  17          2HG       LYS  17  -8.232  -3.235   1.067
  146   2HG   LYS  17          1HG       LYS  17  -8.465  -4.127  -0.438
  147   1HD   LYS  17          2HD       LYS  17  -5.978  -4.530  -0.448
  148   2HD   LYS  17          1HD       LYS  17  -5.943  -3.869   1.188
  149   1HE   LYS  17          2HE       LYS  17  -7.998  -5.897   0.849
  150   2HE   LYS  17          1HE       LYS  17  -6.383  -6.509   0.492
  151   1HZ   LYS  17          1HZ       LYS  17  -5.668  -6.120   2.626
  152   2HZ   LYS  17          2HZ       LYS  17  -7.274  -6.570   2.904
  153   3HZ   LYS  17          3HZ       LYS  17  -6.836  -4.936   2.936
  154    H    GLY  18           H        GLY  18  -7.155   0.826  -1.122
  155   1HA   GLY  18          2HA       GLY  18  -5.094   0.849  -3.046
  156   2HA   GLY  18          1HA       GLY  18  -6.097   2.224  -2.606
  157    H    LEU  19           H        LEU  19  -5.417   2.541   0.053
  158    HA   LEU  19           HA       LEU  19  -3.057   4.047  -0.114
  159   1HB   LEU  19          2HB       LEU  19  -3.519   4.706   2.009
  160   2HB   LEU  19          1HB       LEU  19  -5.080   4.015   1.615
  161    HG   LEU  19           HG       LEU  19  -4.184   1.844   2.679
  162   1HD1  LEU  19          1HD1      LEU  19  -2.481   3.328   4.482
  163   2HD1  LEU  19          2HD1      LEU  19  -1.857   3.349   2.832
  164   3HD1  LEU  19          3HD1      LEU  19  -2.179   1.811   3.633
  165   1HD2  LEU  19          1HD2      LEU  19  -4.476   3.080   5.041
  166   2HD2  LEU  19          2HD2      LEU  19  -5.827   2.713   3.968
  167   3HD2  LEU  19          3HD2      LEU  19  -5.119   4.329   3.974
  168    H    ARG  20           H        ARG  20  -3.702   0.861   1.266
  169    HA   ARG  20           HA       ARG  20  -1.140   0.380   2.278
  170   1HB   ARG  20          2HB       ARG  20  -2.947  -1.001   2.994
  171   2HB   ARG  20          1HB       ARG  20  -3.338  -1.470   1.353
  172   1HG   ARG  20          2HG       ARG  20  -0.805  -2.229   2.796
  173   2HG   ARG  20          1HG       ARG  20  -2.237  -3.244   2.678
  174   1HD   ARG  20          2HD       ARG  20  -0.299  -2.449   0.539
  175   2HD   ARG  20          1HD       ARG  20  -0.879  -4.045   0.985
  176    HE   ARG  20           HE       ARG  20  -2.797  -2.168  -0.172
  177   1HH1  ARG  20          1HH1      ARG  20  -0.827  -5.030  -0.539
  178   2HH1  ARG  20          2HH1      ARG  20  -1.678  -5.584  -1.938
  179   1HH2  ARG  20          1HH2      ARG  20  -3.913  -2.899  -2.011
  180   2HH2  ARG  20          2HH2      ARG  20  -3.429  -4.375  -2.776
  181    H    ALA  21           H        ALA  21  -2.602  -0.406  -0.852
  182    HA   ALA  21           HA       ALA  21  -0.457  -1.754  -1.986
  183   1HB   ALA  21          1HB       ALA  21  -1.382  -0.804  -4.186
  184   2HB   ALA  21          2HB       ALA  21  -2.619  -0.046  -3.184
  185   3HB   ALA  21          3HB       ALA  21  -2.456  -1.802  -3.207
  186    H    ILE  22           H        ILE  22  -0.977   1.640  -1.434
  187    HA   ILE  22           HA       ILE  22   1.232   2.481  -3.069
  188    HB   ILE  22           HB       ILE  22  -0.526   3.911  -1.083
  189   1HG1  ILE  22          2HG1      ILE  22  -0.124   4.918  -3.828
  190   2HG1  ILE  22          1HG1      ILE  22  -0.892   3.338  -3.722
  191   1HG2  ILE  22          1HG2      ILE  22   1.378   5.104  -0.642
  192   2HG2  ILE  22          2HG2      ILE  22   0.787   5.975  -2.057
  193   3HG2  ILE  22          3HG2      ILE  22   2.077   4.786  -2.229
  194   1HD1  ILE  22          1HD1      ILE  22  -2.014   5.924  -3.301
  195   2HD1  ILE  22          2HD1      ILE  22  -2.164   4.971  -1.825
  196   3HD1  ILE  22          3HD1      ILE  22  -2.815   4.354  -3.343
  197    H    ASN  23           H        ASN  23   0.834   1.152   0.045
  198    HA   ASN  23           HA       ASN  23   3.273   2.320   1.097
  199   1HB   ASN  23          2HB       ASN  23   2.703   1.439   3.126
  200   2HB   ASN  23          1HB       ASN  23   1.109   1.545   2.405
  201   1HD2  ASN  23          1HD2      ASN  23   3.846  -0.651   2.831
  202   2HD2  ASN  23          2HD2      ASN  23   2.898  -2.089   2.970
  203    H    ILE  24           H        ILE  24   2.136  -0.938   0.321
  204    HA   ILE  24           HA       ILE  24   4.556  -2.270   0.599
  205    HB   ILE  24           HB       ILE  24   3.641  -3.907  -1.034
  206   1HG1  ILE  24          2HG1      ILE  24   1.201  -3.452  -1.714
  207   2HG1  ILE  24          1HG1      ILE  24   1.552  -1.767  -1.341
  208   1HG2  ILE  24          1HG2      ILE  24   1.665  -3.010   1.054
  209   2HG2  ILE  24          2HG2      ILE  24   3.065  -4.045   1.338
  210   3HG2  ILE  24          3HG2      ILE  24   1.744  -4.610   0.316
  211   1HD1  ILE  24          1HD1      ILE  24   1.959  -3.038  -3.750
  212   2HD1  ILE  24          2HD1      ILE  24   3.572  -2.937  -3.044
  213   3HD1  ILE  24          3HD1      ILE  24   2.612  -1.476  -3.265
  214    H    ALA  25           H        ALA  25   3.297  -0.131  -1.796
  215    HA   ALA  25           HA       ALA  25   5.329  -0.718  -3.744
  216   1HB   ALA  25          1HB       ALA  25   3.587   1.715  -3.818
  217   2HB   ALA  25          2HB       ALA  25   2.921   0.125  -4.187
  218   3HB   ALA  25          3HB       ALA  25   4.242   0.775  -5.158
  219    H    SER  26           H        SER  26   4.705   1.561  -1.178
  220    HA   SER  26           HA       SER  26   6.749   3.427  -1.852
  221   1HB   SER  26          2HB       SER  26   5.200   2.853   0.673
  222   2HB   SER  26          1HB       SER  26   6.482   4.064   0.631
  223    HG   SER  26           HG       SER  26   5.279   5.004  -1.172
  224    H    THR  27           H        THR  27   6.599   0.490   0.042
  225    HA   THR  27           HA       THR  27   9.163   0.736   1.243
  226    HB   THR  27           HB       THR  27   7.327  -1.611   0.775
  227    HG1  THR  27           1HG      THR  27   7.961   0.038   2.967
  228   1HG2  THR  27          1HG2      THR  27  10.102  -1.623   1.721
  229   2HG2  THR  27          2HG2      THR  27   9.118  -2.923   1.048
  230   3HG2  THR  27          3HG2      THR  27   8.946  -2.473   2.745
  231    H    ALA  28           H        ALA  28   7.926  -0.819  -1.669
  232    HA   ALA  28           HA       ALA  28  10.219  -2.175  -2.474
  233   1HB   ALA  28          1HB       ALA  28   9.135  -2.557  -4.435
  234   2HB   ALA  28          2HB       ALA  28   8.576  -0.891  -4.580
  235   3HB   ALA  28          3HB       ALA  28   7.760  -2.002  -3.480
  236    H    ASN  29           H        ASN  29   9.311   1.204  -2.851
  237    HA   ASN  29           HA       ASN  29  11.315   1.960  -4.666
  238   1HB   ASN  29          2HB       ASN  29   9.442   3.318  -2.867
  239   2HB   ASN  29          1HB       ASN  29  10.943   4.204  -3.119
  240   1HD2  ASN  29          1HD2      ASN  29   7.910   3.478  -4.352
  241   2HD2  ASN  29          2HD2      ASN  29   8.107   4.153  -5.930
  242    H    ASP  30           H        ASP  30  11.263   2.657  -1.177
  243    HA   ASP  30           HA       ASP  30  13.868   3.448  -0.865
  244   1HB   ASP  30          2HB       ASP  30  11.949   3.292   0.878
  245   2HB   ASP  30          1HB       ASP  30  12.576   1.677   1.195
  246    H    VAL  31           H        VAL  31  12.606   0.230  -1.289
  247    HA   VAL  31           HA       VAL  31  14.960  -1.178  -0.527
  248    HB   VAL  31           HB       VAL  31  12.559  -1.974  -2.166
  249   1HG1  VAL  31          1HG1      VAL  31  13.937  -3.505  -3.092
  250   2HG1  VAL  31          2HG1      VAL  31  13.684  -4.340  -1.559
  251   3HG1  VAL  31          3HG1      VAL  31  15.133  -3.366  -1.804
  252   1HG2  VAL  31          1HG2      VAL  31  11.651  -2.463  -0.201
  253   2HG2  VAL  31          2HG2      VAL  31  13.085  -1.829   0.607
  254   3HG2  VAL  31          3HG2      VAL  31  12.997  -3.537   0.177
  255    H    PHE  32           H        PHE  32  13.506  -0.610  -3.722
  256    HA   PHE  32           HA       PHE  32  15.484  -1.580  -5.336
  257   1HB   PHE  32          2HB       PHE  32  13.533  -0.833  -6.416
  258   2HB   PHE  32          1HB       PHE  32  13.625   0.762  -5.676
  259    HD1  PHE  32           1HD      PHE  32  16.201  -1.204  -7.502
  260    HD2  PHE  32           2HD      PHE  32  13.752   2.274  -7.415
  261    HE1  PHE  32           1HE      PHE  32  17.351  -0.350  -9.503
  262    HE2  PHE  32           2HE      PHE  32  14.895   3.135  -9.416
  263    HZ   PHE  32           HZ       PHE  32  16.697   1.821 -10.463
  264    H    ASN  33           H        ASN  33  15.432   1.442  -3.573
  265    HA   ASN  33           HA       ASN  33  17.827   2.460  -4.806
  266   1HB   ASN  33          2HB       ASN  33  16.165   4.035  -4.004
  267   2HB   ASN  33          1HB       ASN  33  16.272   3.372  -2.376
  268   1HD2  ASN  33          1HD2      ASN  33  18.458   3.477  -1.373
  269   2HD2  ASN  33          2HD2      ASN  33  19.391   4.905  -1.650
  270    H    PHE  34           H        PHE  34  17.018   0.484  -2.090
  271    HA   PHE  34           HA       PHE  34  19.342   0.861  -0.534
  272   1HB   PHE  34          2HB       PHE  34  16.996  -0.707  -0.400
  273   2HB   PHE  34          1HB       PHE  34  18.348  -1.831  -0.313
  274    HD1  PHE  34           1HD      PHE  34  18.654  -2.479   1.866
  275    HD2  PHE  34           2HD      PHE  34  17.839   1.612   1.028
  276    HE1  PHE  34           1HE      PHE  34  18.944  -1.938   4.249
  277    HE2  PHE  34           2HE      PHE  34  18.128   2.161   3.409
  278    HZ   PHE  34           HZ       PHE  34  18.682   0.385   5.023
  279    H    LEU  35           H        LEU  35  18.628  -1.123  -3.319
  280    HA   LEU  35           HA       LEU  35  21.118  -2.598  -3.094
  281   1HB   LEU  35          2HB       LEU  35  19.292  -2.685  -5.469
  282   2HB   LEU  35          1HB       LEU  35  20.352  -3.937  -4.849
  283    HG   LEU  35           HG       LEU  35  18.049  -3.037  -3.174
  284   1HD1  LEU  35          1HD1      LEU  35  17.189  -5.282  -4.603
  285   2HD1  LEU  35          2HD1      LEU  35  17.799  -4.149  -5.810
  286   3HD1  LEU  35          3HD1      LEU  35  16.541  -3.643  -4.683
  287   1HD2  LEU  35          1HD2      LEU  35  20.029  -4.831  -2.768
  288   2HD2  LEU  35          2HD2      LEU  35  18.786  -5.868  -3.467
  289   3HD2  LEU  35          3HD2      LEU  35  18.436  -4.927  -2.018
  290    H    LYS  36           H        LYS  36  20.714   0.431  -3.789
  291    HA   LYS  36           HA       LYS  36  22.087   0.555  -6.349
  292   1HB   LYS  36          2HB       LYS  36  20.385   2.298  -4.887
  293   2HB   LYS  36          1HB       LYS  36  21.931   3.111  -5.085
  294   1HG   LYS  36          2HG       LYS  36  20.438   3.681  -6.897
  295   2HG   LYS  36          1HG       LYS  36  21.806   2.745  -7.505
  296   1HD   LYS  36          2HD       LYS  36  20.459   0.753  -7.614
  297   2HD   LYS  36          1HD       LYS  36  19.106   1.578  -6.838
  298   1HE   LYS  36          2HE       LYS  36  18.991   1.305  -9.363
  299   2HE   LYS  36          1HE       LYS  36  18.704   2.922  -8.722
  300   1HZ   LYS  36          1HZ       LYS  36  20.556   3.719  -9.677
  301   2HZ   LYS  36          2HZ       LYS  36  20.408   2.383 -10.703
  302   3HZ   LYS  36          3HZ       LYS  36  21.461   2.320  -9.381
  303    HA   PRO  37           HA       PRO  37  25.541   2.267  -3.610
  304   1HB   PRO  37          2HB       PRO  37  25.103   3.070  -1.126
  305   2HB   PRO  37          1HB       PRO  37  24.483   4.013  -2.487
  306   1HG   PRO  37          2HG       PRO  37  23.036   2.135  -0.668
  307   2HG   PRO  37          1HG       PRO  37  22.498   3.686  -1.336
  308   1HD   PRO  37          2HD       PRO  37  21.866   1.155  -2.353
  309   2HD   PRO  37          1HD       PRO  37  21.686   2.696  -3.213
  310    H    LYS  38           H        LYS  38  24.394  -0.510  -3.432
  311    HA   LYS  38           HA       LYS  38  25.031  -2.522  -2.589
  312   1HB   LYS  38          2HB       LYS  38  27.292  -0.853  -2.270
  313   2HB   LYS  38          1HB       LYS  38  27.131  -1.783  -0.786
  314   1HG   LYS  38          2HG       LYS  38  27.490  -2.795  -3.587
  315   2HG   LYS  38          1HG       LYS  38  28.530  -3.045  -2.184
  316   1HD   LYS  38          2HD       LYS  38  26.047  -4.036  -1.409
  317   2HD   LYS  38          1HD       LYS  38  26.240  -4.570  -3.080
  318   1HE   LYS  38          2HE       LYS  38  28.724  -5.013  -1.930
  319   2HE   LYS  38          1HE       LYS  38  27.579  -5.477  -0.672
  320   1HZ   LYS  38          1HZ       LYS  38  28.021  -6.659  -3.314
  321   2HZ   LYS  38          2HZ       LYS  38  26.453  -6.702  -2.682
  322   3HZ   LYS  38          3HZ       LYS  38  27.728  -7.416  -1.829
  323    H    LYS  39           H        LYS  39  25.913  -0.442   0.149
  324    HA   LYS  39           HA       LYS  39  24.151  -2.043   1.850
  325   1HB   LYS  39          2HB       LYS  39  25.857   0.051   3.058
  326   2HB   LYS  39          1HB       LYS  39  25.544  -1.595   3.591
  327   1HG   LYS  39          2HG       LYS  39  27.430  -0.729   1.411
  328   2HG   LYS  39          1HG       LYS  39  27.857  -1.379   2.995
  329   1HD   LYS  39          2HD       LYS  39  26.296  -2.874   0.889
  330   2HD   LYS  39          1HD       LYS  39  28.031  -3.047   1.164
  331   1HE   LYS  39          2HE       LYS  39  27.217  -3.488   3.645
  332   2HE   LYS  39          1HE       LYS  39  25.736  -3.966   2.816
  333   1HZ   LYS  39          1HZ       LYS  39  26.666  -5.892   2.303
  334   2HZ   LYS  39          2HZ       LYS  39  28.061  -5.458   3.155
  335   3HZ   LYS  39          3HZ       LYS  39  27.940  -5.117   1.503
  336    H    ARG  40           H        ARG  40  25.089   1.388   2.013
  337    HA   ARG  40           HA       ARG  40  22.618   2.493   1.392
  338   1HB   ARG  40          2HB       ARG  40  21.481   2.810   3.394
  339   2HB   ARG  40          1HB       ARG  40  22.063   1.159   3.535
  340   1HG   ARG  40          2HG       ARG  40  23.078   3.621   4.912
  341   2HG   ARG  40          1HG       ARG  40  22.443   2.139   5.624
  342   1HD   ARG  40          2HD       ARG  40  24.402   0.918   4.754
  343   2HD   ARG  40          1HD       ARG  40  25.046   2.435   4.129
  344    HE   ARG  40           HE       ARG  40  24.764   3.064   6.681
  345   1HH1  ARG  40          1HH1      ARG  40  26.027   0.149   5.248
  346   2HH1  ARG  40          2HH1      ARG  40  27.092  -0.192   6.571
  347   1HH2  ARG  40          1HH2      ARG  40  26.163   2.622   8.425
  348   2HH2  ARG  40          2HH2      ARG  40  27.169   1.212   8.376
  349    H    LYS  41           H        LYS  41  25.379   3.019   1.050
  350    HA   LYS  41           HA       LYS  41  26.661   4.894   0.804
  351   1HB   LYS  41          2HB       LYS  41  24.756   6.390   2.594
  352   2HB   LYS  41          1HB       LYS  41  25.839   7.043   1.373
  353   1HG   LYS  41          2HG       LYS  41  23.335   5.441   0.916
  354   2HG   LYS  41          1HG       LYS  41  23.607   7.143   0.539
  355   1HD   LYS  41          2HD       LYS  41  25.396   5.080  -0.664
  356   2HD   LYS  41          1HD       LYS  41  23.781   5.316  -1.334
  357   1HE   LYS  41          2HE       LYS  41  24.329   7.766  -1.499
  358   2HE   LYS  41          1HE       LYS  41  25.991   7.345  -1.090
  359   1HZ   LYS  41          1HZ       LYS  41  25.940   7.409  -3.406
  360   2HZ   LYS  41          2HZ       LYS  41  24.455   6.606  -3.504
  361   3HZ   LYS  41          3HZ       LYS  41  25.845   5.757  -3.050
  362    H    ALA  42           H        ALA  42  27.189   2.963   2.755
  363    HA   ALA  42           HA       ALA  42  27.619   3.667   5.339
  364   1HB   ALA  42          1HB       ALA  42  28.232   1.494   4.271
  365   2HB   ALA  42          2HB       ALA  42  29.431   2.111   5.407
  366   3HB   ALA  42          3HB       ALA  42  29.700   2.264   3.671
  Start of MODEL    4
    1   1H    ALA   1          1HT       ALA   1 -32.631   7.504  -0.666
    2   2H    ALA   1          2HT       ALA   1 -33.149   6.504   0.629
    3   3H    ALA   1          3HT       ALA   1 -32.843   5.821  -0.915
    4    HA   ALA   1           HA       ALA   1 -30.526   6.627  -0.670
    5   1HB   ALA   1          1HB       ALA   1 -31.075   8.197   1.180
    6   2HB   ALA   1          2HB       ALA   1 -29.730   7.113   1.536
    7   3HB   ALA   1          3HB       ALA   1 -31.321   6.802   2.230
    8    H    LYS   2           H        LYS   2 -31.064   4.406  -1.498
    9    HA   LYS   2           HA       LYS   2 -30.641   2.370   0.590
   10   1HB   LYS   2          2HB       LYS   2 -31.559   1.596  -2.133
   11   2HB   LYS   2          1HB       LYS   2 -31.945   0.881  -0.574
   12   1HG   LYS   2          2HG       LYS   2 -33.940   1.842  -0.899
   13   2HG   LYS   2          1HG       LYS   2 -33.128   3.299  -0.322
   14   1HD   LYS   2          2HD       LYS   2 -34.362   3.750  -2.375
   15   2HD   LYS   2          1HD       LYS   2 -32.626   3.930  -2.637
   16   1HE   LYS   2          2HE       LYS   2 -32.485   1.898  -3.811
   17   2HE   LYS   2          1HE       LYS   2 -34.063   1.362  -3.237
   18   1HZ   LYS   2          1HZ       LYS   2 -33.542   3.561  -5.165
   19   2HZ   LYS   2          2HZ       LYS   2 -35.068   3.160  -4.555
   20   3HZ   LYS   2          3HZ       LYS   2 -34.225   2.052  -5.515
   21    H    ILE   3           H        ILE   3 -29.423   3.792  -2.307
   22    HA   ILE   3           HA       ILE   3 -27.529   1.657  -2.817
   23    HB   ILE   3           HB       ILE   3 -27.606   4.370  -4.128
   24   1HG1  ILE   3          2HG1      ILE   3 -28.752   2.511  -5.864
   25   2HG1  ILE   3          1HG1      ILE   3 -29.487   2.160  -4.302
   26   1HG2  ILE   3          1HG2      ILE   3 -26.373   1.724  -4.834
   27   2HG2  ILE   3          2HG2      ILE   3 -25.583   3.289  -4.636
   28   3HG2  ILE   3          3HG2      ILE   3 -26.627   2.998  -6.028
   29   1HD1  ILE   3          1HD1      ILE   3 -30.908   3.802  -4.716
   30   2HD1  ILE   3          2HD1      ILE   3 -29.986   4.326  -6.124
   31   3HD1  ILE   3          3HD1      ILE   3 -29.566   4.929  -4.521
   32    HA   PRO   4           HA       PRO   4 -24.734   5.575  -1.465
   33   1HB   PRO   4          2HB       PRO   4 -26.599   6.218   0.782
   34   2HB   PRO   4          1HB       PRO   4 -25.538   7.293  -0.138
   35   1HG   PRO   4          2HG       PRO   4 -28.145   7.242  -0.635
   36   2HG   PRO   4          1HG       PRO   4 -26.977   7.364  -1.964
   37   1HD   PRO   4          2HD       PRO   4 -28.603   5.027  -1.075
   38   2HD   PRO   4          1HD       PRO   4 -28.083   5.487  -2.709
   39    H    ILE   5           H        ILE   5 -26.672   3.502   0.633
   40    HA   ILE   5           HA       ILE   5 -24.669   3.238   2.649
   41    HB   ILE   5           HB       ILE   5 -27.074   2.829   3.093
   42   1HG1  ILE   5          2HG1      ILE   5 -25.191   1.860   4.483
   43   2HG1  ILE   5          1HG1      ILE   5 -26.734   1.021   4.614
   44   1HG2  ILE   5          1HG2      ILE   5 -26.675   0.248   1.590
   45   2HG2  ILE   5          2HG2      ILE   5 -27.513   1.656   0.938
   46   3HG2  ILE   5          3HG2      ILE   5 -28.157   0.824   2.354
   47   1HD1  ILE   5          1HD1      ILE   5 -25.610  -0.844   4.209
   48   2HD1  ILE   5          2HD1      ILE   5 -24.166   0.048   3.728
   49   3HD1  ILE   5          3HD1      ILE   5 -25.435  -0.277   2.548
   50    H    LYS   6           H        LYS   6 -25.772   1.163  -0.002
   51    HA   LYS   6           HA       LYS   6 -23.810  -0.852   0.471
   52   1HB   LYS   6          2HB       LYS   6 -26.116  -0.755  -0.976
   53   2HB   LYS   6          1HB       LYS   6 -24.917  -0.617  -2.254
   54   1HG   LYS   6          2HG       LYS   6 -25.406  -2.911  -2.037
   55   2HG   LYS   6          1HG       LYS   6 -23.822  -2.672  -1.297
   56   1HD   LYS   6          2HD       LYS   6 -24.697  -2.842   0.882
   57   2HD   LYS   6          1HD       LYS   6 -26.356  -2.633   0.318
   58   1HE   LYS   6          2HE       LYS   6 -24.562  -5.021  -0.066
   59   2HE   LYS   6          1HE       LYS   6 -26.062  -4.937   0.857
   60   1HZ   LYS   6          1HZ       LYS   6 -26.797  -5.878  -1.069
   61   2HZ   LYS   6          2HZ       LYS   6 -25.671  -5.077  -2.044
   62   3HZ   LYS   6          3HZ       LYS   6 -27.024  -4.247  -1.458
   63    H    ALA   7           H        ALA   7 -23.786   2.202  -1.041
   64    HA   ALA   7           HA       ALA   7 -21.615   1.682  -2.852
   65   1HB   ALA   7          1HB       ALA   7 -23.483   3.537  -2.919
   66   2HB   ALA   7          2HB       ALA   7 -21.877   3.837  -3.582
   67   3HB   ALA   7          3HB       ALA   7 -22.297   4.444  -1.980
   68    H    ILE   8           H        ILE   8 -21.993   3.112   0.354
   69    HA   ILE   8           HA       ILE   8 -19.303   3.974   0.623
   70    HB   ILE   8           HB       ILE   8 -20.858   4.972   2.098
   71   1HG1  ILE   8          2HG1      ILE   8 -18.568   4.188   3.026
   72   2HG1  ILE   8          1HG1      ILE   8 -19.788   4.751   4.164
   73   1HG2  ILE   8          1HG2      ILE   8 -21.648   2.164   2.815
   74   2HG2  ILE   8          2HG2      ILE   8 -22.649   3.442   2.124
   75   3HG2  ILE   8          3HG2      ILE   8 -22.100   3.559   3.796
   76   1HD1  ILE   8          1HD1      ILE   8 -19.675   2.832   5.250
   77   2HD1  ILE   8          2HD1      ILE   8 -18.424   2.287   4.134
   78   3HD1  ILE   8          3HD1      ILE   8 -20.121   1.952   3.789
   79    H    LYS   9           H        LYS   9 -21.003   0.995   1.357
   80    HA   LYS   9           HA       LYS   9 -18.964  -0.267   2.835
   81   1HB   LYS   9          2HB       LYS   9 -21.108  -1.518   1.108
   82   2HB   LYS   9          1HB       LYS   9 -20.152  -2.359   2.320
   83   1HG   LYS   9          2HG       LYS   9 -21.733   0.023   3.143
   84   2HG   LYS   9          1HG       LYS   9 -22.567  -1.505   2.855
   85   1HD   LYS   9          2HD       LYS   9 -21.307  -2.614   4.527
   86   2HD   LYS   9          1HD       LYS   9 -20.163  -1.276   4.650
   87   1HE   LYS   9          2HE       LYS   9 -22.408   0.038   5.245
   88   2HE   LYS   9          1HE       LYS   9 -22.882  -1.571   5.788
   89   1HZ   LYS   9          1HZ       LYS   9 -21.132  -1.636   7.323
   90   2HZ   LYS   9          2HZ       LYS   9 -21.782  -0.084   7.483
   91   3HZ   LYS   9          3HZ       LYS   9 -20.339  -0.311   6.629
   92    H    THR  10           H        THR  10 -19.766  -0.300  -0.614
   93    HA   THR  10           HA       THR  10 -17.860  -2.137  -1.473
   94    HB   THR  10           HB       THR  10 -18.753   0.317  -2.993
   95    HG1  THR  10           1HG      THR  10 -20.512  -0.840  -3.605
   96   1HG2  THR  10          1HG2      THR  10 -18.238  -2.344  -4.220
   97   2HG2  THR  10          2HG2      THR  10 -16.889  -1.258  -3.886
   98   3HG2  THR  10          3HG2      THR  10 -18.198  -0.738  -4.948
   99    H    VAL  11           H        VAL  11 -17.579   1.319  -0.841
  100    HA   VAL  11           HA       VAL  11 -14.990   1.695  -1.860
  101    HB   VAL  11           HB       VAL  11 -16.497   3.132   0.318
  102   1HG1  VAL  11          1HG1      VAL  11 -13.756   3.727  -0.780
  103   2HG1  VAL  11          2HG1      VAL  11 -14.198   3.405   0.896
  104   3HG1  VAL  11          3HG1      VAL  11 -14.729   4.894   0.115
  105   1HG2  VAL  11          1HG2      VAL  11 -16.391   4.963  -1.461
  106   2HG2  VAL  11          2HG2      VAL  11 -17.457   3.593  -1.773
  107   3HG2  VAL  11          3HG2      VAL  11 -15.887   3.687  -2.570
  108    H    GLY  12           H        GLY  12 -16.100   0.931   1.427
  109   1HA   GLY  12          2HA       GLY  12 -13.683   0.850   2.752
  110   2HA   GLY  12          1HA       GLY  12 -15.040  -0.205   3.129
  111    H    LYS  13           H        LYS  13 -15.066  -1.513   0.557
  112    HA   LYS  13           HA       LYS  13 -13.173  -3.569   1.093
  113   1HB   LYS  13          2HB       LYS  13 -14.680  -3.218  -1.493
  114   2HB   LYS  13          1HB       LYS  13 -14.109  -4.713  -0.765
  115   1HG   LYS  13          2HG       LYS  13 -16.377  -2.975   0.169
  116   2HG   LYS  13          1HG       LYS  13 -16.469  -4.610  -0.489
  117   1HD   LYS  13          2HD       LYS  13 -14.734  -4.311   1.866
  118   2HD   LYS  13          1HD       LYS  13 -16.449  -4.016   2.161
  119   1HE   LYS  13          2HE       LYS  13 -15.854  -6.362   2.538
  120   2HE   LYS  13          1HE       LYS  13 -17.007  -6.184   1.215
  121   1HZ   LYS  13          1HZ       LYS  13 -15.048  -6.279  -0.312
  122   2HZ   LYS  13          2HZ       LYS  13 -15.370  -7.717   0.517
  123   3HZ   LYS  13          3HZ       LYS  13 -14.097  -6.722   1.017
  124    H    ALA  14           H        ALA  14 -13.372  -0.946  -1.257
  125    HA   ALA  14           HA       ALA  14 -11.116  -1.694  -2.789
  126   1HB   ALA  14          1HB       ALA  14 -11.358   1.118  -2.864
  127   2HB   ALA  14          2HB       ALA  14 -12.991   0.459  -2.756
  128   3HB   ALA  14          3HB       ALA  14 -11.916  -0.055  -4.056
  129    H    VAL  15           H        VAL  15 -11.507   0.670  -0.168
  130    HA   VAL  15           HA       VAL  15  -8.831   1.465   0.006
  131    HB   VAL  15           HB       VAL  15 -10.667   1.243   2.388
  132   1HG1  VAL  15          1HG1      VAL  15  -8.750   3.465   1.806
  133   2HG1  VAL  15          2HG1      VAL  15  -8.178   1.952   2.509
  134   3HG1  VAL  15          3HG1      VAL  15  -9.389   2.916   3.356
  135   1HG2  VAL  15          1HG2      VAL  15 -11.205   3.701   1.650
  136   2HG2  VAL  15          2HG2      VAL  15 -12.102   2.344   0.968
  137   3HG2  VAL  15          3HG2      VAL  15 -10.793   3.087   0.048
  138    H    GLY  16           H        GLY  16 -10.481  -1.384   1.100
  139   1HA   GLY  16          2HA       GLY  16  -8.530  -2.252   2.990
  140   2HA   GLY  16          1HA       GLY  16  -9.774  -3.251   2.251
  141    H    LYS  17           H        LYS  17  -9.255  -3.370  -0.327
  142    HA   LYS  17           HA       LYS  17  -7.005  -5.048  -0.521
  143   1HB   LYS  17          2HB       LYS  17  -7.525  -5.283  -2.800
  144   2HB   LYS  17          1HB       LYS  17  -9.078  -4.979  -2.034
  145   1HG   LYS  17          2HG       LYS  17  -9.143  -3.640  -3.918
  146   2HG   LYS  17          1HG       LYS  17  -8.655  -2.516  -2.649
  147   1HD   LYS  17          2HD       LYS  17  -6.834  -2.009  -3.814
  148   2HD   LYS  17          1HD       LYS  17  -6.302  -3.688  -3.700
  149   1HE   LYS  17          2HE       LYS  17  -8.290  -2.800  -5.766
  150   2HE   LYS  17          1HE       LYS  17  -6.553  -2.657  -6.034
  151   1HZ   LYS  17          1HZ       LYS  17  -6.876  -5.213  -5.151
  152   2HZ   LYS  17          2HZ       LYS  17  -6.667  -4.740  -6.761
  153   3HZ   LYS  17          3HZ       LYS  17  -8.224  -4.977  -6.146
  154    H    GLY  18           H        GLY  18  -7.455  -1.632  -0.910
  155   1HA   GLY  18          2HA       GLY  18  -5.035  -1.102  -2.332
  156   2HA   GLY  18          1HA       GLY  18  -6.004   0.074  -1.454
  157    H    LEU  19           H        LEU  19  -5.867  -1.569   1.010
  158    HA   LEU  19           HA       LEU  19  -3.533  -0.388   2.127
  159   1HB   LEU  19          2HB       LEU  19  -4.542  -0.820   4.078
  160   2HB   LEU  19          1HB       LEU  19  -5.898  -1.394   3.130
  161    HG   LEU  19           HG       LEU  19  -4.862  -3.699   3.235
  162   1HD1  LEU  19          1HD1      LEU  19  -3.399  -3.346   5.631
  163   2HD1  LEU  19          2HD1      LEU  19  -2.751  -2.222   4.437
  164   3HD1  LEU  19          3HD1      LEU  19  -2.827  -3.946   4.074
  165   1HD2  LEU  19          1HD2      LEU  19  -6.600  -2.471   4.885
  166   2HD2  LEU  19          2HD2      LEU  19  -5.347  -2.934   6.037
  167   3HD2  LEU  19          3HD2      LEU  19  -6.126  -4.163   5.040
  168    H    ARG  20           H        ARG  20  -4.483  -3.710   1.373
  169    HA   ARG  20           HA       ARG  20  -2.253  -5.080   2.207
  170   1HB   ARG  20          2HB       ARG  20  -3.775  -6.576   1.413
  171   2HB   ARG  20          1HB       ARG  20  -4.329  -5.492   0.147
  172   1HG   ARG  20          2HG       ARG  20  -3.300  -7.546  -0.728
  173   2HG   ARG  20          1HG       ARG  20  -2.456  -6.087  -1.249
  174   1HD   ARG  20          2HD       ARG  20  -1.034  -8.061  -0.469
  175   2HD   ARG  20          1HD       ARG  20  -0.655  -6.476   0.191
  176    HE   ARG  20           HE       ARG  20  -1.439  -7.163   2.267
  177   1HH1  ARG  20          1HH1      ARG  20  -1.945  -9.638  -0.138
  178   2HH1  ARG  20          2HH1      ARG  20  -2.296 -10.871   1.026
  179   1HH2  ARG  20          1HH2      ARG  20  -1.908  -8.781   3.798
  180   2HH2  ARG  20          2HH2      ARG  20  -2.286 -10.383   3.258
  181    H    ALA  21           H        ALA  21  -2.798  -3.749  -1.041
  182    HA   ALA  21           HA       ALA  21  -0.324  -4.252  -2.140
  183   1HB   ALA  21          1HB       ALA  21  -0.818  -2.601  -3.765
  184   2HB   ALA  21          2HB       ALA  21  -1.849  -1.708  -2.647
  185   3HB   ALA  21          3HB       ALA  21  -2.373  -3.273  -3.270
  186    H    ILE  22           H        ILE  22  -1.299  -1.656   0.012
  187    HA   ILE  22           HA       ILE  22   1.121  -0.172  -0.184
  188    HB   ILE  22           HB       ILE  22  -1.070  -0.218   1.891
  189   1HG1  ILE  22          2HG1      ILE  22  -0.327   2.097   0.137
  190   2HG1  ILE  22          1HG1      ILE  22  -1.288   0.777  -0.523
  191   1HG2  ILE  22          1HG2      ILE  22   1.518   1.271   1.864
  192   2HG2  ILE  22          2HG2      ILE  22   0.706   0.458   3.202
  193   3HG2  ILE  22          3HG2      ILE  22   0.086   1.994   2.596
  194   1HD1  ILE  22          1HD1      ILE  22  -2.099   2.977   1.122
  195   2HD1  ILE  22          2HD1      ILE  22  -2.499   1.447   1.902
  196   3HD1  ILE  22          3HD1      ILE  22  -3.085   1.786   0.274
  197    H    ASN  23           H        ASN  23   0.280  -3.099   1.272
  198    HA   ASN  23           HA       ASN  23   2.154  -2.992   3.437
  199   1HB   ASN  23          2HB       ASN  23   1.011  -4.761   4.163
  200   2HB   ASN  23          1HB       ASN  23  -0.051  -4.546   2.793
  201   1HD2  ASN  23          1HD2      ASN  23   3.020  -6.061   3.685
  202   2HD2  ASN  23          2HD2      ASN  23   2.790  -7.487   2.738
  203    H    ILE  24           H        ILE  24   1.946  -5.079   0.571
  204    HA   ILE  24           HA       ILE  24   4.617  -5.951   0.739
  205    HB   ILE  24           HB       ILE  24   4.281  -7.093  -1.217
  206   1HG1  ILE  24          2HG1      ILE  24   3.991  -4.957  -2.578
  207   2HG1  ILE  24          1HG1      ILE  24   3.114  -6.369  -3.154
  208   1HG2  ILE  24          1HG2      ILE  24   2.447  -7.549   0.409
  209   2HG2  ILE  24          2HG2      ILE  24   2.064  -7.955  -1.264
  210   3HG2  ILE  24          3HG2      ILE  24   1.415  -6.482  -0.543
  211   1HD1  ILE  24          1HD1      ILE  24   1.980  -4.003  -2.970
  212   2HD1  ILE  24          2HD1      ILE  24   1.709  -4.532  -1.309
  213   3HD1  ILE  24          3HD1      ILE  24   1.088  -5.491  -2.651
  214    H    ALA  25           H        ALA  25   3.126  -3.079  -0.329
  215    HA   ALA  25           HA       ALA  25   5.380  -2.173  -1.885
  216   1HB   ALA  25          1HB       ALA  25   2.758  -0.930  -1.105
  217   2HB   ALA  25          2HB       ALA  25   3.322  -1.388  -2.712
  218   3HB   ALA  25          3HB       ALA  25   4.034   0.001  -1.891
  219    H    SER  26           H        SER  26   4.175  -2.051   1.355
  220    HA   SER  26           HA       SER  26   5.732   0.217   2.183
  221   1HB   SER  26          2HB       SER  26   3.928  -1.741   3.487
  222   2HB   SER  26          1HB       SER  26   5.176  -1.039   4.516
  223    HG   SER  26           HG       SER  26   4.400   1.014   3.967
  224    H    THR  27           H        THR  27   6.235  -3.188   1.883
  225    HA   THR  27           HA       THR  27   8.662  -3.146   3.486
  226    HB   THR  27           HB       THR  27   7.174  -5.302   1.994
  227    HG1  THR  27           1HG      THR  27   7.940  -5.131   4.714
  228   1HG2  THR  27          1HG2      THR  27   8.773  -6.934   2.626
  229   2HG2  THR  27          2HG2      THR  27   9.734  -5.742   3.501
  230   3HG2  THR  27          3HG2      THR  27   9.627  -5.670   1.742
  231    H    ALA  28           H        ALA  28   7.617  -2.934   0.206
  232    HA   ALA  28           HA       ALA  28  10.147  -3.559  -0.992
  233   1HB   ALA  28          1HB       ALA  28   7.481  -2.699  -1.925
  234   2HB   ALA  28          2HB       ALA  28   8.565  -3.936  -2.561
  235   3HB   ALA  28          3HB       ALA  28   8.846  -2.237  -2.942
  236    H    ASN  29           H        ASN  29   8.578  -0.671   0.218
  237    HA   ASN  29           HA       ASN  29  10.287   1.174  -1.127
  238   1HB   ASN  29          2HB       ASN  29   9.180   2.852   0.021
  239   2HB   ASN  29          1HB       ASN  29   7.971   1.574   0.027
  240   1HD2  ASN  29          1HD2      ASN  29   6.939   1.574   1.873
  241   2HD2  ASN  29          2HD2      ASN  29   7.638   1.770   3.440
  242    H    ASP  30           H        ASP  30  10.293  -0.295   2.086
  243    HA   ASP  30           HA       ASP  30  12.566   1.080   3.054
  244   1HB   ASP  30          2HB       ASP  30  11.023  -0.061   4.572
  245   2HB   ASP  30          1HB       ASP  30  11.432  -1.613   3.849
  246    H    VAL  31           H        VAL  31  12.114  -1.977   1.380
  247    HA   VAL  31           HA       VAL  31  14.783  -2.878   1.469
  248    HB   VAL  31           HB       VAL  31  12.525  -3.430  -0.453
  249   1HG1  VAL  31          1HG1      VAL  31  14.122  -5.468  -0.980
  250   2HG1  VAL  31          2HG1      VAL  31  15.365  -4.287  -0.567
  251   3HG1  VAL  31          3HG1      VAL  31  14.229  -3.951  -1.873
  252   1HG2  VAL  31          1HG2      VAL  31  13.814  -5.180   1.632
  253   2HG2  VAL  31          2HG2      VAL  31  12.383  -5.550   0.670
  254   3HG2  VAL  31          3HG2      VAL  31  12.329  -4.258   1.869
  255    H    PHE  32           H        PHE  32  12.958  -1.078  -0.952
  256    HA   PHE  32           HA       PHE  32  14.777  -0.785  -2.967
  257   1HB   PHE  32          2HB       PHE  32  12.347   0.335  -2.359
  258   2HB   PHE  32          1HB       PHE  32  13.416   1.731  -2.302
  259    HD1  PHE  32           1HD      PHE  32  11.114   0.803  -4.289
  260    HD2  PHE  32           2HD      PHE  32  15.365   0.874  -4.419
  261    HE1  PHE  32           1HE      PHE  32  11.030   0.958  -6.745
  262    HE2  PHE  32           2HE      PHE  32  15.292   1.029  -6.876
  263    HZ   PHE  32           HZ       PHE  32  13.122   1.072  -8.041
  264    H    ASN  33           H        ASN  33  14.602   1.067   0.034
  265    HA   ASN  33           HA       ASN  33  16.892   2.683  -0.676
  266   1HB   ASN  33          2HB       ASN  33  14.759   2.853   1.208
  267   2HB   ASN  33          1HB       ASN  33  16.278   2.908   2.097
  268   1HD2  ASN  33          1HD2      ASN  33  14.472   4.384  -0.533
  269   2HD2  ASN  33          2HD2      ASN  33  15.238   5.929  -0.436
  270    H    PHE  34           H        PHE  34  16.197  -0.123   1.304
  271    HA   PHE  34           HA       PHE  34  18.523  -0.186   2.849
  272   1HB   PHE  34          2HB       PHE  34  16.319  -1.923   2.328
  273   2HB   PHE  34          1HB       PHE  34  17.803  -2.862   2.209
  274    HD1  PHE  34           1HD      PHE  34  19.042  -3.439   4.130
  275    HD2  PHE  34           2HD      PHE  34  15.830  -0.663   4.422
  276    HE1  PHE  34           1HE      PHE  34  19.160  -3.566   6.585
  277    HE2  PHE  34           2HE      PHE  34  15.942  -0.785   6.877
  278    HZ   PHE  34           HZ       PHE  34  17.610  -2.237   7.961
  279    H    LEU  35           H        LEU  35  18.140  -0.646  -0.504
  280    HA   LEU  35           HA       LEU  35  20.950  -1.113  -0.835
  281   1HB   LEU  35          2HB       LEU  35  20.695  -3.210  -2.134
  282   2HB   LEU  35          1HB       LEU  35  20.350  -3.392  -0.424
  283    HG   LEU  35           HG       LEU  35  17.882  -2.819  -1.644
  284   1HD1  LEU  35          1HD1      LEU  35  18.661  -5.239  -3.038
  285   2HD1  LEU  35          2HD1      LEU  35  19.539  -3.821  -3.613
  286   3HD1  LEU  35          3HD1      LEU  35  17.775  -3.831  -3.623
  287   1HD2  LEU  35          1HD2      LEU  35  18.295  -5.625  -1.151
  288   2HD2  LEU  35          2HD2      LEU  35  17.304  -4.463  -0.268
  289   3HD2  LEU  35          3HD2      LEU  35  19.012  -4.650   0.132
  290    H    LYS  36           H        LYS  36  20.886   0.764  -2.062
  291    HA   LYS  36           HA       LYS  36  19.547   0.490  -4.664
  292   1HB   LYS  36          2HB       LYS  36  19.951   3.237  -4.161
  293   2HB   LYS  36          1HB       LYS  36  18.428   2.371  -4.287
  294   1HG   LYS  36          2HG       LYS  36  18.268   2.072  -1.974
  295   2HG   LYS  36          1HG       LYS  36  19.972   2.453  -1.719
  296   1HD   LYS  36          2HD       LYS  36  18.719   4.664  -3.010
  297   2HD   LYS  36          1HD       LYS  36  17.746   4.197  -1.614
  298   1HE   LYS  36          2HE       LYS  36  20.208   4.078  -0.534
  299   2HE   LYS  36          1HE       LYS  36  20.466   5.335  -1.743
  300   1HZ   LYS  36          1HZ       LYS  36  18.033   5.747  -0.332
  301   2HZ   LYS  36          2HZ       LYS  36  19.356   6.786  -0.510
  302   3HZ   LYS  36          3HZ       LYS  36  19.338   5.648   0.740
  303    HA   PRO  37           HA       PRO  37  23.580   2.681  -5.711
  304   1HB   PRO  37          2HB       PRO  37  24.975   4.076  -3.939
  305   2HB   PRO  37          1HB       PRO  37  23.443   4.700  -4.563
  306   1HG   PRO  37          2HG       PRO  37  24.011   3.347  -1.953
  307   2HG   PRO  37          1HG       PRO  37  23.013   4.777  -2.277
  308   1HD   PRO  37          2HD       PRO  37  22.034   2.210  -1.975
  309   2HD   PRO  37          1HD       PRO  37  21.198   3.519  -2.829
  310    H    LYS  38           H        LYS  38  26.113   2.726  -5.069
  311    HA   LYS  38           HA       LYS  38  26.697   0.152  -3.758
  312   1HB   LYS  38          2HB       LYS  38  28.620  -0.030  -5.377
  313   2HB   LYS  38          1HB       LYS  38  27.022  -0.196  -6.092
  314   1HG   LYS  38          2HG       LYS  38  27.993   2.550  -6.088
  315   2HG   LYS  38          1HG       LYS  38  29.025   1.440  -6.992
  316   1HD   LYS  38          2HD       LYS  38  27.416   0.994  -8.550
  317   2HD   LYS  38          1HD       LYS  38  26.092   1.251  -7.412
  318   1HE   LYS  38          2HE       LYS  38  26.244   2.985  -9.188
  319   2HE   LYS  38          1HE       LYS  38  26.349   3.628  -7.550
  320   1HZ   LYS  38          1HZ       LYS  38  28.562   3.239  -9.484
  321   2HZ   LYS  38          2HZ       LYS  38  28.820   3.578  -7.847
  322   3HZ   LYS  38          3HZ       LYS  38  28.008   4.695  -8.824
  323    H    LYS  39           H        LYS  39  26.932   3.313  -3.291
  324    HA   LYS  39           HA       LYS  39  29.654   3.805  -2.783
  325   1HB   LYS  39          2HB       LYS  39  27.218   5.046  -1.491
  326   2HB   LYS  39          1HB       LYS  39  28.852   5.690  -1.411
  327   1HG   LYS  39          2HG       LYS  39  28.869   6.119  -3.766
  328   2HG   LYS  39          1HG       LYS  39  27.323   5.293  -3.972
  329   1HD   LYS  39          2HD       LYS  39  27.816   7.848  -2.445
  330   2HD   LYS  39          1HD       LYS  39  26.973   7.685  -3.987
  331   1HE   LYS  39          2HE       LYS  39  25.521   5.980  -2.537
  332   2HE   LYS  39          1HE       LYS  39  26.063   7.045  -1.241
  333   1HZ   LYS  39          1HZ       LYS  39  24.152   8.081  -1.910
  334   2HZ   LYS  39          2HZ       LYS  39  24.331   7.644  -3.534
  335   3HZ   LYS  39          3HZ       LYS  39  25.277   8.886  -2.884
  336    H    ARG  40           H        ARG  40  27.175   3.574  -0.243
  337    HA   ARG  40           HA       ARG  40  27.156   2.487   1.764
  338   1HB   ARG  40          2HB       ARG  40  28.085   0.563   0.401
  339   2HB   ARG  40          1HB       ARG  40  29.687   1.085   0.904
  340   1HG   ARG  40          2HG       ARG  40  29.446   0.271   2.988
  341   2HG   ARG  40          1HG       ARG  40  27.734   0.692   3.072
  342   1HD   ARG  40          2HD       ARG  40  28.498  -1.450   1.178
  343   2HD   ARG  40          1HD       ARG  40  28.612  -1.830   2.895
  344    HE   ARG  40           HE       ARG  40  26.148  -0.733   2.656
  345   1HH1  ARG  40          1HH1      ARG  40  27.803  -3.320   1.013
  346   2HH1  ARG  40          2HH1      ARG  40  26.353  -4.203   0.671
  347   1HH2  ARG  40          1HH2      ARG  40  24.232  -1.887   2.208
  348   2HH2  ARG  40          2HH2      ARG  40  24.324  -3.389   1.349
  349    H    LYS  41           H        LYS  41  27.819   3.149   3.734
  350    HA   LYS  41           HA       LYS  41  29.722   5.226   3.933
  351   1HB   LYS  41          2HB       LYS  41  27.655   4.397   5.476
  352   2HB   LYS  41          1HB       LYS  41  29.011   3.778   6.409
  353   1HG   LYS  41          2HG       LYS  41  29.212   5.788   7.311
  354   2HG   LYS  41          1HG       LYS  41  29.726   6.386   5.732
  355   1HD   LYS  41          2HD       LYS  41  27.358   6.805   5.161
  356   2HD   LYS  41          1HD       LYS  41  26.899   6.284   6.784
  357   1HE   LYS  41          2HE       LYS  41  27.109   8.431   7.365
  358   2HE   LYS  41          1HE       LYS  41  28.849   8.161   7.266
  359   1HZ   LYS  41          1HZ       LYS  41  28.979   9.166   5.219
  360   2HZ   LYS  41          2HZ       LYS  41  27.774  10.096   5.956
  361   3HZ   LYS  41          3HZ       LYS  41  27.351   8.895   4.843
  362    H    ALA  42           H        ALA  42  30.035   1.826   4.009
  363    HA   ALA  42           HA       ALA  42  32.204   1.438   5.711
  364   1HB   ALA  42          1HB       ALA  42  32.724  -0.528   4.207
  365   2HB   ALA  42          2HB       ALA  42  31.372   0.000   3.205
  366   3HB   ALA  42          3HB       ALA  42  31.095  -0.473   4.881
  Start of MODEL    5
    1   1H    ALA   1          1HT       ALA   1  27.995   5.449  -4.949
    2   2H    ALA   1          2HT       ALA   1  27.170   5.508  -6.452
    3   3H    ALA   1          3HT       ALA   1  28.791   4.948  -6.382
    4    HA   ALA   1           HA       ALA   1  26.493   3.663  -5.071
    5   1HB   ALA   1          1HB       ALA   1  26.284   2.218  -6.848
    6   2HB   ALA   1          2HB       ALA   1  27.923   2.518  -7.425
    7   3HB   ALA   1          3HB       ALA   1  26.665   3.726  -7.678
    8    H    LYS   2           H        LYS   2  27.864   3.559  -3.181
    9    HA   LYS   2           HA       LYS   2  29.483   1.184  -3.170
   10   1HB   LYS   2          2HB       LYS   2  30.719   3.903  -2.865
   11   2HB   LYS   2          1HB       LYS   2  31.419   2.507  -2.058
   12   1HG   LYS   2          2HG       LYS   2  32.568   2.150  -3.918
   13   2HG   LYS   2          1HG       LYS   2  31.048   1.656  -4.665
   14   1HD   LYS   2          2HD       LYS   2  30.676   3.829  -5.548
   15   2HD   LYS   2          1HD       LYS   2  31.975   4.519  -4.573
   16   1HE   LYS   2          2HE       LYS   2  32.880   4.325  -6.727
   17   2HE   LYS   2          1HE       LYS   2  33.532   2.949  -5.839
   18   1HZ   LYS   2          1HZ       LYS   2  31.318   2.935  -7.810
   19   2HZ   LYS   2          2HZ       LYS   2  31.678   1.617  -6.814
   20   3HZ   LYS   2          3HZ       LYS   2  32.818   2.162  -7.937
   21    H    ILE   3           H        ILE   3  28.983   4.156  -1.261
   22    HA   ILE   3           HA       ILE   3  28.842   2.593   1.171
   23    HB   ILE   3           HB       ILE   3  28.694   5.563   0.695
   24   1HG1  ILE   3          2HG1      ILE   3  30.809   3.670   1.693
   25   2HG1  ILE   3          1HG1      ILE   3  30.918   4.852   0.393
   26   1HG2  ILE   3          1HG2      ILE   3  27.719   4.088   2.909
   27   2HG2  ILE   3          2HG2      ILE   3  27.835   5.837   2.721
   28   3HG2  ILE   3          3HG2      ILE   3  29.177   4.935   3.423
   29   1HD1  ILE   3          1HD1      ILE   3  30.455   6.512   2.423
   30   2HD1  ILE   3          2HD1      ILE   3  32.073   5.980   1.966
   31   3HD1  ILE   3          3HD1      ILE   3  31.233   5.197   3.305
   32    HA   PRO   4           HA       PRO   4  24.413   4.542   1.357
   33   1HB   PRO   4          2HB       PRO   4  23.434   5.593  -0.966
   34   2HB   PRO   4          1HB       PRO   4  24.257   6.546   0.275
   35   1HG   PRO   4          2HG       PRO   4  25.342   5.410  -2.273
   36   2HG   PRO   4          1HG       PRO   4  25.605   7.013  -1.561
   37   1HD   PRO   4          2HD       PRO   4  27.431   5.058  -1.353
   38   2HD   PRO   4          1HD       PRO   4  27.159   6.223  -0.042
   39    H    ILE   5           H        ILE   5  25.596   2.760  -1.379
   40    HA   ILE   5           HA       ILE   5  23.342   1.740  -2.536
   41    HB   ILE   5           HB       ILE   5  24.812  -0.518  -2.471
   42   1HG1  ILE   5          2HG1      ILE   5  26.951   1.579  -2.437
   43   2HG1  ILE   5          1HG1      ILE   5  26.419   0.849  -0.924
   44   1HG2  ILE   5          1HG2      ILE   5  24.065   0.901  -4.411
   45   2HG2  ILE   5          2HG2      ILE   5  25.621   0.093  -4.606
   46   3HG2  ILE   5          3HG2      ILE   5  25.563   1.812  -4.213
   47   1HD1  ILE   5          1HD1      ILE   5  27.368  -1.147  -1.398
   48   2HD1  ILE   5          2HD1      ILE   5  28.423  -0.126  -2.375
   49   3HD1  ILE   5          3HD1      ILE   5  27.089  -0.994  -3.133
   50    H    LYS   6           H        LYS   6  25.077  -0.188  -0.117
   51    HA   LYS   6           HA       LYS   6  23.050  -1.947   0.473
   52   1HB   LYS   6          2HB       LYS   6  25.411  -2.138   1.237
   53   2HB   LYS   6          1HB       LYS   6  25.089  -0.900   2.442
   54   1HG   LYS   6          2HG       LYS   6  24.714  -2.674   3.766
   55   2HG   LYS   6          1HG       LYS   6  23.116  -2.633   3.018
   56   1HD   LYS   6          2HD       LYS   6  23.834  -4.276   1.366
   57   2HD   LYS   6          1HD       LYS   6  25.451  -4.294   2.072
   58   1HE   LYS   6          2HE       LYS   6  23.064  -4.900   3.769
   59   2HE   LYS   6          1HE       LYS   6  23.734  -6.143   2.713
   60   1HZ   LYS   6          1HZ       LYS   6  25.788  -6.062   3.837
   61   2HZ   LYS   6          2HZ       LYS   6  24.608  -6.104   5.048
   62   3HZ   LYS   6          3HZ       LYS   6  25.380  -4.647   4.671
   63    H    ALA   7           H        ALA   7  23.351   1.358   1.409
   64    HA   ALA   7           HA       ALA   7  21.577   1.252   3.649
   65   1HB   ALA   7          1HB       ALA   7  22.121   3.729   2.050
   66   2HB   ALA   7          2HB       ALA   7  23.348   3.036   3.111
   67   3HB   ALA   7          3HB       ALA   7  21.804   3.569   3.778
   68    H    ILE   8           H        ILE   8  21.243   2.140   0.244
   69    HA   ILE   8           HA       ILE   8  18.526   2.912   0.381
   70    HB   ILE   8           HB       ILE   8  20.003   3.537  -1.492
   71   1HG1  ILE   8          2HG1      ILE   8  17.680   1.893  -2.506
   72   2HG1  ILE   8          1HG1      ILE   8  17.478   3.440  -1.689
   73   1HG2  ILE   8          1HG2      ILE   8  21.335   1.904  -2.245
   74   2HG2  ILE   8          2HG2      ILE   8  19.962   1.461  -3.259
   75   3HG2  ILE   8          3HG2      ILE   8  20.230   0.631  -1.726
   76   1HD1  ILE   8          1HD1      ILE   8  17.839   4.521  -3.582
   77   2HD1  ILE   8          2HD1      ILE   8  17.928   2.969  -4.415
   78   3HD1  ILE   8          3HD1      ILE   8  19.396   3.718  -3.787
   79    H    LYS   9           H        LYS   9  20.095  -0.153   0.267
   80    HA   LYS   9           HA       LYS   9  17.864  -1.645  -0.725
   81   1HB   LYS   9          2HB       LYS   9  20.334  -2.525   0.778
   82   2HB   LYS   9          1HB       LYS   9  19.161  -3.621   0.061
   83   1HG   LYS   9          2HG       LYS   9  21.148  -1.840  -1.269
   84   2HG   LYS   9          1HG       LYS   9  20.810  -3.551  -1.541
   85   1HD   LYS   9          2HD       LYS   9  18.638  -2.935  -2.533
   86   2HD   LYS   9          1HD       LYS   9  19.041  -1.232  -2.313
   87   1HE   LYS   9          2HE       LYS   9  19.641  -1.591  -4.515
   88   2HE   LYS   9          1HE       LYS   9  21.171  -1.825  -3.670
   89   1HZ   LYS   9          1HZ       LYS   9  19.351  -4.055  -4.387
   90   2HZ   LYS   9          2HZ       LYS   9  20.944  -4.164  -3.831
   91   3HZ   LYS   9          3HZ       LYS   9  20.629  -3.544  -5.373
   92    H    THR  10           H        THR  10  19.263  -1.079   2.478
   93    HA   THR  10           HA       THR  10  17.412  -2.641   3.914
   94    HB   THR  10           HB       THR  10  19.275  -0.408   4.657
   95    HG1  THR  10           1HG      THR  10  20.378  -2.024   5.609
   96   1HG2  THR  10          1HG2      THR  10  17.913   0.115   6.363
   97   2HG2  THR  10          2HG2      THR  10  18.606  -1.342   7.075
   98   3HG2  THR  10          3HG2      THR  10  17.034  -1.411   6.277
   99    H    VAL  11           H        VAL  11  17.396   0.744   2.932
  100    HA   VAL  11           HA       VAL  11  14.999   1.362   4.385
  101    HB   VAL  11           HB       VAL  11  16.559   2.839   2.275
  102   1HG1  VAL  11          1HG1      VAL  11  15.041   4.720   2.527
  103   2HG1  VAL  11          2HG1      VAL  11  14.032   3.782   3.628
  104   3HG1  VAL  11          3HG1      VAL  11  14.168   3.308   1.935
  105   1HG2  VAL  11          1HG2      VAL  11  16.968   2.577   4.944
  106   2HG2  VAL  11          2HG2      VAL  11  15.986   4.041   4.890
  107   3HG2  VAL  11          3HG2      VAL  11  17.496   3.958   3.983
  108    H    GLY  12           H        GLY  12  15.778   0.032   1.298
  109   1HA   GLY  12          2HA       GLY  12  13.298   0.626   0.008
  110   2HA   GLY  12          1HA       GLY  12  14.481  -0.568  -0.510
  111    H    LYS  13           H        LYS  13  14.414  -1.864   2.170
  112    HA   LYS  13           HA       LYS  13  12.151  -3.588   1.621
  113   1HB   LYS  13          2HB       LYS  13  14.203  -3.822   3.827
  114   2HB   LYS  13          1HB       LYS  13  13.098  -5.075   3.278
  115   1HG   LYS  13          2HG       LYS  13  15.269  -3.856   1.588
  116   2HG   LYS  13          1HG       LYS  13  15.416  -5.373   2.477
  117   1HD   LYS  13          2HD       LYS  13  14.140  -6.511   1.000
  118   2HD   LYS  13          1HD       LYS  13  13.059  -5.145   0.723
  119   1HE   LYS  13          2HE       LYS  13  15.105  -4.113  -0.502
  120   2HE   LYS  13          1HE       LYS  13  15.682  -5.778  -0.569
  121   1HZ   LYS  13          1HZ       LYS  13  12.941  -5.206  -1.438
  122   2HZ   LYS  13          2HZ       LYS  13  14.014  -6.397  -1.977
  123   3HZ   LYS  13          3HZ       LYS  13  14.216  -4.792  -2.470
  124    H    ALA  14           H        ALA  14  13.185  -1.297   4.085
  125    HA   ALA  14           HA       ALA  14  10.986  -1.905   5.836
  126   1HB   ALA  14          1HB       ALA  14  11.982   0.621   6.510
  127   2HB   ALA  14          2HB       ALA  14  13.375  -0.305   5.951
  128   3HB   ALA  14          3HB       ALA  14  12.377  -0.921   7.269
  129    H    VAL  15           H        VAL  15  11.818   0.754   3.655
  130    HA   VAL  15           HA       VAL  15   9.278   2.046   4.024
  131    HB   VAL  15           HB       VAL  15  11.297   2.544   1.829
  132   1HG1  VAL  15          1HG1      VAL  15  10.259   4.645   1.542
  133   2HG1  VAL  15          2HG1      VAL  15   9.321   4.470   3.024
  134   3HG1  VAL  15          3HG1      VAL  15   8.949   3.468   1.621
  135   1HG2  VAL  15          1HG2      VAL  15  12.217   4.302   3.252
  136   2HG2  VAL  15          2HG2      VAL  15  12.374   2.721   4.017
  137   3HG2  VAL  15          3HG2      VAL  15  11.117   3.837   4.550
  138    H    GLY  16           H        GLY  16  10.539  -0.464   2.063
  139   1HA   GLY  16          2HA       GLY  16   8.616  -0.195  -0.068
  140   2HA   GLY  16          1HA       GLY  16   9.726  -1.536   0.178
  141    H    LYS  17           H        LYS  17   8.858  -1.952   2.954
  142    HA   LYS  17           HA       LYS  17   6.662  -3.705   2.382
  143   1HB   LYS  17          2HB       LYS  17   8.648  -3.465   4.399
  144   2HB   LYS  17          1HB       LYS  17   7.082  -3.422   5.197
  145   1HG   LYS  17          2HG       LYS  17   7.531  -5.669   5.186
  146   2HG   LYS  17          1HG       LYS  17   6.575  -5.500   3.713
  147   1HD   LYS  17          2HD       LYS  17   8.278  -6.162   2.431
  148   2HD   LYS  17          1HD       LYS  17   9.396  -5.049   3.223
  149   1HE   LYS  17          2HE       LYS  17  10.170  -7.313   3.528
  150   2HE   LYS  17          1HE       LYS  17   9.635  -6.663   5.077
  151   1HZ   LYS  17          1HZ       LYS  17   7.493  -7.826   4.702
  152   2HZ   LYS  17          2HZ       LYS  17   8.812  -8.873   4.858
  153   3HZ   LYS  17          3HZ       LYS  17   8.161  -8.557   3.330
  154    H    GLY  18           H        GLY  18   7.082  -0.727   4.253
  155   1HA   GLY  18          2HA       GLY  18   4.421  -0.623   5.226
  156   2HA   GLY  18          1HA       GLY  18   5.530   0.738   5.117
  157    H    LEU  19           H        LEU  19   5.954   0.507   2.283
  158    HA   LEU  19           HA       LEU  19   3.873   2.148   1.353
  159   1HB   LEU  19          2HB       LEU  19   5.749   2.531   0.128
  160   2HB   LEU  19          1HB       LEU  19   6.264   0.858   0.195
  161    HG   LEU  19           HG       LEU  19   4.747   0.259  -1.589
  162   1HD1  LEU  19          1HD1      LEU  19   3.906   2.935  -2.330
  163   2HD1  LEU  19          2HD1      LEU  19   3.275   2.443  -0.759
  164   3HD1  LEU  19          3HD1      LEU  19   2.964   1.452  -2.185
  165   1HD2  LEU  19          1HD2      LEU  19   6.562   0.839  -2.767
  166   2HD2  LEU  19          2HD2      LEU  19   6.767   2.355  -1.888
  167   3HD2  LEU  19          3HD2      LEU  19   5.622   2.259  -3.226
  168    H    ARG  20           H        ARG  20   4.571  -1.289   0.811
  169    HA   ARG  20           HA       ARG  20   2.445  -1.753  -0.964
  170   1HB   ARG  20          2HB       ARG  20   4.468  -3.294   0.237
  171   2HB   ARG  20          1HB       ARG  20   2.952  -4.058   0.698
  172   1HG   ARG  20          2HG       ARG  20   4.139  -4.806  -1.468
  173   2HG   ARG  20          1HG       ARG  20   2.390  -4.570  -1.483
  174   1HD   ARG  20          2HD       ARG  20   2.510  -2.766  -2.843
  175   2HD   ARG  20          1HD       ARG  20   4.023  -2.203  -2.138
  176    HE   ARG  20           HE       ARG  20   3.752  -3.681  -4.508
  177   1HH1  ARG  20          1HH1      ARG  20   5.709  -3.587  -1.628
  178   2HH1  ARG  20          2HH1      ARG  20   7.109  -4.252  -2.402
  179   1HH2  ARG  20          1HH2      ARG  20   5.584  -4.562  -5.535
  180   2HH2  ARG  20          2HH2      ARG  20   7.037  -4.807  -4.625
  181    H    ALA  21           H        ALA  21   2.656  -2.279   2.540
  182    HA   ALA  21           HA       ALA  21   0.112  -3.204   3.013
  183   1HB   ALA  21          1HB       ALA  21   1.352  -3.190   4.936
  184   2HB   ALA  21          2HB       ALA  21   0.390  -1.736   5.206
  185   3HB   ALA  21          3HB       ALA  21   2.044  -1.601   4.609
  186    H    ILE  22           H        ILE  22   1.170   0.004   2.168
  187    HA   ILE  22           HA       ILE  22  -1.355   1.251   2.777
  188    HB   ILE  22           HB       ILE  22   1.080   2.229   1.290
  189   1HG1  ILE  22          2HG1      ILE  22   1.620   2.275   3.545
  190   2HG1  ILE  22          1HG1      ILE  22   0.931   3.880   3.324
  191   1HG2  ILE  22          1HG2      ILE  22  -1.417   3.789   1.943
  192   2HG2  ILE  22          2HG2      ILE  22  -0.959   3.227   0.336
  193   3HG2  ILE  22          3HG2      ILE  22   0.041   4.414   1.173
  194   1HD1  ILE  22          1HD1      ILE  22  -1.267   2.859   4.096
  195   2HD1  ILE  22          2HD1      ILE  22  -0.003   3.080   5.307
  196   3HD1  ILE  22          3HD1      ILE  22  -0.302   1.481   4.625
  197    H    ASN  23           H        ASN  23   0.102  -0.385   0.079
  198    HA   ASN  23           HA       ASN  23  -1.748   0.661  -1.855
  199   1HB   ASN  23          2HB       ASN  23  -0.565  -0.517  -3.427
  200   2HB   ASN  23          1HB       ASN  23   0.668  -0.313  -2.201
  201   1HD2  ASN  23          1HD2      ASN  23  -1.613  -2.520  -3.646
  202   2HD2  ASN  23          2HD2      ASN  23  -0.853  -3.974  -3.104
  203    H    ILE  24           H        ILE  24  -1.216  -2.351  -0.205
  204    HA   ILE  24           HA       ILE  24  -3.381  -3.769  -1.224
  205    HB   ILE  24           HB       ILE  24  -1.385  -4.184   0.703
  206   1HG1  ILE  24          2HG1      ILE  24  -1.910  -6.478   0.411
  207   2HG1  ILE  24          1HG1      ILE  24  -3.592  -6.116   0.019
  208   1HG2  ILE  24          1HG2      ILE  24  -2.539  -5.158   2.602
  209   2HG2  ILE  24          2HG2      ILE  24  -4.089  -4.649   1.932
  210   3HG2  ILE  24          3HG2      ILE  24  -2.910  -3.441   2.443
  211   1HD1  ILE  24          1HD1      ILE  24  -1.915  -6.696  -1.871
  212   2HD1  ILE  24          2HD1      ILE  24  -1.410  -5.017  -1.681
  213   3HD1  ILE  24          3HD1      ILE  24  -3.081  -5.393  -2.101
  214    H    ALA  25           H        ALA  25  -3.061  -1.363   1.248
  215    HA   ALA  25           HA       ALA  25  -5.767  -1.637   2.167
  216   1HB   ALA  25          1HB       ALA  25  -4.525  -0.902   3.930
  217   2HB   ALA  25          2HB       ALA  25  -5.031   0.660   3.287
  218   3HB   ALA  25          3HB       ALA  25  -3.429   0.027   2.907
  219    H    SER  26           H        SER  26  -4.117  -0.065  -0.349
  220    HA   SER  26           HA       SER  26  -6.062   2.077  -0.640
  221   1HB   SER  26          2HB       SER  26  -3.476   1.354  -1.903
  222   2HB   SER  26          1HB       SER  26  -4.625   2.226  -2.916
  223    HG   SER  26           HG       SER  26  -3.524   3.032  -0.435
  224    H    THR  27           H        THR  27  -5.407  -1.081  -1.937
  225    HA   THR  27           HA       THR  27  -7.186  -0.794  -4.184
  226    HB   THR  27           HB       THR  27  -5.863  -3.226  -2.968
  227    HG1  THR  27           1HG      THR  27  -5.240  -2.163  -5.475
  228   1HG2  THR  27          1HG2      THR  27  -6.671  -3.430  -5.747
  229   2HG2  THR  27          2HG2      THR  27  -8.037  -3.302  -4.640
  230   3HG2  THR  27          3HG2      THR  27  -6.845  -4.583  -4.423
  231    H    ALA  28           H        ALA  28  -7.326  -2.088  -0.925
  232    HA   ALA  28           HA       ALA  28  -9.863  -3.357  -1.211
  233   1HB   ALA  28          1HB       ALA  28  -7.978  -2.807   0.976
  234   2HB   ALA  28          2HB       ALA  28  -8.910  -4.261   0.616
  235   3HB   ALA  28          3HB       ALA  28  -9.673  -2.908   1.454
  236    H    ASN  29           H        ASN  29  -8.816  -0.116  -0.551
  237    HA   ASN  29           HA       ASN  29 -11.171   0.851   0.673
  238   1HB   ASN  29          2HB       ASN  29  -8.673   1.932  -0.253
  239   2HB   ASN  29          1HB       ASN  29  -9.996   2.965  -0.787
  240   1HD2  ASN  29          1HD2      ASN  29  -8.861   1.238   2.094
  241   2HD2  ASN  29          2HD2      ASN  29  -9.308   2.471   3.219
  242    H    ASP  30           H        ASP  30 -10.024   1.208  -2.675
  243    HA   ASP  30           HA       ASP  30 -12.362   2.372  -3.686
  244   1HB   ASP  30          2HB       ASP  30  -9.889   1.307  -4.753
  245   2HB   ASP  30          1HB       ASP  30 -11.249   0.888  -5.790
  246    H    VAL  31           H        VAL  31 -11.510  -0.938  -3.042
  247    HA   VAL  31           HA       VAL  31 -13.624  -2.115  -4.565
  248    HB   VAL  31           HB       VAL  31 -11.963  -3.256  -2.315
  249   1HG1  VAL  31          1HG1      VAL  31 -14.128  -4.404  -2.568
  250   2HG1  VAL  31          2HG1      VAL  31 -12.765  -5.433  -3.009
  251   3HG1  VAL  31          3HG1      VAL  31 -13.756  -4.695  -4.267
  252   1HG2  VAL  31          1HG2      VAL  31 -11.173  -2.572  -4.849
  253   2HG2  VAL  31          2HG2      VAL  31 -11.583  -4.279  -5.021
  254   3HG2  VAL  31          3HG2      VAL  31 -10.393  -3.774  -3.821
  255    H    PHE  32           H        PHE  32 -13.111  -1.476  -1.116
  256    HA   PHE  32           HA       PHE  32 -15.611  -2.456  -0.247
  257   1HB   PHE  32          2HB       PHE  32 -13.941  -2.207   1.410
  258   2HB   PHE  32          1HB       PHE  32 -13.622  -0.537   0.954
  259    HD1  PHE  32           1HD      PHE  32 -16.769  -2.364   1.772
  260    HD2  PHE  32           2HD      PHE  32 -14.126   0.834   2.722
  261    HE1  PHE  32           1HE      PHE  32 -18.329  -1.596   3.512
  262    HE2  PHE  32           2HE      PHE  32 -15.681   1.607   4.464
  263    HZ   PHE  32           HZ       PHE  32 -17.786   0.392   4.862
  264    H    ASN  33           H        ASN  33 -14.698   0.393  -1.878
  265    HA   ASN  33           HA       ASN  33 -17.046   1.895  -1.052
  266   1HB   ASN  33          2HB       ASN  33 -14.761   2.942  -1.459
  267   2HB   ASN  33          1HB       ASN  33 -15.047   2.672  -3.175
  268   1HD2  ASN  33          1HD2      ASN  33 -15.059   4.988  -0.998
  269   2HD2  ASN  33          2HD2      ASN  33 -16.347   5.988  -1.570
  270    H    PHE  34           H        PHE  34 -15.868   0.035  -3.769
  271    HA   PHE  34           HA       PHE  34 -17.879   0.858  -5.613
  272   1HB   PHE  34          2HB       PHE  34 -15.537  -0.608  -5.779
  273   2HB   PHE  34          1HB       PHE  34 -16.786  -1.814  -6.068
  274    HD1  PHE  34           1HD      PHE  34 -15.582   1.511  -7.189
  275    HD2  PHE  34           2HD      PHE  34 -17.806  -1.986  -8.152
  276    HE1  PHE  34           1HE      PHE  34 -15.783   2.285  -9.516
  277    HE2  PHE  34           2HE      PHE  34 -18.010  -1.220 -10.481
  278    HZ   PHE  34           HZ       PHE  34 -16.998   0.919 -11.166
  279    H    LEU  35           H        LEU  35 -17.715  -1.481  -3.069
  280    HA   LEU  35           HA       LEU  35 -19.964  -3.031  -3.963
  281   1HB   LEU  35          2HB       LEU  35 -18.084  -3.069  -1.710
  282   2HB   LEU  35          1HB       LEU  35 -19.705  -3.593  -1.298
  283    HG   LEU  35           HG       LEU  35 -18.133  -5.434  -1.935
  284   1HD1  LEU  35          1HD1      LEU  35 -19.816  -6.333  -3.757
  285   2HD1  LEU  35          2HD1      LEU  35 -20.755  -4.933  -3.240
  286   3HD1  LEU  35          3HD1      LEU  35 -20.290  -6.165  -2.067
  287   1HD2  LEU  35          1HD2      LEU  35 -17.681  -5.752  -4.334
  288   2HD2  LEU  35          2HD2      LEU  35 -16.900  -4.309  -3.687
  289   3HD2  LEU  35          3HD2      LEU  35 -18.366  -4.159  -4.657
  290    H    LYS  36           H        LYS  36 -19.715  -1.638  -0.746
  291    HA   LYS  36           HA       LYS  36 -21.617  -1.066   0.545
  292   1HB   LYS  36          2HB       LYS  36 -21.920   1.494  -0.325
  293   2HB   LYS  36          1HB       LYS  36 -20.632   0.943   0.737
  294   1HG   LYS  36          2HG       LYS  36 -19.171   0.630  -1.197
  295   2HG   LYS  36          1HG       LYS  36 -20.463   1.196  -2.258
  296   1HD   LYS  36          2HD       LYS  36 -19.604   2.906   0.027
  297   2HD   LYS  36          1HD       LYS  36 -18.600   2.840  -1.421
  298   1HE   LYS  36          2HE       LYS  36 -21.513   3.256  -1.789
  299   2HE   LYS  36          1HE       LYS  36 -20.577   4.599  -1.134
  300   1HZ   LYS  36          1HZ       LYS  36 -20.797   4.556  -3.608
  301   2HZ   LYS  36          2HZ       LYS  36 -19.834   3.165  -3.621
  302   3HZ   LYS  36          3HZ       LYS  36 -19.203   4.624  -3.043
  303    HA   PRO  37           HA       PRO  37 -24.838  -1.711  -2.831
  304   1HB   PRO  37          2HB       PRO  37 -26.188  -3.594  -1.335
  305   2HB   PRO  37          1HB       PRO  37 -24.964  -3.973  -2.551
  306   1HG   PRO  37          2HG       PRO  37 -24.689  -3.788   0.421
  307   2HG   PRO  37          1HG       PRO  37 -23.986  -4.970  -0.698
  308   1HD   PRO  37          2HD       PRO  37 -22.529  -2.951   0.296
  309   2HD   PRO  37          1HD       PRO  37 -22.307  -3.516  -1.374
  310    H    LYS  38           H        LYS  38 -26.096   0.052  -2.678
  311    HA   LYS  38           HA       LYS  38 -27.732   1.464  -1.966
  312   1HB   LYS  38          2HB       LYS  38 -28.308  -0.948  -0.270
  313   2HB   LYS  38          1HB       LYS  38 -29.221   0.538  -0.053
  314   1HG   LYS  38          2HG       LYS  38 -30.593  -0.333  -1.584
  315   2HG   LYS  38          1HG       LYS  38 -29.378   0.207  -2.745
  316   1HD   LYS  38          2HD       LYS  38 -28.286  -2.114  -2.234
  317   2HD   LYS  38          1HD       LYS  38 -29.909  -2.536  -1.685
  318   1HE   LYS  38          2HE       LYS  38 -29.738  -1.170  -4.295
  319   2HE   LYS  38          1HE       LYS  38 -29.068  -2.800  -4.233
  320   1HZ   LYS  38          1HZ       LYS  38 -31.537  -2.502  -4.804
  321   2HZ   LYS  38          2HZ       LYS  38 -31.753  -2.242  -3.147
  322   3HZ   LYS  38          3HZ       LYS  38 -31.112  -3.707  -3.695
  323    H    LYS  39           H        LYS  39 -25.146   1.837  -0.991
  324    HA   LYS  39           HA       LYS  39 -23.906   2.725   0.726
  325   1HB   LYS  39          2HB       LYS  39 -26.466   4.276   1.146
  326   2HB   LYS  39          1HB       LYS  39 -24.844   4.788   1.591
  327   1HG   LYS  39          2HG       LYS  39 -25.839   4.341  -1.215
  328   2HG   LYS  39          1HG       LYS  39 -25.613   5.905  -0.430
  329   1HD   LYS  39          2HD       LYS  39 -23.193   5.263  -0.117
  330   2HD   LYS  39          1HD       LYS  39 -23.506   3.887  -1.177
  331   1HE   LYS  39          2HE       LYS  39 -24.043   6.748  -1.949
  332   2HE   LYS  39          1HE       LYS  39 -22.534   5.908  -2.306
  333   1HZ   LYS  39          1HZ       LYS  39 -23.556   4.521  -3.806
  334   2HZ   LYS  39          2HZ       LYS  39 -24.416   5.956  -4.056
  335   3HZ   LYS  39          3HZ       LYS  39 -25.095   4.716  -3.129
  336    H    ARG  40           H        ARG  40 -25.356   0.330   1.471
  337    HA   ARG  40           HA       ARG  40 -25.620  -0.921   3.358
  338   1HB   ARG  40          2HB       ARG  40 -24.195   1.434   4.307
  339   2HB   ARG  40          1HB       ARG  40 -25.252   0.759   5.540
  340   1HG   ARG  40          2HG       ARG  40 -23.980  -1.449   4.453
  341   2HG   ARG  40          1HG       ARG  40 -22.724  -0.212   4.535
  342   1HD   ARG  40          2HD       ARG  40 -22.501  -0.693   6.694
  343   2HD   ARG  40          1HD       ARG  40 -24.106  -0.008   6.948
  344    HE   ARG  40           HE       ARG  40 -24.932  -2.127   7.223
  345   1HH1  ARG  40          1HH1      ARG  40 -21.755  -2.311   5.805
  346   2HH1  ARG  40          2HH1      ARG  40 -21.643  -4.032   5.965
  347   1HH2  ARG  40          1HH2      ARG  40 -24.794  -4.391   7.439
  348   2HH2  ARG  40          2HH2      ARG  40 -23.372  -5.215   6.894
  349    H    LYS  41           H        LYS  41 -26.743   2.382   4.124
  350    HA   LYS  41           HA       LYS  41 -29.437   1.288   4.519
  351   1HB   LYS  41          2HB       LYS  41 -29.651   2.894   6.488
  352   2HB   LYS  41          1HB       LYS  41 -28.687   1.447   6.747
  353   1HG   LYS  41          2HG       LYS  41 -27.072   2.766   7.491
  354   2HG   LYS  41          1HG       LYS  41 -26.872   3.345   5.836
  355   1HD   LYS  41          2HD       LYS  41 -29.100   4.651   7.119
  356   2HD   LYS  41          1HD       LYS  41 -27.628   4.839   8.075
  357   1HE   LYS  41          2HE       LYS  41 -26.555   6.031   6.438
  358   2HE   LYS  41          1HE       LYS  41 -27.473   5.276   5.136
  359   1HZ   LYS  41          1HZ       LYS  41 -29.440   6.559   6.146
  360   2HZ   LYS  41          2HZ       LYS  41 -28.316   7.409   5.211
  361   3HZ   LYS  41          3HZ       LYS  41 -28.255   7.505   6.899
  362    H    ALA  42           H        ALA  42 -27.678   3.229   2.714
  363    HA   ALA  42           HA       ALA  42 -29.811   5.246   2.456
  364   1HB   ALA  42          1HB       ALA  42 -28.075   6.535   3.274
  365   2HB   ALA  42          2HB       ALA  42 -27.874   6.708   1.531
  366   3HB   ALA  42          3HB       ALA  42 -26.843   5.596   2.431
  Start of MODEL    6
    1   1H    ALA   1          1HT       ALA   1 -30.543  -2.944   4.701
    2   2H    ALA   1          2HT       ALA   1 -31.595  -4.150   5.322
    3   3H    ALA   1          3HT       ALA   1 -32.156  -2.541   5.116
    4    HA   ALA   1           HA       ALA   1 -31.449  -4.511   3.058
    5   1HB   ALA   1          1HB       ALA   1 -33.847  -3.867   4.352
    6   2HB   ALA   1          2HB       ALA   1 -33.635  -4.867   2.915
    7   3HB   ALA   1          3HB       ALA   1 -33.954  -3.141   2.748
    8    H    LYS   2           H        LYS   2 -29.673  -2.677   2.818
    9    HA   LYS   2           HA       LYS   2 -30.726  -0.497   1.164
   10   1HB   LYS   2          2HB       LYS   2 -28.579  -0.697   3.037
   11   2HB   LYS   2          1HB       LYS   2 -27.906  -0.301   1.462
   12   1HG   LYS   2          2HG       LYS   2 -28.327   1.750   2.533
   13   2HG   LYS   2          1HG       LYS   2 -29.603   1.555   1.330
   14   1HD   LYS   2          2HD       LYS   2 -31.020   2.000   3.003
   15   2HD   LYS   2          1HD       LYS   2 -30.678   0.360   3.559
   16   1HE   LYS   2          2HE       LYS   2 -29.601   1.103   5.364
   17   2HE   LYS   2          1HE       LYS   2 -28.643   2.237   4.412
   18   1HZ   LYS   2          1HZ       LYS   2 -31.110   3.367   4.449
   19   2HZ   LYS   2          2HZ       LYS   2 -29.816   3.802   5.448
   20   3HZ   LYS   2          3HZ       LYS   2 -30.982   2.710   6.004
   21    H    ILE   3           H        ILE   3 -30.038  -0.144  -0.932
   22    HA   ILE   3           HA       ILE   3 -29.103  -2.517  -2.319
   23    HB   ILE   3           HB       ILE   3 -29.871   0.115  -3.563
   24   1HG1  ILE   3          2HG1      ILE   3 -31.949  -1.842  -3.759
   25   2HG1  ILE   3          1HG1      ILE   3 -31.527  -1.640  -2.062
   26   1HG2  ILE   3          1HG2      ILE   3 -30.074  -2.656  -4.710
   27   2HG2  ILE   3          2HG2      ILE   3 -28.641  -1.646  -4.893
   28   3HG2  ILE   3          3HG2      ILE   3 -30.185  -1.113  -5.556
   29   1HD1  ILE   3          1HD1      ILE   3 -32.863   0.201  -3.911
   30   2HD1  ILE   3          2HD1      ILE   3 -31.664   0.937  -2.848
   31   3HD1  ILE   3          3HD1      ILE   3 -33.014   0.031  -2.163
   32    HA   PRO   4           HA       PRO   4 -25.655   0.605  -3.468
   33   1HB   PRO   4          2HB       PRO   4 -25.454   2.915  -2.123
   34   2HB   PRO   4          1HB       PRO   4 -26.575   2.723  -3.476
   35   1HG   PRO   4          2HG       PRO   4 -27.120   2.697  -0.542
   36   2HG   PRO   4          1HG       PRO   4 -28.087   3.384  -1.859
   37   1HD   PRO   4          2HD       PRO   4 -28.555   0.935  -0.636
   38   2HD   PRO   4          1HD       PRO   4 -29.166   1.414  -2.231
   39    H    ILE   5           H        ILE   5 -26.434  -0.465  -0.382
   40    HA   ILE   5           HA       ILE   5 -24.297   0.276   1.215
   41    HB   ILE   5           HB       ILE   5 -26.296  -1.081   1.928
   42   1HG1  ILE   5          2HG1      ILE   5 -24.001  -0.749   3.169
   43   2HG1  ILE   5          1HG1      ILE   5 -25.199  -1.872   3.803
   44   1HG2  ILE   5          1HG2      ILE   5 -25.971  -3.570   1.826
   45   2HG2  ILE   5          2HG2      ILE   5 -24.687  -3.278   0.652
   46   3HG2  ILE   5          3HG2      ILE   5 -26.343  -2.794   0.286
   47   1HD1  ILE   5          1HD1      ILE   5 -22.758  -2.558   2.187
   48   2HD1  ILE   5          2HD1      ILE   5 -23.997  -3.714   2.675
   49   3HD1  ILE   5          3HD1      ILE   5 -23.033  -2.885   3.898
   50    H    LYS   6           H        LYS   6 -24.475  -2.228  -1.249
   51    HA   LYS   6           HA       LYS   6 -21.896  -3.322  -0.679
   52   1HB   LYS   6          2HB       LYS   6 -22.182  -4.523  -2.819
   53   2HB   LYS   6          1HB       LYS   6 -23.580  -4.692  -1.766
   54   1HG   LYS   6          2HG       LYS   6 -24.283  -2.519  -3.234
   55   2HG   LYS   6          1HG       LYS   6 -23.345  -3.449  -4.405
   56   1HD   LYS   6          2HD       LYS   6 -25.320  -4.937  -2.773
   57   2HD   LYS   6          1HD       LYS   6 -25.958  -3.842  -4.002
   58   1HE   LYS   6          2HE       LYS   6 -23.743  -5.559  -4.888
   59   2HE   LYS   6          1HE       LYS   6 -25.224  -6.416  -4.459
   60   1HZ   LYS   6          1HZ       LYS   6 -25.847  -5.925  -6.530
   61   2HZ   LYS   6          2HZ       LYS   6 -24.674  -4.721  -6.720
   62   3HZ   LYS   6          3HZ       LYS   6 -26.137  -4.361  -5.952
   63    H    ALA   7           H        ALA   7 -23.145  -0.808  -2.764
   64    HA   ALA   7           HA       ALA   7 -20.784  -0.509  -4.337
   65   1HB   ALA   7          1HB       ALA   7 -23.094   0.222  -5.007
   66   2HB   ALA   7          2HB       ALA   7 -21.821   1.416  -5.263
   67   3HB   ALA   7          3HB       ALA   7 -22.912   1.572  -3.886
   68    H    ILE   8           H        ILE   8 -21.990   0.932  -1.368
   69    HA   ILE   8           HA       ILE   8 -20.020   2.987  -1.209
   70    HB   ILE   8           HB       ILE   8 -22.116   3.186   0.013
   71   1HG1  ILE   8          2HG1      ILE   8 -19.635   3.009   1.729
   72   2HG1  ILE   8          1HG1      ILE   8 -20.293   4.437   0.937
   73   1HG2  ILE   8          1HG2      ILE   8 -22.461   1.780   2.060
   74   2HG2  ILE   8          2HG2      ILE   8 -21.145   0.751   1.494
   75   3HG2  ILE   8          3HG2      ILE   8 -22.613   0.916   0.530
   76   1HD1  ILE   8          1HD1      ILE   8 -20.710   3.637   3.553
   77   2HD1  ILE   8          2HD1      ILE   8 -22.219   3.251   2.726
   78   3HD1  ILE   8          3HD1      ILE   8 -21.582   4.895   2.678
   79    H    LYS   9           H        LYS   9 -20.240  -0.326  -0.089
   80    HA   LYS   9           HA       LYS   9 -17.920  -0.218   1.575
   81   1HB   LYS   9          2HB       LYS   9 -19.457  -2.541   0.402
   82   2HB   LYS   9          1HB       LYS   9 -18.119  -2.720   1.529
   83   1HG   LYS   9          2HG       LYS   9 -20.597  -1.139   2.152
   84   2HG   LYS   9          1HG       LYS   9 -20.408  -2.851   2.538
   85   1HD   LYS   9          2HD       LYS   9 -18.482  -2.350   3.927
   86   2HD   LYS   9          1HD       LYS   9 -18.584  -0.644   3.489
   87   1HE   LYS   9          2HE       LYS   9 -20.295  -0.249   4.903
   88   2HE   LYS   9          1HE       LYS   9 -21.048  -1.813   4.594
   89   1HZ   LYS   9          1HZ       LYS   9 -19.880  -2.807   6.249
   90   2HZ   LYS   9          2HZ       LYS   9 -19.932  -1.243   6.891
   91   3HZ   LYS   9          3HZ       LYS   9 -18.541  -1.783   6.097
   92    H    THR  10           H        THR  10 -18.533  -0.848  -1.790
   93    HA   THR  10           HA       THR  10 -16.023  -2.094  -2.342
   94    HB   THR  10           HB       THR  10 -18.208  -0.921  -4.036
   95    HG1  THR  10           1HG      THR  10 -17.099  -3.506  -3.708
   96   1HG2  THR  10          1HG2      THR  10 -15.457  -1.282  -4.859
   97   2HG2  THR  10          2HG2      THR  10 -16.807  -0.525  -5.706
   98   3HG2  THR  10          3HG2      THR  10 -16.578  -2.272  -5.794
   99    H    VAL  11           H        VAL  11 -17.223   1.202  -2.360
  100    HA   VAL  11           HA       VAL  11 -14.955   2.307  -3.695
  101    HB   VAL  11           HB       VAL  11 -17.447   3.252  -3.110
  102   1HG1  VAL  11          1HG1      VAL  11 -17.232   5.212  -1.687
  103   2HG1  VAL  11          2HG1      VAL  11 -15.558   4.787  -1.331
  104   3HG1  VAL  11          3HG1      VAL  11 -16.869   3.741  -0.784
  105   1HG2  VAL  11          1HG2      VAL  11 -15.502   5.377  -3.624
  106   2HG2  VAL  11          2HG2      VAL  11 -16.881   4.839  -4.582
  107   3HG2  VAL  11          3HG2      VAL  11 -15.349   3.971  -4.677
  108    H    GLY  12           H        GLY  12 -15.837   1.708  -0.360
  109   1HA   GLY  12          2HA       GLY  12 -13.724   3.237   0.800
  110   2HA   GLY  12          1HA       GLY  12 -14.694   2.021   1.616
  111    H    LYS  13           H        LYS  13 -14.017  -0.116  -0.241
  112    HA   LYS  13           HA       LYS  13 -11.534  -0.902   0.981
  113   1HB   LYS  13          2HB       LYS  13 -11.878  -3.039  -0.123
  114   2HB   LYS  13          1HB       LYS  13 -13.371  -2.511   0.641
  115   1HG   LYS  13          2HG       LYS  13 -13.947  -1.563  -1.693
  116   2HG   LYS  13          1HG       LYS  13 -12.682  -2.655  -2.261
  117   1HD   LYS  13          2HD       LYS  13 -15.213  -3.365  -0.789
  118   2HD   LYS  13          1HD       LYS  13 -14.756  -3.818  -2.432
  119   1HE   LYS  13          2HE       LYS  13 -12.686  -4.709  -0.745
  120   2HE   LYS  13          1HE       LYS  13 -14.199  -5.156   0.041
  121   1HZ   LYS  13          1HZ       LYS  13 -13.766  -5.714  -2.824
  122   2HZ   LYS  13          2HZ       LYS  13 -14.836  -6.461  -1.749
  123   3HZ   LYS  13          3HZ       LYS  13 -13.176  -6.770  -1.641
  124    H    ALA  14           H        ALA  14 -12.558   0.287  -2.138
  125    HA   ALA  14           HA       ALA  14 -10.204  -0.453  -3.559
  126   1HB   ALA  14          1HB       ALA  14 -12.684   0.743  -4.183
  127   2HB   ALA  14          2HB       ALA  14 -11.435   0.181  -5.295
  128   3HB   ALA  14          3HB       ALA  14 -11.422   1.849  -4.724
  129    H    VAL  15           H        VAL  15 -11.287   2.560  -2.045
  130    HA   VAL  15           HA       VAL  15  -8.900   3.992  -2.677
  131    HB   VAL  15           HB       VAL  15 -10.958   4.617  -0.555
  132   1HG1  VAL  15          1HG1      VAL  15  -8.510   5.927  -1.430
  133   2HG1  VAL  15          2HG1      VAL  15  -9.479   6.189   0.019
  134   3HG1  VAL  15          3HG1      VAL  15  -9.919   6.985  -1.493
  135   1HG2  VAL  15          1HG2      VAL  15 -10.800   5.547  -3.421
  136   2HG2  VAL  15          2HG2      VAL  15 -11.971   6.091  -2.220
  137   3HG2  VAL  15          3HG2      VAL  15 -11.980   4.413  -2.764
  138    H    GLY  16           H        GLY  16  -9.881   1.858  -0.146
  139   1HA   GLY  16          2HA       GLY  16  -7.872   2.701   1.739
  140   2HA   GLY  16          1HA       GLY  16  -8.903   1.284   1.874
  141    H    LYS  17           H        LYS  17  -8.091   0.361  -0.840
  142    HA   LYS  17           HA       LYS  17  -5.705  -1.041   0.015
  143   1HB   LYS  17          2HB       LYS  17  -7.882  -1.589  -1.737
  144   2HB   LYS  17          1HB       LYS  17  -6.399  -1.674  -2.679
  145   1HG   LYS  17          2HG       LYS  17  -5.615  -3.487  -1.548
  146   2HG   LYS  17          1HG       LYS  17  -6.452  -3.057  -0.055
  147   1HD   LYS  17          2HD       LYS  17  -8.520  -3.864  -0.869
  148   2HD   LYS  17          1HD       LYS  17  -7.912  -3.968  -2.523
  149   1HE   LYS  17          2HE       LYS  17  -6.233  -5.666  -1.595
  150   2HE   LYS  17          1HE       LYS  17  -7.274  -5.726  -0.174
  151   1HZ   LYS  17          1HZ       LYS  17  -7.590  -7.313  -2.267
  152   2HZ   LYS  17          2HZ       LYS  17  -8.587  -6.036  -2.752
  153   3HZ   LYS  17          3HZ       LYS  17  -8.880  -6.826  -1.286
  154    H    GLY  18           H        GLY  18  -6.651   1.312  -2.425
  155   1HA   GLY  18          2HA       GLY  18  -4.220   1.322  -3.871
  156   2HA   GLY  18          1HA       GLY  18  -5.406   2.619  -3.848
  157    H    LEU  19           H        LEU  19  -5.351   3.224  -1.110
  158    HA   LEU  19           HA       LEU  19  -2.979   4.834  -1.012
  159   1HB   LEU  19          2HB       LEU  19  -4.855   5.908  -0.148
  160   2HB   LEU  19          1HB       LEU  19  -5.390   4.487   0.726
  161    HG   LEU  19           HG       LEU  19  -2.993   5.080   1.957
  162   1HD1  LEU  19          1HD1      LEU  19  -4.426   7.667   1.378
  163   2HD1  LEU  19          2HD1      LEU  19  -2.854   7.198   0.731
  164   3HD1  LEU  19          3HD1      LEU  19  -3.054   7.450   2.464
  165   1HD2  LEU  19          1HD2      LEU  19  -4.677   4.489   3.373
  166   2HD2  LEU  19          2HD2      LEU  19  -5.872   5.493   2.552
  167   3HD2  LEU  19          3HD2      LEU  19  -4.688   6.233   3.630
  168    H    ARG  20           H        ARG  20  -4.237   2.061   0.785
  169    HA   ARG  20           HA       ARG  20  -2.147   1.902   2.664
  170   1HB   ARG  20          2HB       ARG  20  -4.268   0.735   2.985
  171   2HB   ARG  20          1HB       ARG  20  -3.938  -0.281   1.588
  172   1HG   ARG  20          2HG       ARG  20  -3.504  -1.193   3.972
  173   2HG   ARG  20          1HG       ARG  20  -2.335  -1.513   2.689
  174   1HD   ARG  20          2HD       ARG  20  -1.072  -0.850   4.567
  175   2HD   ARG  20          1HD       ARG  20  -1.093   0.541   3.487
  176    HE   ARG  20           HE       ARG  20  -3.063   1.253   5.002
  177   1HH1  ARG  20          1HH1      ARG  20  -0.164  -0.392   6.061
  178   2HH1  ARG  20          2HH1      ARG  20  -0.235   0.261   7.661
  179   1HH2  ARG  20          1HH2      ARG  20  -3.142   2.111   7.106
  180   2HH2  ARG  20          2HH2      ARG  20  -1.918   1.682   8.253
  181    H    ALA  21           H        ALA  21  -2.644   0.253  -0.433
  182    HA   ALA  21           HA       ALA  21  -0.283  -1.267  -0.376
  183   1HB   ALA  21          1HB       ALA  21  -2.021  -1.865  -1.904
  184   2HB   ALA  21          2HB       ALA  21  -0.601  -1.425  -2.853
  185   3HB   ALA  21          3HB       ALA  21  -1.943  -0.291  -2.695
  186    H    ILE  22           H        ILE  22  -0.950   2.011  -1.466
  187    HA   ILE  22           HA       ILE  22   1.589   2.424  -2.688
  188    HB   ILE  22           HB       ILE  22  -0.521   4.329  -1.682
  189   1HG1  ILE  22          2HG1      ILE  22   0.516   3.803  -4.473
  190   2HG1  ILE  22          1HG1      ILE  22  -0.901   3.016  -3.786
  191   1HG2  ILE  22          1HG2      ILE  22   1.160   5.808  -1.424
  192   2HG2  ILE  22          2HG2      ILE  22   1.067   5.915  -3.181
  193   3HG2  ILE  22          3HG2      ILE  22   2.275   4.877  -2.423
  194   1HD1  ILE  22          1HD1      ILE  22  -2.093   4.690  -4.606
  195   2HD1  ILE  22          2HD1      ILE  22  -0.643   5.612  -5.003
  196   3HD1  ILE  22          3HD1      ILE  22  -1.346   5.724  -3.389
  197    H    ASN  23           H        ASN  23   0.454   2.281   0.521
  198    HA   ASN  23           HA       ASN  23   2.509   3.892   1.693
  199   1HB   ASN  23          2HB       ASN  23   1.115   3.792   3.436
  200   2HB   ASN  23          1HB       ASN  23   0.088   2.704   2.532
  201   1HD2  ASN  23          1HD2      ASN  23   2.350   3.043   5.087
  202   2HD2  ASN  23          2HD2      ASN  23   2.279   1.417   5.664
  203    H    ILE  24           H        ILE  24   1.773   0.456   1.964
  204    HA   ILE  24           HA       ILE  24   4.220  -0.353   2.989
  205    HB   ILE  24           HB       ILE  24   3.653  -2.599   1.873
  206   1HG1  ILE  24          2HG1      ILE  24   1.099  -2.679   1.386
  207   2HG1  ILE  24          1HG1      ILE  24   1.261  -0.957   1.084
  208   1HG2  ILE  24          1HG2      ILE  24   2.270  -3.179   3.642
  209   2HG2  ILE  24          2HG2      ILE  24   1.465  -1.609   3.652
  210   3HG2  ILE  24          3HG2      ILE  24   3.120  -1.755   4.242
  211   1HD1  ILE  24          1HD1      ILE  24   3.154  -1.656  -0.519
  212   2HD1  ILE  24          2HD1      ILE  24   1.476  -1.882  -1.012
  213   3HD1  ILE  24          3HD1      ILE  24   2.414  -3.252  -0.422
  214    H    ALA  25           H        ALA  25   3.267   0.650  -0.138
  215    HA   ALA  25           HA       ALA  25   5.596  -0.479  -1.422
  216   1HB   ALA  25          1HB       ALA  25   3.415  -0.424  -2.596
  217   2HB   ALA  25          2HB       ALA  25   4.701   0.398  -3.481
  218   3HB   ALA  25          3HB       ALA  25   3.499   1.338  -2.596
  219    H    SER  26           H        SER  26   4.535   2.466   0.028
  220    HA   SER  26           HA       SER  26   6.587   4.088  -1.224
  221   1HB   SER  26          2HB       SER  26   4.354   4.566   0.691
  222   2HB   SER  26          1HB       SER  26   5.722   5.678   0.748
  223    HG   SER  26           HG       SER  26   4.153   6.405  -0.720
  224    H    THR  27           H        THR  27   6.051   2.382   1.780
  225    HA   THR  27           HA       THR  27   8.335   3.483   3.116
  226    HB   THR  27           HB       THR  27   6.842   0.942   3.786
  227    HG1  THR  27           1HG      THR  27   5.598   3.022   3.587
  228   1HG2  THR  27          1HG2      THR  27   8.911   1.233   5.039
  229   2HG2  THR  27          2HG2      THR  27   7.492   1.402   6.074
  230   3HG2  THR  27          3HG2      THR  27   8.377   2.835   5.549
  231    H    ALA  28           H        ALA  28   7.614   0.583   1.258
  232    HA   ALA  28           HA       ALA  28  10.070  -0.745   1.771
  233   1HB   ALA  28          1HB       ALA  28   8.572  -1.198  -0.766
  234   2HB   ALA  28          2HB       ALA  28   7.803  -1.612   0.767
  235   3HB   ALA  28          3HB       ALA  28   9.336  -2.361   0.318
  236    H    ASN  29           H        ASN  29   9.155   1.824  -0.362
  237    HA   ASN  29           HA       ASN  29  11.327   1.482  -2.195
  238   1HB   ASN  29          2HB       ASN  29  10.259   3.037  -3.418
  239   2HB   ASN  29          1HB       ASN  29   8.974   2.929  -2.224
  240   1HD2  ASN  29          1HD2      ASN  29   8.304   4.817  -1.541
  241   2HD2  ASN  29          2HD2      ASN  29   9.259   6.246  -1.374
  242    H    ASP  30           H        ASP  30  10.646   3.972   0.255
  243    HA   ASP  30           HA       ASP  30  13.179   5.169   0.188
  244   1HB   ASP  30          2HB       ASP  30  11.012   6.021   1.288
  245   2HB   ASP  30          1HB       ASP  30  11.477   5.035   2.671
  246    H    VAL  31           H        VAL  31  11.912   2.458   2.018
  247    HA   VAL  31           HA       VAL  31  14.203   2.128   3.689
  248    HB   VAL  31           HB       VAL  31  12.005   0.182   2.970
  249   1HG1  VAL  31          1HG1      VAL  31  13.190  -1.393   3.985
  250   2HG1  VAL  31          2HG1      VAL  31  13.157  -0.436   5.466
  251   3HG1  VAL  31          3HG1      VAL  31  14.484  -0.243   4.320
  252   1HG2  VAL  31          1HG2      VAL  31  10.867   0.868   4.866
  253   2HG2  VAL  31          2HG2      VAL  31  11.517   2.386   4.247
  254   3HG2  VAL  31          3HG2      VAL  31  12.306   1.575   5.600
  255    H    PHE  32           H        PHE  32  13.021   0.576   0.744
  256    HA   PHE  32           HA       PHE  32  14.927  -1.392   0.413
  257   1HB   PHE  32          2HB       PHE  32  13.098  -1.378  -1.090
  258   2HB   PHE  32          1HB       PHE  32  13.422   0.277  -1.596
  259    HD1  PHE  32           1HD      PHE  32  14.949   0.753  -3.342
  260    HD2  PHE  32           2HD      PHE  32  14.582  -3.210  -1.834
  261    HE1  PHE  32           1HE      PHE  32  16.265  -0.088  -5.243
  262    HE2  PHE  32           2HE      PHE  32  15.898  -4.058  -3.731
  263    HZ   PHE  32           HZ       PHE  32  16.742  -2.496  -5.438
  264    H    ASN  33           H        ASN  33  15.186   2.048  -0.097
  265    HA   ASN  33           HA       ASN  33  17.681   1.911  -1.513
  266   1HB   ASN  33          2HB       ASN  33  15.755   3.847  -1.218
  267   2HB   ASN  33          1HB       ASN  33  17.044   4.447  -0.180
  268   1HD2  ASN  33          1HD2      ASN  33  15.856   5.003  -3.007
  269   2HD2  ASN  33          2HD2      ASN  33  17.273   5.265  -3.960
  270    H    PHE  34           H        PHE  34  16.657   2.581   1.796
  271    HA   PHE  34           HA       PHE  34  19.354   3.032   2.714
  272   1HB   PHE  34          2HB       PHE  34  16.641   3.169   3.867
  273   2HB   PHE  34          1HB       PHE  34  17.902   2.674   4.991
  274    HD1  PHE  34           1HD      PHE  34  18.150   4.519   6.381
  275    HD2  PHE  34           2HD      PHE  34  18.140   5.066   2.161
  276    HE1  PHE  34           1HE      PHE  34  18.798   6.871   6.689
  277    HE2  PHE  34           2HE      PHE  34  18.791   7.420   2.461
  278    HZ   PHE  34           HZ       PHE  34  19.120   8.326   4.728
  279    H    LEU  35           H        LEU  35  17.920   0.335   1.701
  280    HA   LEU  35           HA       LEU  35  19.558  -1.353   3.426
  281   1HB   LEU  35          2HB       LEU  35  17.228  -1.298   4.352
  282   2HB   LEU  35          1HB       LEU  35  16.667  -1.995   2.844
  283    HG   LEU  35           HG       LEU  35  18.245  -3.941   3.322
  284   1HD1  LEU  35          1HD1      LEU  35  18.897  -4.286   5.626
  285   2HD1  LEU  35          2HD1      LEU  35  18.182  -2.741   6.086
  286   3HD1  LEU  35          3HD1      LEU  35  19.590  -2.780   5.025
  287   1HD2  LEU  35          1HD2      LEU  35  16.613  -4.746   5.224
  288   2HD2  LEU  35          2HD2      LEU  35  16.045  -4.524   3.569
  289   3HD2  LEU  35          3HD2      LEU  35  15.736  -3.281   4.782
  290    H    LYS  36           H        LYS  36  20.635  -0.999   1.207
  291    HA   LYS  36           HA       LYS  36  19.688  -3.074  -0.660
  292   1HB   LYS  36          2HB       LYS  36  20.659  -1.828  -2.473
  293   2HB   LYS  36          1HB       LYS  36  19.622  -0.747  -1.551
  294   1HG   LYS  36          2HG       LYS  36  21.955  -0.278  -0.320
  295   2HG   LYS  36          1HG       LYS  36  22.546  -0.713  -1.925
  296   1HD   LYS  36          2HD       LYS  36  20.951   0.960  -2.877
  297   2HD   LYS  36          1HD       LYS  36  20.585   1.467  -1.227
  298   1HE   LYS  36          2HE       LYS  36  23.143   1.741  -2.764
  299   2HE   LYS  36          1HE       LYS  36  22.209   2.986  -1.935
  300   1HZ   LYS  36          1HZ       LYS  36  22.914   2.180   0.158
  301   2HZ   LYS  36          2HZ       LYS  36  24.305   2.284  -0.799
  302   3HZ   LYS  36          3HZ       LYS  36  23.587   0.779  -0.513
  303    HA   PRO  37           HA       PRO  37  23.748  -4.342   1.526
  304   1HB   PRO  37          2HB       PRO  37  22.303  -6.850   0.769
  305   2HB   PRO  37          1HB       PRO  37  23.289  -6.512   2.196
  306   1HG   PRO  37          2HG       PRO  37  20.611  -6.481   2.307
  307   2HG   PRO  37          1HG       PRO  37  21.598  -5.362   3.262
  308   1HD   PRO  37          2HD       PRO  37  19.904  -4.830   0.905
  309   2HD   PRO  37          1HD       PRO  37  20.459  -3.722   2.174
  310    H    LYS  38           H        LYS  38  22.078  -5.736  -1.283
  311    HA   LYS  38           HA       LYS  38  24.076  -6.978  -2.610
  312   1HB   LYS  38          2HB       LYS  38  22.076  -5.135  -3.924
  313   2HB   LYS  38          1HB       LYS  38  22.933  -6.461  -4.697
  314   1HG   LYS  38          2HG       LYS  38  21.797  -7.888  -2.822
  315   2HG   LYS  38          1HG       LYS  38  20.667  -6.533  -2.771
  316   1HD   LYS  38          2HD       LYS  38  21.186  -7.270  -5.494
  317   2HD   LYS  38          1HD       LYS  38  20.693  -8.692  -4.571
  318   1HE   LYS  38          2HE       LYS  38  19.167  -6.146  -4.268
  319   2HE   LYS  38          1HE       LYS  38  18.904  -7.144  -5.698
  320   1HZ   LYS  38          1HZ       LYS  38  18.151  -7.624  -2.942
  321   2HZ   LYS  38          2HZ       LYS  38  18.765  -8.972  -3.760
  322   3HZ   LYS  38          3HZ       LYS  38  17.418  -8.151  -4.373
  323    H    LYS  39           H        LYS  39  23.510  -3.491  -2.559
  324    HA   LYS  39           HA       LYS  39  26.103  -3.121  -3.905
  325   1HB   LYS  39          2HB       LYS  39  24.331  -0.787  -3.742
  326   2HB   LYS  39          1HB       LYS  39  25.242  -1.418  -5.108
  327   1HG   LYS  39          2HG       LYS  39  23.449  -3.256  -5.193
  328   2HG   LYS  39          1HG       LYS  39  22.506  -2.178  -4.161
  329   1HD   LYS  39          2HD       LYS  39  21.841  -1.108  -5.992
  330   2HD   LYS  39          1HD       LYS  39  23.506  -0.571  -6.225
  331   1HE   LYS  39          2HE       LYS  39  23.854  -2.858  -7.358
  332   2HE   LYS  39          1HE       LYS  39  22.093  -2.921  -7.440
  333   1HZ   LYS  39          1HZ       LYS  39  23.945  -1.078  -8.796
  334   2HZ   LYS  39          2HZ       LYS  39  22.353  -0.595  -8.495
  335   3HZ   LYS  39          3HZ       LYS  39  22.655  -1.964  -9.440
  336    H    ARG  40           H        ARG  40  24.350  -2.637  -1.017
  337    HA   ARG  40           HA       ARG  40  25.804  -0.398  -0.016
  338   1HB   ARG  40          2HB       ARG  40  23.725  -0.705   0.998
  339   2HB   ARG  40          1HB       ARG  40  23.966  -2.436   1.191
  340   1HG   ARG  40          2HG       ARG  40  24.879  -2.185   3.202
  341   2HG   ARG  40          1HG       ARG  40  25.931  -0.879   2.653
  342   1HD   ARG  40          2HD       ARG  40  23.008  -0.407   3.106
  343   2HD   ARG  40          1HD       ARG  40  24.141  -0.382   4.456
  344    HE   ARG  40           HE       ARG  40  23.746   1.670   2.556
  345   1HH1  ARG  40          1HH1      ARG  40  26.263   0.060   4.347
  346   2HH1  ARG  40          2HH1      ARG  40  27.325   1.428   4.337
  347   1HH2  ARG  40          1HH2      ARG  40  25.136   3.477   2.535
  348   2HH2  ARG  40          2HH2      ARG  40  26.685   3.371   3.304
  349    H    LYS  41           H        LYS  41  27.947  -0.528   0.237
  350    HA   LYS  41           HA       LYS  41  29.252  -2.991   0.966
  351   1HB   LYS  41          2HB       LYS  41  30.429  -0.215   0.755
  352   2HB   LYS  41          1HB       LYS  41  31.318  -1.731   0.784
  353   1HG   LYS  41          2HG       LYS  41  30.380  -2.363  -1.352
  354   2HG   LYS  41          1HG       LYS  41  29.387  -0.904  -1.373
  355   1HD   LYS  41          2HD       LYS  41  31.205  -0.350  -2.726
  356   2HD   LYS  41          1HD       LYS  41  31.618   0.363  -1.165
  357   1HE   LYS  41          2HE       LYS  41  32.634  -2.204  -1.011
  358   2HE   LYS  41          1HE       LYS  41  32.961  -1.724  -2.675
  359   1HZ   LYS  41          1HZ       LYS  41  34.465  -1.072  -0.510
  360   2HZ   LYS  41          2HZ       LYS  41  33.573   0.338  -0.782
  361   3HZ   LYS  41          3HZ       LYS  41  34.528  -0.308  -2.019
  362    H    ALA  42           H        ALA  42  28.886  -3.645   3.013
  363    HA   ALA  42           HA       ALA  42  29.019  -1.700   5.190
  364   1HB   ALA  42          1HB       ALA  42  27.984  -4.490   4.946
  365   2HB   ALA  42          2HB       ALA  42  27.178  -3.041   5.544
  366   3HB   ALA  42          3HB       ALA  42  28.396  -3.844   6.534
  Start of MODEL    7
    1   1H    ALA   1          1HT       ALA   1  31.365   5.899   4.595
    2   2H    ALA   1          2HT       ALA   1  32.736   4.868   4.536
    3   3H    ALA   1          3HT       ALA   1  31.856   5.046   5.999
    4    HA   ALA   1           HA       ALA   1  29.936   4.269   4.379
    5   1HB   ALA   1          1HB       ALA   1  30.618   2.809   2.753
    6   2HB   ALA   1          2HB       ALA   1  32.155   2.469   3.548
    7   3HB   ALA   1          3HB       ALA   1  31.926   3.989   2.685
    8    H    LYS   2           H        LYS   2  28.960   3.378   6.088
    9    HA   LYS   2           HA       LYS   2  30.357   1.208   7.494
   10   1HB   LYS   2          2HB       LYS   2  29.804   3.535   8.691
   11   2HB   LYS   2          1HB       LYS   2  28.249   2.748   8.921
   12   1HG   LYS   2          2HG       LYS   2  30.888   2.122  10.104
   13   2HG   LYS   2          1HG       LYS   2  29.278   2.080  10.827
   14   1HD   LYS   2          2HD       LYS   2  28.807   0.061   9.409
   15   2HD   LYS   2          1HD       LYS   2  30.515   0.061   8.965
   16   1HE   LYS   2          2HE       LYS   2  31.191  -0.363  11.191
   17   2HE   LYS   2          1HE       LYS   2  29.587   0.000  11.826
   18   1HZ   LYS   2          1HZ       LYS   2  30.526  -2.408  10.423
   19   2HZ   LYS   2          2HZ       LYS   2  28.892  -1.985  10.336
   20   3HZ   LYS   2          3HZ       LYS   2  29.608  -2.283  11.839
   21    H    ILE   3           H        ILE   3  29.289  -0.095   5.804
   22    HA   ILE   3           HA       ILE   3  27.697  -1.572   5.131
   23    HB   ILE   3           HB       ILE   3  26.570  -1.041   7.879
   24   1HG1  ILE   3          2HG1      ILE   3  28.423  -3.178   6.813
   25   2HG1  ILE   3          1HG1      ILE   3  28.807  -1.942   8.007
   26   1HG2  ILE   3          1HG2      ILE   3  24.799  -2.218   7.228
   27   2HG2  ILE   3          2HG2      ILE   3  25.867  -3.609   7.040
   28   3HG2  ILE   3          3HG2      ILE   3  25.535  -2.559   5.662
   29   1HD1  ILE   3          1HD1      ILE   3  27.425  -4.510   8.317
   30   2HD1  ILE   3          2HD1      ILE   3  26.730  -3.161   9.215
   31   3HD1  ILE   3          3HD1      ILE   3  28.420  -3.604   9.457
   32    HA   PRO   4           HA       PRO   4  24.820   2.133   4.434
   33   1HB   PRO   4          2HB       PRO   4  25.633   2.754   1.925
   34   2HB   PRO   4          1HB       PRO   4  26.388   3.437   3.370
   35   1HG   PRO   4          2HG       PRO   4  27.295   1.147   1.664
   36   2HG   PRO   4          1HG       PRO   4  28.246   2.485   2.337
   37   1HD   PRO   4          2HD       PRO   4  28.202   0.028   3.465
   38   2HD   PRO   4          1HD       PRO   4  28.375   1.512   4.423
   39    H    ILE   5           H        ILE   5  25.626  -0.831   2.904
   40    HA   ILE   5           HA       ILE   5  23.985  -1.013   0.728
   41    HB   ILE   5           HB       ILE   5  24.144  -3.229   2.762
   42   1HG1  ILE   5          2HG1      ILE   5  26.129  -3.411   0.676
   43   2HG1  ILE   5          1HG1      ILE   5  26.325  -1.906   1.567
   44   1HG2  ILE   5          1HG2      ILE   5  24.233  -3.580  -0.197
   45   2HG2  ILE   5          2HG2      ILE   5  22.689  -3.253   0.589
   46   3HG2  ILE   5          3HG2      ILE   5  23.629  -4.672   1.048
   47   1HD1  ILE   5          1HD1      ILE   5  27.291  -4.385   2.286
   48   2HD1  ILE   5          2HD1      ILE   5  25.888  -4.158   3.329
   49   3HD1  ILE   5          3HD1      ILE   5  27.182  -2.960   3.320
   50    H    LYS   6           H        LYS   6  23.057  -1.544   4.108
   51    HA   LYS   6           HA       LYS   6  20.369  -2.168   3.672
   52   1HB   LYS   6          2HB       LYS   6  21.181  -0.577   6.073
   53   2HB   LYS   6          1HB       LYS   6  20.068  -1.933   5.960
   54   1HG   LYS   6          2HG       LYS   6  22.389  -3.127   5.248
   55   2HG   LYS   6          1HG       LYS   6  22.971  -1.900   6.377
   56   1HD   LYS   6          2HD       LYS   6  21.744  -2.771   8.150
   57   2HD   LYS   6          1HD       LYS   6  20.629  -3.628   7.084
   58   1HE   LYS   6          2HE       LYS   6  23.103  -4.711   6.475
   59   2HE   LYS   6          1HE       LYS   6  23.155  -4.497   8.224
   60   1HZ   LYS   6          1HZ       LYS   6  20.950  -5.869   6.788
   61   2HZ   LYS   6          2HZ       LYS   6  21.185  -5.794   8.462
   62   3HZ   LYS   6          3HZ       LYS   6  22.261  -6.672   7.496
   63    H    ALA   7           H        ALA   7  22.047   0.808   3.393
   64    HA   ALA   7           HA       ALA   7  19.827   2.556   3.798
   65   1HB   ALA   7          1HB       ALA   7  22.355   3.088   3.900
   66   2HB   ALA   7          2HB       ALA   7  21.255   4.294   3.233
   67   3HB   ALA   7          3HB       ALA   7  22.218   3.285   2.153
   68    H    ILE   8           H        ILE   8  21.508   1.368   0.907
   69    HA   ILE   8           HA       ILE   8  19.859   2.619  -0.987
   70    HB   ILE   8           HB       ILE   8  22.056   1.587  -1.513
   71   1HG1  ILE   8          2HG1      ILE   8  19.795   0.464  -3.179
   72   2HG1  ILE   8          1HG1      ILE   8  20.363   2.129  -3.268
   73   1HG2  ILE   8          1HG2      ILE   8  21.350  -1.049  -2.116
   74   2HG2  ILE   8          2HG2      ILE   8  20.739  -0.755  -0.488
   75   3HG2  ILE   8          3HG2      ILE   8  22.446  -0.496  -0.849
   76   1HD1  ILE   8          1HD1      ILE   8  22.676   0.773  -3.633
   77   2HD1  ILE   8          2HD1      ILE   8  21.632   1.350  -4.933
   78   3HD1  ILE   8          3HD1      ILE   8  21.512  -0.321  -4.381
   79    H    LYS   9           H        LYS   9  19.467  -0.304   0.868
   80    HA   LYS   9           HA       LYS   9  17.390  -1.447  -0.702
   81   1HB   LYS   9          2HB       LYS   9  17.714  -1.924   2.246
   82   2HB   LYS   9          1HB       LYS   9  17.168  -3.042   1.004
   83   1HG   LYS   9          2HG       LYS   9  19.671  -2.532   0.133
   84   2HG   LYS   9          1HG       LYS   9  19.889  -2.363   1.876
   85   1HD   LYS   9          2HD       LYS   9  20.310  -4.661   1.123
   86   2HD   LYS   9          1HD       LYS   9  18.936  -4.575   2.228
   87   1HE   LYS   9          2HE       LYS   9  18.099  -4.236  -0.515
   88   2HE   LYS   9          1HE       LYS   9  18.995  -5.740  -0.305
   89   1HZ   LYS   9          1HZ       LYS   9  16.513  -4.881   1.054
   90   2HZ   LYS   9          2HZ       LYS   9  17.477  -6.125   1.672
   91   3HZ   LYS   9          3HZ       LYS   9  16.782  -6.278   0.138
   92    H    THR  10           H        THR  10  17.465   0.685   2.104
   93    HA   THR  10           HA       THR  10  14.727   0.704   2.679
   94    HB   THR  10           HB       THR  10  16.864   2.800   3.077
   95    HG1  THR  10           1HG      THR  10  15.666   0.840   4.718
   96   1HG2  THR  10          1HG2      THR  10  14.694   3.116   4.892
   97   2HG2  THR  10          2HG2      THR  10  14.094   3.241   3.238
   98   3HG2  THR  10          3HG2      THR  10  15.403   4.291   3.783
   99    H    VAL  11           H        VAL  11  16.645   2.606   0.416
  100    HA   VAL  11           HA       VAL  11  14.560   4.356  -0.378
  101    HB   VAL  11           HB       VAL  11  17.096   3.527  -1.787
  102   1HG1  VAL  11          1HG1      VAL  11  16.475   5.826  -2.994
  103   2HG1  VAL  11          2HG1      VAL  11  14.845   5.232  -2.675
  104   3HG1  VAL  11          3HG1      VAL  11  15.971   4.255  -3.618
  105   1HG2  VAL  11          1HG2      VAL  11  17.133   4.877   0.388
  106   2HG2  VAL  11          2HG2      VAL  11  16.460   6.195  -0.572
  107   3HG2  VAL  11          3HG2      VAL  11  18.033   5.515  -0.988
  108    H    GLY  12           H        GLY  12  15.960   1.490  -1.945
  109   1HA   GLY  12          2HA       GLY  12  14.128   1.347  -4.067
  110   2HA   GLY  12          1HA       GLY  12  15.068  -0.004  -3.445
  111    H    LYS  13           H        LYS  13  13.844   0.479  -0.733
  112    HA   LYS  13           HA       LYS  13  11.541  -1.224  -1.144
  113   1HB   LYS  13          2HB       LYS  13  13.091  -0.286   1.242
  114   2HB   LYS  13          1HB       LYS  13  11.484  -0.964   1.463
  115   1HG   LYS  13          2HG       LYS  13  13.763  -2.357   0.076
  116   2HG   LYS  13          1HG       LYS  13  13.281  -2.620   1.753
  117   1HD   LYS  13          2HD       LYS  13  10.914  -2.996   0.547
  118   2HD   LYS  13          1HD       LYS  13  11.989  -3.499  -0.759
  119   1HE   LYS  13          2HE       LYS  13  13.158  -4.890   1.103
  120   2HE   LYS  13          1HE       LYS  13  11.638  -4.674   1.969
  121   1HZ   LYS  13          1HZ       LYS  13  10.527  -5.581  -0.074
  122   2HZ   LYS  13          2HZ       LYS  13  11.467  -6.691   0.790
  123   3HZ   LYS  13          3HZ       LYS  13  12.063  -6.014  -0.640
  124    H    ALA  14           H        ALA  14  12.231   2.105  -0.435
  125    HA   ALA  14           HA       ALA  14   9.661   2.786   0.589
  126   1HB   ALA  14          1HB       ALA  14  11.506   4.722  -0.769
  127   2HB   ALA  14          2HB       ALA  14  11.856   4.086   0.838
  128   3HB   ALA  14          3HB       ALA  14  10.380   5.011   0.558
  129    H    VAL  15           H        VAL  15  11.206   3.316  -2.565
  130    HA   VAL  15           HA       VAL  15   8.873   4.314  -3.828
  131    HB   VAL  15           HB       VAL  15  11.094   2.943  -5.319
  132   1HG1  VAL  15          1HG1      VAL  15  10.365   4.087  -7.121
  133   2HG1  VAL  15          2HG1      VAL  15   9.973   5.528  -6.182
  134   3HG1  VAL  15          3HG1      VAL  15   8.858   4.161  -6.207
  135   1HG2  VAL  15          1HG2      VAL  15  11.682   5.699  -5.077
  136   2HG2  VAL  15          2HG2      VAL  15  12.625   4.325  -4.499
  137   3HG2  VAL  15          3HG2      VAL  15  11.418   5.070  -3.450
  138    H    GLY  16           H        GLY  16  10.218   1.117  -3.369
  139   1HA   GLY  16          2HA       GLY  16   8.491  -0.193  -5.239
  140   2HA   GLY  16          1HA       GLY  16   9.473  -0.972  -4.006
  141    H    LYS  17           H        LYS  17   8.261   0.705  -1.875
  142    HA   LYS  17           HA       LYS  17   5.975  -0.991  -1.377
  143   1HB   LYS  17          2HB       LYS  17   7.492   1.043   0.224
  144   2HB   LYS  17          1HB       LYS  17   5.911   0.502   0.768
  145   1HG   LYS  17          2HG       LYS  17   6.677  -1.768   0.919
  146   2HG   LYS  17          1HG       LYS  17   8.230  -1.332   0.204
  147   1HD   LYS  17          2HD       LYS  17   8.938  -1.124   2.321
  148   2HD   LYS  17          1HD       LYS  17   8.050   0.401   2.319
  149   1HE   LYS  17          2HE       LYS  17   6.030  -1.156   2.962
  150   2HE   LYS  17          1HE       LYS  17   7.315  -2.231   3.509
  151   1HZ   LYS  17          1HZ       LYS  17   7.786  -0.916   5.244
  152   2HZ   LYS  17          2HZ       LYS  17   6.234  -0.289   5.001
  153   3HZ   LYS  17          3HZ       LYS  17   7.580   0.518   4.370
  154    H    GLY  18           H        GLY  18   6.624   2.378  -2.119
  155   1HA   GLY  18          2HA       GLY  18   4.050   3.405  -1.614
  156   2HA   GLY  18          1HA       GLY  18   5.241   4.117  -2.692
  157    H    LEU  19           H        LEU  19   5.470   1.999  -4.540
  158    HA   LEU  19           HA       LEU  19   3.173   2.522  -6.154
  159   1HB   LEU  19          2HB       LEU  19   4.368   1.645  -7.880
  160   2HB   LEU  19          1HB       LEU  19   5.690   2.002  -6.788
  161    HG   LEU  19           HG       LEU  19   5.343  -0.472  -5.997
  162   1HD1  LEU  19          1HD1      LEU  19   4.454  -0.839  -8.823
  163   2HD1  LEU  19          2HD1      LEU  19   3.260  -0.558  -7.556
  164   3HD1  LEU  19          3HD1      LEU  19   4.341  -1.948  -7.456
  165   1HD2  LEU  19          1HD2      LEU  19   7.323   0.505  -7.150
  166   2HD2  LEU  19          2HD2      LEU  19   6.567   0.098  -8.691
  167   3HD2  LEU  19          3HD2      LEU  19   7.011  -1.182  -7.562
  168    H    ARG  20           H        ARG  20   4.432  -0.326  -4.466
  169    HA   ARG  20           HA       ARG  20   2.425  -2.100  -5.304
  170   1HB   ARG  20          2HB       ARG  20   4.386  -3.035  -4.351
  171   2HB   ARG  20          1HB       ARG  20   4.240  -2.074  -2.896
  172   1HG   ARG  20          2HG       ARG  20   2.323  -4.257  -3.699
  173   2HG   ARG  20          1HG       ARG  20   3.682  -4.475  -2.603
  174   1HD   ARG  20          2HD       ARG  20   1.133  -2.965  -2.189
  175   2HD   ARG  20          1HD       ARG  20   1.906  -4.157  -1.158
  176    HE   ARG  20           HE       ARG  20   3.330  -1.650  -1.488
  177   1HH1  ARG  20          1HH1      ARG  20   1.157  -3.562   0.445
  178   2HH1  ARG  20          2HH1      ARG  20   1.430  -2.643   1.888
  179   1HH2  ARG  20          1HH2      ARG  20   3.704  -0.443   0.401
  180   2HH2  ARG  20          2HH2      ARG  20   2.881  -0.871   1.864
  181    H    ALA  21           H        ALA  21   2.730  -0.139  -2.361
  182    HA   ALA  21           HA       ALA  21   0.320  -0.854  -1.175
  183   1HB   ALA  21          1HB       ALA  21   2.302   0.741  -0.400
  184   2HB   ALA  21          2HB       ALA  21   0.688   0.853   0.301
  185   3HB   ALA  21          3HB       ALA  21   1.182   1.982  -0.960
  186    H    ILE  22           H        ILE  22   1.044   1.445  -3.706
  187    HA   ILE  22           HA       ILE  22  -1.573   2.572  -3.821
  188    HB   ILE  22           HB       ILE  22   0.824   2.648  -5.629
  189   1HG1  ILE  22          2HG1      ILE  22  -0.799   4.919  -4.489
  190   2HG1  ILE  22          1HG1      ILE  22   0.485   4.134  -3.574
  191   1HG2  ILE  22          1HG2      ILE  22  -0.955   2.462  -7.208
  192   2HG2  ILE  22          2HG2      ILE  22  -0.482   4.160  -7.138
  193   3HG2  ILE  22          3HG2      ILE  22  -1.944   3.617  -6.315
  194   1HD1  ILE  22          1HD1      ILE  22   2.104   5.150  -4.743
  195   2HD1  ILE  22          2HD1      ILE  22   0.827   6.300  -5.140
  196   3HD1  ILE  22          3HD1      ILE  22   1.235   5.010  -6.272
  197    H    ASN  23           H        ASN  23  -0.281  -0.426  -4.674
  198    HA   ASN  23           HA       ASN  23  -1.986  -0.905  -6.945
  199   1HB   ASN  23          2HB       ASN  23  -0.773  -2.770  -7.259
  200   2HB   ASN  23          1HB       ASN  23   0.333  -2.003  -6.143
  201   1HD2  ASN  23          1HD2      ASN  23   1.096  -3.359  -4.718
  202   2HD2  ASN  23          2HD2      ASN  23   0.255  -4.692  -4.010
  203    H    ILE  24           H        ILE  24  -1.810  -2.366  -3.700
  204    HA   ILE  24           HA       ILE  24  -4.335  -3.616  -3.906
  205    HB   ILE  24           HB       ILE  24  -4.188  -4.098  -1.598
  206   1HG1  ILE  24          2HG1      ILE  24  -3.316  -1.534  -1.241
  207   2HG1  ILE  24          1HG1      ILE  24  -3.304  -2.773   0.005
  208   1HG2  ILE  24          1HG2      ILE  24  -1.324  -4.010  -2.491
  209   2HG2  ILE  24          2HG2      ILE  24  -2.506  -5.152  -3.130
  210   3HG2  ILE  24          3HG2      ILE  24  -2.094  -5.177  -1.416
  211   1HD1  ILE  24          1HD1      ILE  24  -1.000  -2.046  -1.784
  212   2HD1  ILE  24          2HD1      ILE  24  -0.984  -3.288  -0.532
  213   3HD1  ILE  24          3HD1      ILE  24  -1.193  -1.593  -0.090
  214    H    ALA  25           H        ALA  25  -3.243  -0.457  -3.210
  215    HA   ALA  25           HA       ALA  25  -5.695   0.462  -2.021
  216   1HB   ALA  25          1HB       ALA  25  -4.599   2.725  -2.311
  217   2HB   ALA  25          2HB       ALA  25  -3.196   1.865  -2.947
  218   3HB   ALA  25          3HB       ALA  25  -3.729   1.579  -1.291
  219    H    SER  26           H        SER  26  -4.213   0.216  -5.161
  220    HA   SER  26           HA       SER  26  -5.983   2.049  -6.476
  221   1HB   SER  26          2HB       SER  26  -3.879   0.117  -7.310
  222   2HB   SER  26          1HB       SER  26  -5.093   0.547  -8.516
  223    HG   SER  26           HG       SER  26  -3.106   1.908  -8.313
  224    H    THR  27           H        THR  27  -5.775  -1.493  -6.266
  225    HA   THR  27           HA       THR  27  -8.140  -1.982  -7.753
  226    HB   THR  27           HB       THR  27  -7.047  -3.827  -5.637
  227    HG1  THR  27           1HG      THR  27  -5.953  -3.174  -8.148
  228   1HG2  THR  27          1HG2      THR  27  -7.691  -5.586  -7.155
  229   2HG2  THR  27          2HG2      THR  27  -8.230  -4.398  -8.342
  230   3HG2  THR  27          3HG2      THR  27  -9.074  -4.550  -6.801
  231    H    ALA  28           H        ALA  28  -7.463  -1.259  -4.421
  232    HA   ALA  28           HA       ALA  28  -9.919  -2.094  -3.301
  233   1HB   ALA  28          1HB       ALA  28  -8.468  -1.725  -1.605
  234   2HB   ALA  28          2HB       ALA  28  -9.180  -0.113  -1.638
  235   3HB   ALA  28          3HB       ALA  28  -7.644  -0.415  -2.450
  236    H    ASN  29           H        ASN  29  -8.963   0.678  -5.143
  237    HA   ASN  29           HA       ASN  29 -10.861   2.559  -4.391
  238   1HB   ASN  29          2HB       ASN  29  -9.816   2.049  -7.184
  239   2HB   ASN  29          1HB       ASN  29 -10.565   3.538  -6.616
  240   1HD2  ASN  29          1HD2      ASN  29  -9.220   3.296  -3.994
  241   2HD2  ASN  29          2HD2      ASN  29  -7.587   3.781  -4.273
  242    H    ASP  30           H        ASP  30 -11.175   0.800  -7.446
  243    HA   ASP  30           HA       ASP  30 -13.820   1.181  -7.908
  244   1HB   ASP  30          2HB       ASP  30 -12.165  -0.049  -9.377
  245   2HB   ASP  30          1HB       ASP  30 -12.481  -1.481  -8.402
  246    H    VAL  31           H        VAL  31 -12.388  -1.135  -5.694
  247    HA   VAL  31           HA       VAL  31 -14.731  -2.599  -5.115
  248    HB   VAL  31           HB       VAL  31 -12.320  -2.132  -3.356
  249   1HG1  VAL  31          1HG1      VAL  31 -13.048  -3.794  -1.952
  250   2HG1  VAL  31          2HG1      VAL  31 -14.063  -4.543  -3.185
  251   3HG1  VAL  31          3HG1      VAL  31 -14.581  -3.049  -2.404
  252   1HG2  VAL  31          1HG2      VAL  31 -12.392  -4.736  -4.489
  253   2HG2  VAL  31          2HG2      VAL  31 -11.190  -3.466  -4.727
  254   3HG2  VAL  31          3HG2      VAL  31 -12.592  -3.564  -5.793
  255    H    PHE  32           H        PHE  32 -13.188   0.143  -3.489
  256    HA   PHE  32           HA       PHE  32 -15.051   0.394  -1.396
  257   1HB   PHE  32          2HB       PHE  32 -12.950   1.493  -1.163
  258   2HB   PHE  32          1HB       PHE  32 -13.160   2.367  -2.676
  259    HD1  PHE  32           1HD      PHE  32 -13.507   4.607  -2.407
  260    HD2  PHE  32           2HD      PHE  32 -15.132   1.926   0.470
  261    HE1  PHE  32           1HE      PHE  32 -14.459   6.512  -1.176
  262    HE2  PHE  32           2HE      PHE  32 -16.089   3.827   1.706
  263    HZ   PHE  32           HZ       PHE  32 -15.752   6.124   0.883
  264    H    ASN  33           H        ASN  33 -15.058   1.519  -4.698
  265    HA   ASN  33           HA       ASN  33 -17.368   3.230  -4.285
  266   1HB   ASN  33          2HB       ASN  33 -15.546   3.863  -5.867
  267   2HB   ASN  33          1HB       ASN  33 -15.982   2.481  -6.869
  268   1HD2  ASN  33          1HD2      ASN  33 -16.685   3.507  -8.649
  269   2HD2  ASN  33          2HD2      ASN  33 -18.034   4.586  -8.689
  270    H    PHE  34           H        PHE  34 -16.839  -0.031  -4.777
  271    HA   PHE  34           HA       PHE  34 -19.176  -0.507  -6.425
  272   1HB   PHE  34          2HB       PHE  34 -16.820  -1.959  -5.762
  273   2HB   PHE  34          1HB       PHE  34 -18.202  -2.916  -5.242
  274    HD1  PHE  34           1HD      PHE  34 -18.169  -4.654  -6.805
  275    HD2  PHE  34           2HD      PHE  34 -18.056  -0.615  -8.137
  276    HE1  PHE  34           1HE      PHE  34 -18.516  -5.413  -9.120
  277    HE2  PHE  34           2HE      PHE  34 -18.403  -1.365 -10.455
  278    HZ   PHE  34           HZ       PHE  34 -18.633  -3.767 -10.949
  279    H    LEU  35           H        LEU  35 -18.242  -0.733  -3.049
  280    HA   LEU  35           HA       LEU  35 -21.049  -1.317  -2.383
  281   1HB   LEU  35          2HB       LEU  35 -20.258  -2.666  -0.472
  282   2HB   LEU  35          1HB       LEU  35 -19.823  -3.352  -2.027
  283    HG   LEU  35           HG       LEU  35 -17.723  -1.633  -1.009
  284   1HD1  LEU  35          1HD1      LEU  35 -17.526  -3.949   0.631
  285   2HD1  LEU  35          2HD1      LEU  35 -19.066  -3.154   0.959
  286   3HD1  LEU  35          3HD1      LEU  35 -17.557  -2.253   1.110
  287   1HD2  LEU  35          1HD2      LEU  35 -16.713  -3.027  -2.411
  288   2HD2  LEU  35          2HD2      LEU  35 -18.096  -4.122  -2.416
  289   3HD2  LEU  35          3HD2      LEU  35 -16.854  -4.274  -1.172
  290    H    LYS  36           H        LYS  36 -21.148   1.031  -2.180
  291    HA   LYS  36           HA       LYS  36 -20.105   1.936   0.421
  292   1HB   LYS  36          2HB       LYS  36 -20.189   4.270  -0.651
  293   2HB   LYS  36          1HB       LYS  36 -18.868   3.203  -1.110
  294   1HG   LYS  36          2HG       LYS  36 -19.439   3.345  -3.240
  295   2HG   LYS  36          1HG       LYS  36 -21.076   2.793  -2.877
  296   1HD   LYS  36          2HD       LYS  36 -20.696   5.530  -2.046
  297   2HD   LYS  36          1HD       LYS  36 -20.306   5.327  -3.755
  298   1HE   LYS  36          2HE       LYS  36 -22.854   4.378  -2.453
  299   2HE   LYS  36          1HE       LYS  36 -22.687   5.897  -3.333
  300   1HZ   LYS  36          1HZ       LYS  36 -21.975   4.535  -5.280
  301   2HZ   LYS  36          2HZ       LYS  36 -23.585   4.305  -4.817
  302   3HZ   LYS  36          3HZ       LYS  36 -22.418   3.149  -4.415
  303    HA   PRO  37           HA       PRO  37 -24.800   2.403  -0.035
  304   1HB   PRO  37          2HB       PRO  37 -25.593   0.409   1.610
  305   2HB   PRO  37          1HB       PRO  37 -25.305   0.161  -0.116
  306   1HG   PRO  37          2HG       PRO  37 -23.542  -0.480   2.213
  307   2HG   PRO  37          1HG       PRO  37 -23.854  -1.428   0.748
  308   1HD   PRO  37          2HD       PRO  37 -21.616   0.098   1.108
  309   2HD   PRO  37          1HD       PRO  37 -22.312  -0.259  -0.485
  310    H    LYS  38           H        LYS  38 -22.791   1.597   2.756
  311    HA   LYS  38           HA       LYS  38 -22.463   2.803   4.690
  312   1HB   LYS  38          2HB       LYS  38 -24.902   4.440   4.010
  313   2HB   LYS  38          1HB       LYS  38 -23.623   4.838   5.148
  314   1HG   LYS  38          2HG       LYS  38 -22.434   5.826   3.565
  315   2HG   LYS  38          1HG       LYS  38 -22.525   4.400   2.529
  316   1HD   LYS  38          2HD       LYS  38 -24.353   5.175   1.389
  317   2HD   LYS  38          1HD       LYS  38 -24.928   6.138   2.752
  318   1HE   LYS  38          2HE       LYS  38 -22.579   6.770   0.969
  319   2HE   LYS  38          1HE       LYS  38 -24.143   7.583   0.966
  320   1HZ   LYS  38          1HZ       LYS  38 -21.907   8.196   2.502
  321   2HZ   LYS  38          2HZ       LYS  38 -23.082   7.617   3.573
  322   3HZ   LYS  38          3HZ       LYS  38 -23.433   8.925   2.559
  323    H    LYS  39           H        LYS  39 -25.797   2.033   3.823
  324    HA   LYS  39           HA       LYS  39 -27.220   1.874   6.032
  325   1HB   LYS  39          2HB       LYS  39 -26.914  -0.564   4.279
  326   2HB   LYS  39          1HB       LYS  39 -28.330  -0.098   5.213
  327   1HG   LYS  39          2HG       LYS  39 -27.881   2.092   3.603
  328   2HG   LYS  39          1HG       LYS  39 -27.497   0.723   2.558
  329   1HD   LYS  39          2HD       LYS  39 -29.876   1.409   2.444
  330   2HD   LYS  39          1HD       LYS  39 -29.657  -0.260   2.971
  331   1HE   LYS  39          2HE       LYS  39 -30.849   0.181   4.790
  332   2HE   LYS  39          1HE       LYS  39 -29.626   1.349   5.289
  333   1HZ   LYS  39          1HZ       LYS  39 -31.202   2.877   5.062
  334   2HZ   LYS  39          2HZ       LYS  39 -32.257   1.805   4.288
  335   3HZ   LYS  39          3HZ       LYS  39 -31.103   2.652   3.387
  336    H    ARG  40           H        ARG  40 -24.927  -0.746   5.244
  337    HA   ARG  40           HA       ARG  40 -25.009  -1.592   8.048
  338   1HB   ARG  40          2HB       ARG  40 -23.705  -3.009   5.723
  339   2HB   ARG  40          1HB       ARG  40 -24.061  -3.673   7.312
  340   1HG   ARG  40          2HG       ARG  40 -26.120  -4.241   6.709
  341   2HG   ARG  40          1HG       ARG  40 -26.440  -2.647   6.024
  342   1HD   ARG  40          2HD       ARG  40 -25.888  -3.291   3.925
  343   2HD   ARG  40          1HD       ARG  40 -24.622  -4.385   4.481
  344    HE   ARG  40           HE       ARG  40 -27.376  -5.035   3.968
  345   1HH1  ARG  40          1HH1      ARG  40 -24.496  -5.932   5.708
  346   2HH1  ARG  40          2HH1      ARG  40 -24.953  -7.595   5.868
  347   1HH2  ARG  40          1HH2      ARG  40 -27.989  -7.225   4.169
  348   2HH2  ARG  40          2HH2      ARG  40 -26.940  -8.331   4.993
  349    H    LYS  41           H        LYS  41 -23.273  -1.510   9.377
  350    HA   LYS  41           HA       LYS  41 -21.050   0.137   8.583
  351   1HB   LYS  41          2HB       LYS  41 -21.728   0.539  10.781
  352   2HB   LYS  41          1HB       LYS  41 -21.919  -1.171  11.139
  353   1HG   LYS  41          2HG       LYS  41 -19.188  -0.673  10.496
  354   2HG   LYS  41          1HG       LYS  41 -19.720   0.500  11.701
  355   1HD   LYS  41          2HD       LYS  41 -20.183  -1.121  13.271
  356   2HD   LYS  41          1HD       LYS  41 -20.438  -2.373  12.054
  357   1HE   LYS  41          2HE       LYS  41 -17.724  -1.180  12.336
  358   2HE   LYS  41          1HE       LYS  41 -18.270  -2.336  13.551
  359   1HZ   LYS  41          1HZ       LYS  41 -17.164  -3.578  11.913
  360   2HZ   LYS  41          2HZ       LYS  41 -17.941  -2.776  10.642
  361   3HZ   LYS  41          3HZ       LYS  41 -18.811  -3.841  11.626
  362    H    ALA  42           H        ALA  42 -20.251  -1.282   6.898
  363    HA   ALA  42           HA       ALA  42 -19.135  -3.838   7.620
  364   1HB   ALA  42          1HB       ALA  42 -18.447  -2.447   5.074
  365   2HB   ALA  42          2HB       ALA  42 -20.096  -3.020   5.327
  366   3HB   ALA  42          3HB       ALA  42 -18.750  -4.157   5.378
  Start of MODEL    8
    1   1H    ALA   1          1HT       ALA   1 -28.584  -7.529  -1.602
    2   2H    ALA   1          2HT       ALA   1 -28.539  -8.069  -3.230
    3   3H    ALA   1          3HT       ALA   1 -29.979  -7.391  -2.587
    4    HA   ALA   1           HA       ALA   1 -27.956  -5.565  -2.189
    5   1HB   ALA   1          1HB       ALA   1 -26.697  -6.737  -3.914
    6   2HB   ALA   1          2HB       ALA   1 -27.227  -5.155  -4.489
    7   3HB   ALA   1          3HB       ALA   1 -28.070  -6.613  -5.015
    8    H    LYS   2           H        LYS   2 -28.550  -3.505  -3.302
    9    HA   LYS   2           HA       LYS   2 -31.232  -3.417  -4.414
   10   1HB   LYS   2          2HB       LYS   2 -31.557  -1.396  -2.673
   11   2HB   LYS   2          1HB       LYS   2 -32.104  -3.035  -2.359
   12   1HG   LYS   2          2HG       LYS   2 -29.408  -2.871  -1.520
   13   2HG   LYS   2          1HG       LYS   2 -30.255  -1.457  -0.891
   14   1HD   LYS   2          2HD       LYS   2 -32.080  -3.333  -0.336
   15   2HD   LYS   2          1HD       LYS   2 -30.625  -4.330  -0.276
   16   1HE   LYS   2          2HE       LYS   2 -29.679  -3.024   1.442
   17   2HE   LYS   2          1HE       LYS   2 -30.840  -1.720   1.198
   18   1HZ   LYS   2          1HZ       LYS   2 -32.493  -2.872   2.275
   19   2HZ   LYS   2          2HZ       LYS   2 -31.137  -3.353   3.164
   20   3HZ   LYS   2          3HZ       LYS   2 -31.792  -4.387   1.996
   21    H    ILE   3           H        ILE   3 -29.326  -0.835  -2.883
   22    HA   ILE   3           HA       ILE   3 -28.435   0.137  -5.459
   23    HB   ILE   3           HB       ILE   3 -29.624   2.413  -4.240
   24   1HG1  ILE   3          2HG1      ILE   3 -31.513   0.084  -4.646
   25   2HG1  ILE   3          1HG1      ILE   3 -31.241   0.979  -3.156
   26   1HG2  ILE   3          1HG2      ILE   3 -30.269   0.941  -6.788
   27   2HG2  ILE   3          2HG2      ILE   3 -29.041   2.191  -6.588
   28   3HG2  ILE   3          3HG2      ILE   3 -30.749   2.594  -6.405
   29   1HD1  ILE   3          1HD1      ILE   3 -32.915   1.633  -5.474
   30   2HD1  ILE   3          2HD1      ILE   3 -32.018   2.980  -4.772
   31   3HD1  ILE   3          3HD1      ILE   3 -33.118   2.035  -3.768
   32    HA   PRO   4           HA       PRO   4 -26.515   3.057  -2.142
   33   1HB   PRO   4          2HB       PRO   4 -27.345   2.755   0.443
   34   2HB   PRO   4          1HB       PRO   4 -28.070   3.895  -0.695
   35   1HG   PRO   4          2HG       PRO   4 -29.008   1.173   0.116
   36   2HG   PRO   4          1HG       PRO   4 -29.949   2.657  -0.124
   37   1HD   PRO   4          2HD       PRO   4 -29.855   0.702  -1.975
   38   2HD   PRO   4          1HD       PRO   4 -29.978   2.416  -2.420
   39    H    ILE   5           H        ILE   5 -27.159  -0.283  -1.509
   40    HA   ILE   5           HA       ILE   5 -25.318  -0.889   0.461
   41    HB   ILE   5           HB       ILE   5 -25.287  -3.147  -0.417
   42   1HG1  ILE   5          2HG1      ILE   5 -26.831  -3.417  -2.558
   43   2HG1  ILE   5          1HG1      ILE   5 -26.261  -1.785  -2.887
   44   1HG2  ILE   5          1HG2      ILE   5 -27.252  -2.333   0.824
   45   2HG2  ILE   5          2HG2      ILE   5 -27.651  -3.613  -0.322
   46   3HG2  ILE   5          3HG2      ILE   5 -28.024  -1.933  -0.709
   47   1HD1  ILE   5          1HD1      ILE   5 -24.064  -3.485  -2.163
   48   2HD1  ILE   5          2HD1      ILE   5 -24.330  -2.557  -3.639
   49   3HD1  ILE   5          3HD1      ILE   5 -24.987  -4.187  -3.491
   50    H    LYS   6           H        LYS   6 -24.825  -0.622  -3.031
   51    HA   LYS   6           HA       LYS   6 -22.102  -1.397  -3.005
   52   1HB   LYS   6          2HB       LYS   6 -22.024  -0.514  -5.270
   53   2HB   LYS   6          1HB       LYS   6 -23.503  -1.435  -5.032
   54   1HG   LYS   6          2HG       LYS   6 -24.842   0.406  -5.167
   55   2HG   LYS   6          1HG       LYS   6 -23.587   1.498  -4.574
   56   1HD   LYS   6          2HD       LYS   6 -22.395   1.254  -6.709
   57   2HD   LYS   6          1HD       LYS   6 -23.688   0.209  -7.298
   58   1HE   LYS   6          2HE       LYS   6 -24.141   3.030  -6.350
   59   2HE   LYS   6          1HE       LYS   6 -23.806   2.619  -8.031
   60   1HZ   LYS   6          1HZ       LYS   6 -26.237   2.358  -6.542
   61   2HZ   LYS   6          2HZ       LYS   6 -25.816   0.926  -7.339
   62   3HZ   LYS   6          3HZ       LYS   6 -25.994   2.361  -8.216
   63    H    ALA   7           H        ALA   7 -23.697   1.440  -2.030
   64    HA   ALA   7           HA       ALA   7 -21.536   3.271  -2.503
   65   1HB   ALA   7          1HB       ALA   7 -23.137   4.765  -2.151
   66   2HB   ALA   7          2HB       ALA   7 -23.285   4.235  -0.475
   67   3HB   ALA   7          3HB       ALA   7 -24.251   3.464  -1.733
   68    H    ILE   8           H        ILE   8 -22.853   1.603   0.334
   69    HA   ILE   8           HA       ILE   8 -20.975   2.641   2.179
   70    HB   ILE   8           HB       ILE   8 -23.065   1.668   2.949
   71   1HG1  ILE   8          2HG1      ILE   8 -20.922  -0.173   3.974
   72   2HG1  ILE   8          1HG1      ILE   8 -20.842   1.557   4.292
   73   1HG2  ILE   8          1HG2      ILE   8 -22.987  -0.985   2.963
   74   2HG2  ILE   8          2HG2      ILE   8 -22.055  -0.707   1.492
   75   3HG2  ILE   8          3HG2      ILE   8 -23.694  -0.072   1.629
   76   1HD1  ILE   8          1HD1      ILE   8 -21.850   0.361   6.146
   77   2HD1  ILE   8          2HD1      ILE   8 -23.096  -0.275   5.072
   78   3HD1  ILE   8          3HD1      ILE   8 -23.011   1.456   5.396
   79    H    LYS   9           H        LYS   9 -20.972  -0.115   0.020
   80    HA   LYS   9           HA       LYS   9 -18.714  -1.426   1.145
   81   1HB   LYS   9          2HB       LYS   9 -20.411  -1.720  -1.231
   82   2HB   LYS   9          1HB       LYS   9 -18.738  -2.195  -1.493
   83   1HG   LYS   9          2HG       LYS   9 -19.851  -4.148  -0.837
   84   2HG   LYS   9          1HG       LYS   9 -18.963  -3.616   0.591
   85   1HD   LYS   9          2HD       LYS   9 -20.841  -3.361   1.770
   86   2HD   LYS   9          1HD       LYS   9 -21.613  -2.449   0.471
   87   1HE   LYS   9          2HE       LYS   9 -22.919  -4.200   0.073
   88   2HE   LYS   9          1HE       LYS   9 -21.490  -5.119  -0.398
   89   1HZ   LYS   9          1HZ       LYS   9 -21.338  -6.106   1.652
   90   2HZ   LYS   9          2HZ       LYS   9 -23.017  -5.978   1.492
   91   3HZ   LYS   9          3HZ       LYS   9 -22.173  -4.870   2.450
   92    H    THR  10           H        THR  10 -19.157   0.960  -1.407
   93    HA   THR  10           HA       THR  10 -16.533   0.963  -2.404
   94    HB   THR  10           HB       THR  10 -18.683   3.077  -2.347
   95    HG1  THR  10           1HG      THR  10 -18.500   2.556  -4.681
   96   1HG2  THR  10          1HG2      THR  10 -15.918   3.265  -3.459
   97   2HG2  THR  10          2HG2      THR  10 -16.849   4.464  -2.561
   98   3HG2  THR  10          3HG2      THR  10 -17.264   4.099  -4.235
   99    H    VAL  11           H        VAL  11 -18.036   2.678   0.276
  100    HA   VAL  11           HA       VAL  11 -15.793   4.335   0.851
  101    HB   VAL  11           HB       VAL  11 -18.189   3.545   2.501
  102   1HG1  VAL  11          1HG1      VAL  11 -17.060   5.808   3.652
  103   2HG1  VAL  11          2HG1      VAL  11 -15.696   4.728   3.365
  104   3HG1  VAL  11          3HG1      VAL  11 -17.071   4.176   4.321
  105   1HG2  VAL  11          1HG2      VAL  11 -18.458   6.149   2.179
  106   2HG2  VAL  11          2HG2      VAL  11 -18.984   5.012   0.938
  107   3HG2  VAL  11          3HG2      VAL  11 -17.438   5.846   0.772
  108    H    GLY  12           H        GLY  12 -16.924   1.207   2.024
  109   1HA   GLY  12          2HA       GLY  12 -14.960   0.925   4.064
  110   2HA   GLY  12          1HA       GLY  12 -15.918  -0.373   3.362
  111    H    LYS  13           H        LYS  13 -15.020   0.299   0.642
  112    HA   LYS  13           HA       LYS  13 -12.578  -1.250   0.677
  113   1HB   LYS  13          2HB       LYS  13 -14.201  -0.130  -1.616
  114   2HB   LYS  13          1HB       LYS  13 -12.801  -1.177  -1.800
  115   1HG   LYS  13          2HG       LYS  13 -15.098  -2.082  -0.130
  116   2HG   LYS  13          1HG       LYS  13 -15.207  -2.165  -1.889
  117   1HD   LYS  13          2HD       LYS  13 -12.890  -3.318  -0.357
  118   2HD   LYS  13          1HD       LYS  13 -14.354  -4.243  -0.694
  119   1HE   LYS  13          2HE       LYS  13 -13.792  -3.267  -3.155
  120   2HE   LYS  13          1HE       LYS  13 -12.168  -3.427  -2.488
  121   1HZ   LYS  13          1HZ       LYS  13 -12.481  -5.718  -2.136
  122   2HZ   LYS  13          2HZ       LYS  13 -13.070  -5.421  -3.694
  123   3HZ   LYS  13          3HZ       LYS  13 -14.149  -5.628  -2.408
  124    H    ALA  14           H        ALA  14 -13.573   2.051   0.239
  125    HA   ALA  14           HA       ALA  14 -11.177   2.959  -1.017
  126   1HB   ALA  14          1HB       ALA  14 -12.186   5.202   0.101
  127   2HB   ALA  14          2HB       ALA  14 -13.626   4.183   0.066
  128   3HB   ALA  14          3HB       ALA  14 -12.750   4.523  -1.426
  129    H    VAL  15           H        VAL  15 -12.396   3.013   2.305
  130    HA   VAL  15           HA       VAL  15 -10.108   4.285   3.411
  131    HB   VAL  15           HB       VAL  15 -12.277   2.617   4.687
  132   1HG1  VAL  15          1HG1      VAL  15  -9.928   4.025   5.920
  133   2HG1  VAL  15          2HG1      VAL  15 -10.469   2.363   6.159
  134   3HG1  VAL  15          3HG1      VAL  15 -11.405   3.700   6.828
  135   1HG2  VAL  15          1HG2      VAL  15 -12.278   5.227   3.718
  136   2HG2  VAL  15          2HG2      VAL  15 -12.112   5.393   5.466
  137   3HG2  VAL  15          3HG2      VAL  15 -13.470   4.493   4.791
  138    H    GLY  16           H        GLY  16 -11.041   0.957   2.823
  139   1HA   GLY  16          2HA       GLY  16  -8.957  -0.242   4.349
  140   2HA   GLY  16          1HA       GLY  16  -9.922  -1.032   3.111
  141    H    LYS  17           H        LYS  17  -9.235   0.792   0.986
  142    HA   LYS  17           HA       LYS  17  -6.800  -0.436   0.153
  143   1HB   LYS  17          2HB       LYS  17  -7.228   0.442  -1.927
  144   2HB   LYS  17          1HB       LYS  17  -8.848   0.449  -1.246
  145   1HG   LYS  17          2HG       LYS  17  -8.319   2.859  -0.537
  146   2HG   LYS  17          1HG       LYS  17  -6.983   2.748  -1.683
  147   1HD   LYS  17          2HD       LYS  17  -8.594   2.132  -3.450
  148   2HD   LYS  17          1HD       LYS  17  -9.910   2.342  -2.292
  149   1HE   LYS  17          2HE       LYS  17  -9.921   4.393  -3.316
  150   2HE   LYS  17          1HE       LYS  17  -8.827   4.709  -1.970
  151   1HZ   LYS  17          1HZ       LYS  17  -7.223   5.201  -3.393
  152   2HZ   LYS  17          2HZ       LYS  17  -8.311   5.018  -4.676
  153   3HZ   LYS  17          3HZ       LYS  17  -7.373   3.705  -4.170
  154    H    GLY  18           H        GLY  18  -7.641   2.586   1.646
  155   1HA   GLY  18          2HA       GLY  18  -5.293   4.035   1.009
  156   2HA   GLY  18          1HA       GLY  18  -6.363   4.357   2.367
  157    H    LEU  19           H        LEU  19  -6.184   2.336   4.017
  158    HA   LEU  19           HA       LEU  19  -3.743   2.633   5.310
  159   1HB   LEU  19          2HB       LEU  19  -4.975   1.662   6.889
  160   2HB   LEU  19          1HB       LEU  19  -6.158   1.157   5.700
  161    HG   LEU  19           HG       LEU  19  -4.851  -0.904   5.300
  162   1HD1  LEU  19          1HD1      LEU  19  -3.246  -1.057   7.572
  163   2HD1  LEU  19          2HD1      LEU  19  -2.899   0.521   6.865
  164   3HD1  LEU  19          3HD1      LEU  19  -2.714  -0.941   5.895
  165   1HD2  LEU  19          1HD2      LEU  19  -5.285  -1.913   7.575
  166   2HD2  LEU  19          2HD2      LEU  19  -6.654  -1.101   6.816
  167   3HD2  LEU  19          3HD2      LEU  19  -5.755  -0.297   8.103
  168    H    ARG  20           H        ARG  20  -4.807   0.232   2.968
  169    HA   ARG  20           HA       ARG  20  -2.532  -1.438   3.186
  170   1HB   ARG  20          2HB       ARG  20  -4.956  -1.526   1.810
  171   2HB   ARG  20          1HB       ARG  20  -3.745  -1.442   0.540
  172   1HG   ARG  20          2HG       ARG  20  -4.524  -3.748   1.410
  173   2HG   ARG  20          1HG       ARG  20  -2.808  -3.471   1.111
  174   1HD   ARG  20          2HD       ARG  20  -2.273  -3.670   3.283
  175   2HD   ARG  20          1HD       ARG  20  -3.690  -2.768   3.815
  176    HE   ARG  20           HE       ARG  20  -4.656  -5.195   2.978
  177   1HH1  ARG  20          1HH1      ARG  20  -2.321  -4.101   5.316
  178   2HH1  ARG  20          2HH1      ARG  20  -2.568  -5.441   6.385
  179   1HH2  ARG  20          1HH2      ARG  20  -4.992  -6.967   4.380
  180   2HH2  ARG  20          2HH2      ARG  20  -4.089  -7.068   5.855
  181    H    ALA  21           H        ALA  21  -3.294   1.391   1.257
  182    HA   ALA  21           HA       ALA  21  -1.058   1.225  -0.470
  183   1HB   ALA  21          1HB       ALA  21  -2.101   2.946  -1.423
  184   2HB   ALA  21          2HB       ALA  21  -1.750   3.954  -0.019
  185   3HB   ALA  21          3HB       ALA  21  -3.233   3.001  -0.071
  186    H    ILE  22           H        ILE  22  -1.418   2.016   2.825
  187    HA   ILE  22           HA       ILE  22   0.968   3.618   3.036
  188    HB   ILE  22           HB       ILE  22  -0.568   2.290   5.271
  189   1HG1  ILE  22          2HG1      ILE  22  -1.888   3.862   3.718
  190   2HG1  ILE  22          1HG1      ILE  22  -1.939   4.195   5.446
  191   1HG2  ILE  22          1HG2      ILE  22   1.113   3.069   6.506
  192   2HG2  ILE  22          2HG2      ILE  22   0.520   4.689   6.141
  193   3HG2  ILE  22          3HG2      ILE  22   1.785   3.968   5.146
  194   1HD1  ILE  22          1HD1      ILE  22  -0.329   5.628   3.352
  195   2HD1  ILE  22          2HD1      ILE  22  -0.133   5.881   5.087
  196   3HD1  ILE  22          3HD1      ILE  22  -1.669   6.260   4.308
  197    H    ASN  23           H        ASN  23   0.012   0.260   3.594
  198    HA   ASN  23           HA       ASN  23   2.567  -0.463   4.673
  199   1HB   ASN  23          2HB       ASN  23   1.741  -2.627   4.855
  200   2HB   ASN  23          1HB       ASN  23   0.306  -1.641   5.055
  201   1HD2  ASN  23          1HD2      ASN  23   2.015  -3.862   3.038
  202   2HD2  ASN  23          2HD2      ASN  23   0.727  -4.176   1.931
  203    H    ILE  24           H        ILE  24   0.889  -0.865   1.664
  204    HA   ILE  24           HA       ILE  24   2.842  -2.253   0.254
  205    HB   ILE  24           HB       ILE  24   0.357  -1.064  -0.310
  206   1HG1  ILE  24          2HG1      ILE  24   0.349  -2.520  -2.174
  207   2HG1  ILE  24          1HG1      ILE  24   2.106  -2.473  -2.314
  208   1HG2  ILE  24          1HG2      ILE  24   2.335  -0.127  -2.363
  209   2HG2  ILE  24          2HG2      ILE  24   1.687   0.907  -1.090
  210   3HG2  ILE  24          3HG2      ILE  24   0.604   0.200  -2.289
  211   1HD1  ILE  24          1HD1      ILE  24   0.822  -4.502  -1.198
  212   2HD1  ILE  24          2HD1      ILE  24   0.974  -3.473   0.226
  213   3HD1  ILE  24          3HD1      ILE  24   2.416  -3.979  -0.654
  214    H    ALA  25           H        ALA  25   2.438   1.077   1.122
  215    HA   ALA  25           HA       ALA  25   4.576   2.056  -0.495
  216   1HB   ALA  25          1HB       ALA  25   2.669   3.180   1.436
  217   2HB   ALA  25          2HB       ALA  25   3.282   3.854  -0.074
  218   3HB   ALA  25          3HB       ALA  25   4.243   3.973   1.400
  219    H    SER  26           H        SER  26   4.229   0.511   2.531
  220    HA   SER  26           HA       SER  26   6.720   1.426   3.656
  221   1HB   SER  26          2HB       SER  26   4.418   0.043   4.598
  222   2HB   SER  26          1HB       SER  26   5.817  -0.987   4.898
  223    HG   SER  26           HG       SER  26   5.208   1.543   5.918
  224    H    THR  27           H        THR  27   5.573  -1.293   1.786
  225    HA   THR  27           HA       THR  27   7.907  -2.905   2.140
  226    HB   THR  27           HB       THR  27   5.547  -2.992   0.279
  227    HG1  THR  27           1HG      THR  27   5.406  -5.088   1.377
  228   1HG2  THR  27          1HG2      THR  27   7.558  -3.768  -0.978
  229   2HG2  THR  27          2HG2      THR  27   6.306  -4.988  -0.749
  230   3HG2  THR  27          3HG2      THR  27   7.762  -5.021   0.246
  231    H    ALA  28           H        ALA  28   6.889  -0.443  -0.130
  232    HA   ALA  28           HA       ALA  28   8.892  -0.939  -2.091
  233   1HB   ALA  28          1HB       ALA  28   6.746   0.354  -2.426
  234   2HB   ALA  28          2HB       ALA  28   8.201   1.085  -3.105
  235   3HB   ALA  28          3HB       ALA  28   7.529   1.698  -1.594
  236    H    ASN  29           H        ASN  29   8.741   1.041   0.814
  237    HA   ASN  29           HA       ASN  29  11.096   2.526   0.331
  238   1HB   ASN  29          2HB       ASN  29  10.878   3.348   2.494
  239   2HB   ASN  29          1HB       ASN  29   9.222   2.895   2.109
  240   1HD2  ASN  29          1HD2      ASN  29   8.347   2.255   3.938
  241   2HD2  ASN  29          2HD2      ASN  29   9.012   1.092   5.029
  242    H    ASP  30           H        ASP  30  10.481  -0.580   1.857
  243    HA   ASP  30           HA       ASP  30  13.140  -0.981   2.791
  244   1HB   ASP  30          2HB       ASP  30  11.153  -2.195   3.684
  245   2HB   ASP  30          1HB       ASP  30  11.035  -3.063   2.156
  246    H    VAL  31           H        VAL  31  11.491  -1.457  -0.212
  247    HA   VAL  31           HA       VAL  31  13.413  -3.208  -1.402
  248    HB   VAL  31           HB       VAL  31  11.187  -1.519  -2.530
  249   1HG1  VAL  31          1HG1      VAL  31  11.649  -2.899  -4.652
  250   2HG1  VAL  31          2HG1      VAL  31  13.263  -3.120  -3.977
  251   3HG1  VAL  31          3HG1      VAL  31  12.666  -1.497  -4.323
  252   1HG2  VAL  31          1HG2      VAL  31  11.520  -4.510  -2.466
  253   2HG2  VAL  31          2HG2      VAL  31  10.074  -3.596  -2.898
  254   3HG2  VAL  31          3HG2      VAL  31  10.660  -3.587  -1.234
  255    H    PHE  32           H        PHE  32  12.620   0.217  -1.839
  256    HA   PHE  32           HA       PHE  32  14.750   0.841  -3.553
  257   1HB   PHE  32          2HB       PHE  32  13.013   2.413  -3.496
  258   2HB   PHE  32          1HB       PHE  32  12.996   2.471  -1.737
  259    HD1  PHE  32           1HD      PHE  32  14.164   4.123  -0.598
  260    HD2  PHE  32           2HD      PHE  32  15.035   3.387  -4.698
  261    HE1  PHE  32           1HE      PHE  32  15.588   6.129  -0.651
  262    HE2  PHE  32           2HE      PHE  32  16.462   5.390  -4.759
  263    HZ   PHE  32           HZ       PHE  32  16.740   6.764  -2.734
  264    H    ASN  33           H        ASN  33  14.610   0.393  -0.126
  265    HA   ASN  33           HA       ASN  33  17.069   1.786   0.430
  266   1HB   ASN  33          2HB       ASN  33  14.930   0.800   1.969
  267   2HB   ASN  33          1HB       ASN  33  16.345  -0.117   2.475
  268   1HD2  ASN  33          1HD2      ASN  33  15.865   3.241   1.440
  269   2HD2  ASN  33          2HD2      ASN  33  16.571   3.955   2.846
  270    H    PHE  34           H        PHE  34  16.041  -1.590   0.167
  271    HA   PHE  34           HA       PHE  34  18.434  -2.830   0.827
  272   1HB   PHE  34          2HB       PHE  34  16.781  -4.395   0.597
  273   2HB   PHE  34          1HB       PHE  34  16.037  -3.567  -0.764
  274    HD1  PHE  34           1HD      PHE  34  19.323  -5.210  -0.073
  275    HD2  PHE  34           2HD      PHE  34  15.991  -4.796  -2.686
  276    HE1  PHE  34           1HE      PHE  34  20.330  -6.847  -1.611
  277    HE2  PHE  34           2HE      PHE  34  16.990  -6.432  -4.228
  278    HZ   PHE  34           HZ       PHE  34  19.162  -7.460  -3.691
  279    H    LEU  35           H        LEU  35  17.481  -1.147  -2.055
  280    HA   LEU  35           HA       LEU  35  19.903  -1.999  -3.465
  281   1HB   LEU  35          2HB       LEU  35  17.562  -1.945  -4.518
  282   2HB   LEU  35          1HB       LEU  35  17.753  -0.203  -4.553
  283    HG   LEU  35           HG       LEU  35  19.717  -0.425  -5.989
  284   1HD1  LEU  35          1HD1      LEU  35  19.438  -3.239  -5.238
  285   2HD1  LEU  35          2HD1      LEU  35  20.858  -2.338  -5.770
  286   3HD1  LEU  35          3HD1      LEU  35  19.721  -2.974  -6.959
  287   1HD2  LEU  35          1HD2      LEU  35  17.454  -0.256  -6.967
  288   2HD2  LEU  35          2HD2      LEU  35  17.383  -2.016  -7.044
  289   3HD2  LEU  35          3HD2      LEU  35  18.583  -1.139  -7.995
  290    H    LYS  36           H        LYS  36  18.906   0.450  -1.429
  291    HA   LYS  36           HA       LYS  36  20.002   2.758  -2.558
  292   1HB   LYS  36          2HB       LYS  36  18.689   3.175  -0.694
  293   2HB   LYS  36          1HB       LYS  36  19.425   1.880   0.237
  294   1HG   LYS  36          2HG       LYS  36  21.344   3.938  -0.434
  295   2HG   LYS  36          1HG       LYS  36  19.959   4.582   0.451
  296   1HD   LYS  36          2HD       LYS  36  20.322   2.588   2.041
  297   2HD   LYS  36          1HD       LYS  36  21.913   2.465   1.288
  298   1HE   LYS  36          2HE       LYS  36  21.296   5.191   2.027
  299   2HE   LYS  36          1HE       LYS  36  21.187   4.107   3.413
  300   1HZ   LYS  36          1HZ       LYS  36  23.456   3.262   2.390
  301   2HZ   LYS  36          2HZ       LYS  36  23.390   4.556   3.476
  302   3HZ   LYS  36          3HZ       LYS  36  23.511   4.853   1.816
  303    HA   PRO  37           HA       PRO  37  24.132   1.662  -0.433
  304   1HB   PRO  37          2HB       PRO  37  24.456  -0.743   0.681
  305   2HB   PRO  37          1HB       PRO  37  23.629   0.566   1.534
  306   1HG   PRO  37          2HG       PRO  37  22.464  -1.766   0.062
  307   2HG   PRO  37          1HG       PRO  37  21.994  -1.086   1.631
  308   1HD   PRO  37          2HD       PRO  37  20.699  -0.538  -0.722
  309   2HD   PRO  37          1HD       PRO  37  20.726   0.561   0.671
  310    H    LYS  38           H        LYS  38  24.723   1.687  -2.654
  311    HA   LYS  38           HA       LYS  38  24.771  -0.672  -4.250
  312   1HB   LYS  38          2HB       LYS  38  26.411   0.797  -5.635
  313   2HB   LYS  38          1HB       LYS  38  24.720   1.265  -5.525
  314   1HG   LYS  38          2HG       LYS  38  25.167   3.123  -4.319
  315   2HG   LYS  38          1HG       LYS  38  26.531   2.383  -3.478
  316   1HD   LYS  38          2HD       LYS  38  27.874   2.580  -5.536
  317   2HD   LYS  38          1HD       LYS  38  26.512   3.376  -6.328
  318   1HE   LYS  38          2HE       LYS  38  28.051   4.371  -3.933
  319   2HE   LYS  38          1HE       LYS  38  28.080   5.041  -5.564
  320   1HZ   LYS  38          1HZ       LYS  38  25.480   5.157  -5.038
  321   2HZ   LYS  38          2HZ       LYS  38  26.550   6.420  -4.693
  322   3HZ   LYS  38          3HZ       LYS  38  26.090   5.345  -3.470
  323    H    LYS  39           H        LYS  39  26.737   0.464  -1.742
  324    HA   LYS  39           HA       LYS  39  29.056  -1.084  -2.647
  325   1HB   LYS  39          2HB       LYS  39  29.211   0.370  -0.084
  326   2HB   LYS  39          1HB       LYS  39  30.371   0.280  -1.401
  327   1HG   LYS  39          2HG       LYS  39  29.055   1.889  -2.679
  328   2HG   LYS  39          1HG       LYS  39  27.886   1.978  -1.360
  329   1HD   LYS  39          2HD       LYS  39  30.728   2.469  -0.683
  330   2HD   LYS  39          1HD       LYS  39  29.899   3.711  -1.624
  331   1HE   LYS  39          2HE       LYS  39  28.032   3.300   0.227
  332   2HE   LYS  39          1HE       LYS  39  29.442   2.809   1.165
  333   1HZ   LYS  39          1HZ       LYS  39  29.621   5.323  -0.311
  334   2HZ   LYS  39          2HZ       LYS  39  30.268   4.905   1.195
  335   3HZ   LYS  39          3HZ       LYS  39  28.630   5.302   1.060
  336    H    ARG  40           H        ARG  40  26.319  -1.416  -0.753
  337    HA   ARG  40           HA       ARG  40  25.593  -3.131   0.561
  338   1HB   ARG  40          2HB       ARG  40  28.275  -4.454   0.518
  339   2HB   ARG  40          1HB       ARG  40  26.674  -5.180   0.529
  340   1HG   ARG  40          2HG       ARG  40  26.730  -5.400  -1.668
  341   2HG   ARG  40          1HG       ARG  40  26.969  -3.662  -1.861
  342   1HD   ARG  40          2HD       ARG  40  29.143  -3.908  -2.321
  343   2HD   ARG  40          1HD       ARG  40  29.378  -5.043  -0.992
  344    HE   ARG  40           HE       ARG  40  28.011  -6.358  -3.051
  345   1HH1  ARG  40          1HH1      ARG  40  31.139  -4.969  -2.407
  346   2HH1  ARG  40          2HH1      ARG  40  31.980  -6.050  -3.467
  347   1HH2  ARG  40          1HH2      ARG  40  29.110  -7.789  -4.446
  348   2HH2  ARG  40          2HH2      ARG  40  30.828  -7.656  -4.622
  349    H    LYS  41           H        LYS  41  29.055  -2.855   1.393
  350    HA   LYS  41           HA       LYS  41  29.018  -3.211   4.051
  351   1HB   LYS  41          2HB       LYS  41  30.961  -1.834   4.245
  352   2HB   LYS  41          1HB       LYS  41  31.010  -2.579   2.653
  353   1HG   LYS  41          2HG       LYS  41  30.035  -0.467   1.730
  354   2HG   LYS  41          1HG       LYS  41  30.254   0.253   3.326
  355   1HD   LYS  41          2HD       LYS  41  32.674  -1.049   2.464
  356   2HD   LYS  41          1HD       LYS  41  32.127   0.108   1.249
  357   1HE   LYS  41          2HE       LYS  41  33.642   1.133   2.892
  358   2HE   LYS  41          1HE       LYS  41  32.038   1.864   2.914
  359   1HZ   LYS  41          1HZ       LYS  41  32.811  -0.288   4.794
  360   2HZ   LYS  41          2HZ       LYS  41  31.504   0.780   4.905
  361   3HZ   LYS  41          3HZ       LYS  41  33.081   1.347   5.139
  362    H    ALA  42           H        ALA  42  28.332  -2.210   5.874
  363    HA   ALA  42           HA       ALA  42  27.892   0.371   6.474
  364   1HB   ALA  42          1HB       ALA  42  25.803  -0.570   4.612
  365   2HB   ALA  42          2HB       ALA  42  26.434   1.053   4.886
  366   3HB   ALA  42          3HB       ALA  42  25.252   0.367   6.000
  Start of MODEL    9
    1   1H    ALA   1          1HT       ALA   1  34.834  -1.710   4.845
    2   2H    ALA   1          2HT       ALA   1  35.384  -0.426   3.848
    3   3H    ALA   1          3HT       ALA   1  34.546  -1.754   3.156
    4    HA   ALA   1           HA       ALA   1  33.045  -0.581   5.218
    5   1HB   ALA   1          1HB       ALA   1  33.469   1.267   2.904
    6   2HB   ALA   1          2HB       ALA   1  34.499   1.366   4.333
    7   3HB   ALA   1          3HB       ALA   1  32.757   1.597   4.484
    8    H    LYS   2           H        LYS   2  30.884  -0.711   4.675
    9    HA   LYS   2           HA       LYS   2  29.925  -1.025   2.030
   10   1HB   LYS   2          2HB       LYS   2  29.371  -3.352   1.990
   11   2HB   LYS   2          1HB       LYS   2  31.086  -3.224   2.357
   12   1HG   LYS   2          2HG       LYS   2  28.842  -3.860   4.252
   13   2HG   LYS   2          1HG       LYS   2  30.181  -4.900   3.766
   14   1HD   LYS   2          2HD       LYS   2  31.721  -3.182   4.806
   15   2HD   LYS   2          1HD       LYS   2  30.276  -2.439   5.497
   16   1HE   LYS   2          2HE       LYS   2  30.481  -5.336   5.910
   17   2HE   LYS   2          1HE       LYS   2  31.749  -4.393   6.692
   18   1HZ   LYS   2          1HZ       LYS   2  29.073  -4.728   7.485
   19   2HZ   LYS   2          2HZ       LYS   2  29.332  -3.090   7.154
   20   3HZ   LYS   2          3HZ       LYS   2  30.311  -3.889   8.278
   21    H    ILE   3           H        ILE   3  29.186   0.588   4.124
   22    HA   ILE   3           HA       ILE   3  26.785  -0.577   5.294
   23    HB   ILE   3           HB       ILE   3  28.443   0.824   6.620
   24   1HG1  ILE   3          2HG1      ILE   3  25.733   2.040   6.870
   25   2HG1  ILE   3          1HG1      ILE   3  25.872   0.293   7.043
   26   1HG2  ILE   3          1HG2      ILE   3  28.875   2.657   5.222
   27   2HG2  ILE   3          2HG2      ILE   3  27.884   3.303   6.530
   28   3HG2  ILE   3          3HG2      ILE   3  27.159   2.969   4.957
   29   1HD1  ILE   3          1HD1      ILE   3  27.125   0.452   8.967
   30   2HD1  ILE   3          2HD1      ILE   3  26.012   1.810   9.132
   31   3HD1  ILE   3          3HD1      ILE   3  27.671   2.089   8.601
   32    HA   PRO   4           HA       PRO   4  25.035   3.055   2.649
   33   1HB   PRO   4          2HB       PRO   4  26.331   3.664   0.366
   34   2HB   PRO   4          1HB       PRO   4  26.725   4.427   1.911
   35   1HG   PRO   4          2HG       PRO   4  28.123   2.212   0.479
   36   2HG   PRO   4          1HG       PRO   4  28.809   3.581   1.371
   37   1HD   PRO   4          2HD       PRO   4  28.578   1.043   2.378
   38   2HD   PRO   4          1HD       PRO   4  28.640   2.505   3.380
   39    H    ILE   5           H        ILE   5  26.546   0.248   1.191
   40    HA   ILE   5           HA       ILE   5  24.949   0.027  -1.105
   41    HB   ILE   5           HB       ILE   5  26.093  -2.237   0.530
   42   1HG1  ILE   5          2HG1      ILE   5  27.482  -1.456  -1.925
   43   2HG1  ILE   5          1HG1      ILE   5  27.492  -0.198  -0.693
   44   1HG2  ILE   5          1HG2      ILE   5  25.474  -2.224  -2.411
   45   2HG2  ILE   5          2HG2      ILE   5  24.318  -2.766  -1.194
   46   3HG2  ILE   5          3HG2      ILE   5  25.860  -3.602  -1.379
   47   1HD1  ILE   5          1HD1      ILE   5  29.117  -1.244   0.367
   48   2HD1  ILE   5          2HD1      ILE   5  29.116  -2.496  -0.874
   49   3HD1  ILE   5          3HD1      ILE   5  28.099  -2.672   0.556
   50    H    LYS   6           H        LYS   6  24.639  -1.893   1.863
   51    HA   LYS   6           HA       LYS   6  22.074  -2.867   1.320
   52   1HB   LYS   6          2HB       LYS   6  23.301  -2.389   4.043
   53   2HB   LYS   6          1HB       LYS   6  21.978  -3.488   3.674
   54   1HG   LYS   6          2HG       LYS   6  24.771  -3.747   2.582
   55   2HG   LYS   6          1HG       LYS   6  24.148  -4.623   3.981
   56   1HD   LYS   6          2HD       LYS   6  22.915  -4.746   1.232
   57   2HD   LYS   6          1HD       LYS   6  24.098  -5.910   1.834
   58   1HE   LYS   6          2HE       LYS   6  22.272  -7.044   2.504
   59   2HE   LYS   6          1HE       LYS   6  22.316  -5.922   3.864
   60   1HZ   LYS   6          1HZ       LYS   6  20.796  -5.356   1.386
   61   2HZ   LYS   6          2HZ       LYS   6  20.665  -4.587   2.888
   62   3HZ   LYS   6          3HZ       LYS   6  20.116  -6.176   2.701
   63    H    ALA   7           H        ALA   7  23.143   0.195   2.421
   64    HA   ALA   7           HA       ALA   7  20.691   1.011   3.661
   65   1HB   ALA   7          1HB       ALA   7  23.108   2.561   2.750
   66   2HB   ALA   7          2HB       ALA   7  22.715   2.053   4.392
   67   3HB   ALA   7          3HB       ALA   7  21.736   3.281   3.590
   68    H    ILE   8           H        ILE   8  22.243   1.561   0.533
   69    HA   ILE   8           HA       ILE   8  20.233   3.280  -0.492
   70    HB   ILE   8           HB       ILE   8  22.518   3.188  -1.414
   71   1HG1  ILE   8          2HG1      ILE   8  20.795   2.371  -3.703
   72   2HG1  ILE   8          1HG1      ILE   8  20.267   3.744  -2.736
   73   1HG2  ILE   8          1HG2      ILE   8  21.768   0.388  -1.832
   74   2HG2  ILE   8          2HG2      ILE   8  23.358   1.121  -1.625
   75   3HG2  ILE   8          3HG2      ILE   8  22.576   1.144  -3.206
   76   1HD1  ILE   8          1HD1      ILE   8  22.125   3.722  -4.829
   77   2HD1  ILE   8          2HD1      ILE   8  23.045   4.018  -3.354
   78   3HD1  ILE   8          3HD1      ILE   8  21.694   5.070  -3.777
   79    H    LYS   9           H        LYS   9  20.559  -0.166  -0.274
   80    HA   LYS   9           HA       LYS   9  18.610  -0.792  -2.277
   81   1HB   LYS   9          2HB       LYS   9  19.302  -2.659  -0.040
   82   2HB   LYS   9          1HB       LYS   9  18.963  -3.023  -1.727
   83   1HG   LYS   9          2HG       LYS   9  21.247  -1.440  -1.794
   84   2HG   LYS   9          1HG       LYS   9  21.484  -2.523  -0.421
   85   1HD   LYS   9          2HD       LYS   9  21.507  -4.399  -1.729
   86   2HD   LYS   9          1HD       LYS   9  20.461  -3.686  -2.958
   87   1HE   LYS   9          2HE       LYS   9  23.098  -2.416  -2.628
   88   2HE   LYS   9          1HE       LYS   9  23.119  -4.061  -3.262
   89   1HZ   LYS   9          1HZ       LYS   9  21.566  -1.795  -4.391
   90   2HZ   LYS   9          2HZ       LYS   9  21.593  -3.371  -5.003
   91   3HZ   LYS   9          3HZ       LYS   9  22.996  -2.428  -5.036
   92    H    THR  10           H        THR  10  18.607  -0.412   1.222
   93    HA   THR  10           HA       THR  10  15.936  -1.275   1.618
   94    HB   THR  10           HB       THR  10  18.100  -0.214   3.224
   95    HG1  THR  10           1HG      THR  10  17.404  -1.742   4.517
   96   1HG2  THR  10          1HG2      THR  10  15.357   0.674   4.084
   97   2HG2  THR  10          2HG2      THR  10  16.638   1.745   3.515
   98   3HG2  THR  10          3HG2      THR  10  16.856   0.819   5.000
   99    H    VAL  11           H        VAL  11  17.422   1.883   1.084
  100    HA   VAL  11           HA       VAL  11  15.061   3.402   1.411
  101    HB   VAL  11           HB       VAL  11  16.307   5.152   0.114
  102   1HG1  VAL  11          1HG1      VAL  11  16.796   4.100   2.690
  103   2HG1  VAL  11          2HG1      VAL  11  17.028   5.754   2.122
  104   3HG1  VAL  11          3HG1      VAL  11  18.349   4.590   2.012
  105   1HG2  VAL  11          1HG2      VAL  11  18.667   4.750  -0.388
  106   2HG2  VAL  11          2HG2      VAL  11  17.617   3.674  -1.310
  107   3HG2  VAL  11          3HG2      VAL  11  18.481   3.067   0.102
  108    H    GLY  12           H        GLY  12  16.694   2.032  -1.415
  109   1HA   GLY  12          2HA       GLY  12  14.953   3.066  -3.372
  110   2HA   GLY  12          1HA       GLY  12  15.949   1.625  -3.551
  111    H    LYS  13           H        LYS  13  14.828   0.155  -1.395
  112    HA   LYS  13           HA       LYS  13  12.533  -0.931  -2.715
  113   1HB   LYS  13          2HB       LYS  13  14.109  -1.586  -0.266
  114   2HB   LYS  13          1HB       LYS  13  12.485  -2.245  -0.403
  115   1HG   LYS  13          2HG       LYS  13  14.723  -2.634  -2.379
  116   2HG   LYS  13          1HG       LYS  13  14.142  -3.824  -1.212
  117   1HD   LYS  13          2HD       LYS  13  11.913  -3.725  -2.304
  118   2HD   LYS  13          1HD       LYS  13  12.597  -2.648  -3.522
  119   1HE   LYS  13          2HE       LYS  13  14.046  -5.176  -3.052
  120   2HE   LYS  13          1HE       LYS  13  12.457  -5.320  -3.802
  121   1HZ   LYS  13          1HZ       LYS  13  14.883  -4.534  -4.981
  122   2HZ   LYS  13          2HZ       LYS  13  13.803  -3.236  -5.072
  123   3HZ   LYS  13          3HZ       LYS  13  13.373  -4.740  -5.716
  124    H    ALA  14           H        ALA  14  13.104   1.384  -0.228
  125    HA   ALA  14           HA       ALA  14  10.571   1.251   1.055
  126   1HB   ALA  14          1HB       ALA  14  12.862   2.428   1.725
  127   2HB   ALA  14          2HB       ALA  14  11.305   2.976   2.349
  128   3HB   ALA  14          3HB       ALA  14  12.057   3.816   0.993
  129    H    VAL  15           H        VAL  15  11.926   3.495  -1.341
  130    HA   VAL  15           HA       VAL  15   9.622   5.010  -1.773
  131    HB   VAL  15           HB       VAL  15  11.663   4.383  -3.903
  132   1HG1  VAL  15          1HG1      VAL  15  11.132   6.873  -4.387
  133   2HG1  VAL  15          2HG1      VAL  15   9.680   6.572  -3.432
  134   3HG1  VAL  15          3HG1      VAL  15   9.984   5.633  -4.894
  135   1HG2  VAL  15          1HG2      VAL  15  13.205   5.172  -2.486
  136   2HG2  VAL  15          2HG2      VAL  15  11.990   5.773  -1.358
  137   3HG2  VAL  15          3HG2      VAL  15  12.457   6.747  -2.753
  138    H    GLY  16           H        GLY  16  10.686   1.961  -3.159
  139   1HA   GLY  16          2HA       GLY  16   8.710   1.816  -5.199
  140   2HA   GLY  16          1HA       GLY  16   9.641   0.466  -4.563
  141    H    LYS  17           H        LYS  17   8.817   0.757  -1.843
  142    HA   LYS  17           HA       LYS  17   6.333  -0.666  -1.972
  143   1HB   LYS  17          2HB       LYS  17   8.443  -0.297  -0.072
  144   2HB   LYS  17          1HB       LYS  17   6.914   0.086   0.706
  145   1HG   LYS  17          2HG       LYS  17   6.160  -2.050   0.596
  146   2HG   LYS  17          1HG       LYS  17   7.036  -2.401  -0.895
  147   1HD   LYS  17          2HD       LYS  17   9.152  -2.376   0.427
  148   2HD   LYS  17          1HD       LYS  17   8.178  -2.215   1.890
  149   1HE   LYS  17          2HE       LYS  17   6.962  -4.333   0.920
  150   2HE   LYS  17          1HE       LYS  17   8.482  -4.541   0.052
  151   1HZ   LYS  17          1HZ       LYS  17   7.890  -4.990   2.816
  152   2HZ   LYS  17          2HZ       LYS  17   9.253  -4.012   2.608
  153   3HZ   LYS  17          3HZ       LYS  17   9.195  -5.541   1.890
  154    H    GLY  18           H        GLY  18   7.352   2.585  -1.168
  155   1HA   GLY  18          2HA       GLY  18   4.993   3.461   0.106
  156   2HA   GLY  18          1HA       GLY  18   6.155   4.495  -0.717
  157    H    LEU  19           H        LEU  19   6.018   3.675  -3.291
  158    HA   LEU  19           HA       LEU  19   3.714   4.945  -4.258
  159   1HB   LEU  19          2HB       LEU  19   5.307   5.014  -5.868
  160   2HB   LEU  19          1HB       LEU  19   5.995   3.473  -5.397
  161    HG   LEU  19           HG       LEU  19   3.361   3.320  -6.716
  162   1HD1  LEU  19          1HD1      LEU  19   4.004   4.878  -8.250
  163   2HD1  LEU  19          2HD1      LEU  19   4.763   3.447  -8.949
  164   3HD1  LEU  19          3HD1      LEU  19   5.724   4.580  -7.998
  165   1HD2  LEU  19          1HD2      LEU  19   5.866   1.868  -7.465
  166   2HD2  LEU  19          2HD2      LEU  19   4.191   1.326  -7.552
  167   3HD2  LEU  19          3HD2      LEU  19   4.998   1.448  -5.989
  168    H    ARG  20           H        ARG  20   4.586   1.506  -4.140
  169    HA   ARG  20           HA       ARG  20   2.191   0.545  -5.236
  170   1HB   ARG  20          2HB       ARG  20   4.397  -0.720  -4.808
  171   2HB   ARG  20          1HB       ARG  20   3.780  -0.972  -3.180
  172   1HG   ARG  20          2HG       ARG  20   3.371  -2.849  -4.781
  173   2HG   ARG  20          1HG       ARG  20   1.929  -2.221  -3.980
  174   1HD   ARG  20          2HD       ARG  20   1.533  -2.615  -6.361
  175   2HD   ARG  20          1HD       ARG  20   1.385  -0.907  -5.959
  176    HE   ARG  20           HE       ARG  20   4.000  -1.285  -6.762
  177   1HH1  ARG  20          1HH1      ARG  20   0.831  -1.662  -8.158
  178   2HH1  ARG  20          2HH1      ARG  20   1.363  -1.332  -9.772
  179   1HH2  ARG  20          1HH2      ARG  20   4.707  -0.844  -8.881
  180   2HH2  ARG  20          2HH2      ARG  20   3.566  -0.864 -10.184
  181    H    ALA  21           H        ALA  21   3.101   1.496  -2.007
  182    HA   ALA  21           HA       ALA  21   0.963   0.377  -0.581
  183   1HB   ALA  21          1HB       ALA  21   2.692   2.791  -0.107
  184   2HB   ALA  21          2HB       ALA  21   2.722   1.232   0.717
  185   3HB   ALA  21          3HB       ALA  21   1.391   2.354   1.001
  186    H    ILE  22           H        ILE  22   1.238   3.249  -2.558
  187    HA   ILE  22           HA       ILE  22  -1.285   4.359  -1.785
  188    HB   ILE  22           HB       ILE  22   0.561   4.880  -4.114
  189   1HG1  ILE  22          2HG1      ILE  22  -0.228   7.098  -2.384
  190   2HG1  ILE  22          1HG1      ILE  22   0.539   5.786  -1.493
  191   1HG2  ILE  22          1HG2      ILE  22  -0.915   6.726  -4.774
  192   2HG2  ILE  22          2HG2      ILE  22  -2.097   6.199  -3.576
  193   3HG2  ILE  22          3HG2      ILE  22  -1.705   5.158  -4.945
  194   1HD1  ILE  22          1HD1      ILE  22   1.661   7.610  -3.537
  195   2HD1  ILE  22          2HD1      ILE  22   2.290   5.963  -3.463
  196   3HD1  ILE  22          3HD1      ILE  22   2.371   7.004  -2.041
  197    H    ASN  23           H        ASN  23  -0.145   1.946  -3.963
  198    HA   ASN  23           HA       ASN  23  -2.435   1.857  -5.656
  199   1HB   ASN  23          2HB       ASN  23  -1.038   0.575  -6.835
  200   2HB   ASN  23          1HB       ASN  23   0.112   0.639  -5.522
  201   1HD2  ASN  23          1HD2      ASN  23   0.433  -1.138  -4.277
  202   2HD2  ASN  23          2HD2      ASN  23  -0.327  -2.662  -4.563
  203    H    ILE  24           H        ILE  24  -1.261  -0.450  -3.256
  204    HA   ILE  24           HA       ILE  24  -3.575  -1.970  -3.063
  205    HB   ILE  24           HB       ILE  24  -2.760  -2.566  -0.769
  206   1HG1  ILE  24          2HG1      ILE  24  -0.359  -1.710  -0.330
  207   2HG1  ILE  24          1HG1      ILE  24  -0.778  -0.411  -1.444
  208   1HG2  ILE  24          1HG2      ILE  24  -1.585  -4.116  -1.831
  209   2HG2  ILE  24          2HG2      ILE  24  -0.287  -2.961  -2.130
  210   3HG2  ILE  24          3HG2      ILE  24  -1.613  -3.115  -3.282
  211   1HD1  ILE  24          1HD1      ILE  24  -2.664  -0.962   0.762
  212   2HD1  ILE  24          2HD1      ILE  24  -2.198   0.565   0.021
  213   3HD1  ILE  24          3HD1      ILE  24  -1.120  -0.216   1.171
  214    H    ALA  25           H        ALA  25  -2.788   1.173  -1.974
  215    HA   ALA  25           HA       ALA  25  -4.891   1.319  -0.023
  216   1HB   ALA  25          1HB       ALA  25  -2.761   2.592   0.213
  217   2HB   ALA  25          2HB       ALA  25  -4.205   3.599   0.308
  218   3HB   ALA  25          3HB       ALA  25  -3.247   3.569  -1.172
  219    H    SER  26           H        SER  26  -4.333   2.050  -3.377
  220    HA   SER  26           HA       SER  26  -6.681   3.671  -3.713
  221   1HB   SER  26          2HB       SER  26  -4.521   2.637  -5.428
  222   2HB   SER  26          1HB       SER  26  -6.087   2.760  -6.230
  223    HG   SER  26           HG       SER  26  -4.593   4.807  -4.973
  224    H    THR  27           H        THR  27  -5.884   0.287  -3.899
  225    HA   THR  27           HA       THR  27  -8.259  -0.542  -5.238
  226    HB   THR  27           HB       THR  27  -6.567  -2.237  -3.402
  227    HG1  THR  27           1HG      THR  27  -6.091  -1.918  -6.160
  228   1HG2  THR  27          1HG2      THR  27  -7.522  -3.329  -5.937
  229   2HG2  THR  27          2HG2      THR  27  -8.796  -2.932  -4.783
  230   3HG2  THR  27          3HG2      THR  27  -7.503  -4.039  -4.323
  231    H    ALA  28           H        ALA  28  -7.253  -0.290  -1.868
  232    HA   ALA  28           HA       ALA  28  -9.450  -1.495  -0.649
  233   1HB   ALA  28          1HB       ALA  28  -8.539  -0.788   1.291
  234   2HB   ALA  28          2HB       ALA  28  -8.350   0.870   0.721
  235   3HB   ALA  28          3HB       ALA  28  -7.174  -0.360   0.258
  236    H    ASN  29           H        ASN  29  -9.090   1.645  -2.118
  237    HA   ASN  29           HA       ASN  29 -11.227   3.009  -0.965
  238   1HB   ASN  29          2HB       ASN  29 -10.319   3.211  -3.841
  239   2HB   ASN  29          1HB       ASN  29 -11.201   4.433  -2.930
  240   1HD2  ASN  29          1HD2      ASN  29  -9.545   3.725  -0.516
  241   2HD2  ASN  29          2HD2      ASN  29  -8.046   4.543  -0.775
  242    H    ASP  30           H        ASP  30 -11.317   1.586  -4.218
  243    HA   ASP  30           HA       ASP  30 -14.045   1.613  -4.574
  244   1HB   ASP  30          2HB       ASP  30 -12.026   0.825  -6.127
  245   2HB   ASP  30          1HB       ASP  30 -12.571  -0.765  -5.600
  246    H    VAL  31           H        VAL  31 -12.076  -0.714  -2.837
  247    HA   VAL  31           HA       VAL  31 -14.057  -2.689  -2.464
  248    HB   VAL  31           HB       VAL  31 -11.777  -2.064  -0.588
  249   1HG1  VAL  31          1HG1      VAL  31 -12.220  -4.817  -0.771
  250   2HG1  VAL  31          2HG1      VAL  31 -13.821  -4.089  -0.643
  251   3HG1  VAL  31          3HG1      VAL  31 -12.600  -3.760   0.587
  252   1HG2  VAL  31          1HG2      VAL  31 -10.290  -2.983  -1.995
  253   2HG2  VAL  31          2HG2      VAL  31 -11.478  -2.595  -3.240
  254   3HG2  VAL  31          3HG2      VAL  31 -11.424  -4.216  -2.547
  255    H    PHE  32           H        PHE  32 -13.028   0.055  -0.486
  256    HA   PHE  32           HA       PHE  32 -14.636  -0.335   1.735
  257   1HB   PHE  32          2HB       PHE  32 -13.030   1.381   1.888
  258   2HB   PHE  32          1HB       PHE  32 -13.586   2.154   0.407
  259    HD1  PHE  32           1HD      PHE  32 -13.723   2.183   3.934
  260    HD2  PHE  32           2HD      PHE  32 -15.982   3.136   0.456
  261    HE1  PHE  32           1HE      PHE  32 -15.125   3.703   5.266
  262    HE2  PHE  32           2HE      PHE  32 -17.388   4.658   1.780
  263    HZ   PHE  32           HZ       PHE  32 -16.961   4.944   4.189
  264    H    ASN  33           H        ASN  33 -15.429   0.915  -1.429
  265    HA   ASN  33           HA       ASN  33 -18.038   1.860  -0.689
  266   1HB   ASN  33          2HB       ASN  33 -16.368   1.832  -3.085
  267   2HB   ASN  33          1HB       ASN  33 -18.064   1.516  -3.438
  268   1HD2  ASN  33          1HD2      ASN  33 -18.418   3.445  -4.459
  269   2HD2  ASN  33          2HD2      ASN  33 -18.435   4.962  -3.632
  270    H    PHE  34           H        PHE  34 -16.699  -1.020  -2.215
  271    HA   PHE  34           HA       PHE  34 -19.193  -2.219  -2.847
  272   1HB   PHE  34          2HB       PHE  34 -17.091  -2.860  -3.960
  273   2HB   PHE  34          1HB       PHE  34 -16.490  -3.518  -2.442
  274    HD1  PHE  34           1HD      PHE  34 -19.107  -3.917  -5.029
  275    HD2  PHE  34           2HD      PHE  34 -17.027  -5.698  -1.772
  276    HE1  PHE  34           1HE      PHE  34 -20.127  -6.090  -5.570
  277    HE2  PHE  34           2HE      PHE  34 -18.043  -7.874  -2.307
  278    HZ   PHE  34           HZ       PHE  34 -19.595  -8.072  -4.209
  279    H    LEU  35           H        LEU  35 -17.609  -1.729   0.086
  280    HA   LEU  35           HA       LEU  35 -18.783  -4.065   1.381
  281   1HB   LEU  35          2HB       LEU  35 -16.502  -3.455   1.989
  282   2HB   LEU  35          1HB       LEU  35 -17.036  -1.855   2.468
  283    HG   LEU  35           HG       LEU  35 -18.318  -2.797   4.312
  284   1HD1  LEU  35          1HD1      LEU  35 -19.052  -4.881   3.520
  285   2HD1  LEU  35          2HD1      LEU  35 -17.934  -5.255   4.831
  286   3HD1  LEU  35          3HD1      LEU  35 -17.411  -5.414   3.154
  287   1HD2  LEU  35          1HD2      LEU  35 -16.514  -3.383   5.720
  288   2HD2  LEU  35          2HD2      LEU  35 -15.855  -2.273   4.518
  289   3HD2  LEU  35          3HD2      LEU  35 -15.566  -4.006   4.370
  290    H    LYS  36           H        LYS  36 -19.985  -1.259   0.390
  291    HA   LYS  36           HA       LYS  36 -21.712  -0.932   2.754
  292   1HB   LYS  36          2HB       LYS  36 -20.272   1.031   1.128
  293   2HB   LYS  36          1HB       LYS  36 -21.976   1.412   1.329
  294   1HG   LYS  36          2HG       LYS  36 -20.900   2.508   3.086
  295   2HG   LYS  36          1HG       LYS  36 -21.600   1.063   3.820
  296   1HD   LYS  36          2HD       LYS  36 -19.567   0.093   4.175
  297   2HD   LYS  36          1HD       LYS  36 -18.831   0.866   2.770
  298   1HE   LYS  36          2HE       LYS  36 -17.824   1.840   4.680
  299   2HE   LYS  36          1HE       LYS  36 -18.951   3.035   4.041
  300   1HZ   LYS  36          1HZ       LYS  36 -19.039   2.784   6.482
  301   2HZ   LYS  36          2HZ       LYS  36 -19.573   1.192   6.283
  302   3HZ   LYS  36          3HZ       LYS  36 -20.525   2.478   5.731
  303    HA   PRO  37           HA       PRO  37 -24.190  -2.622  -0.862
  304   1HB   PRO  37          2HB       PRO  37 -25.983  -3.728   0.993
  305   2HB   PRO  37          1HB       PRO  37 -24.706  -4.592   0.134
  306   1HG   PRO  37          2HG       PRO  37 -24.714  -3.475   2.896
  307   2HG   PRO  37          1HG       PRO  37 -23.941  -4.946   2.278
  308   1HD   PRO  37          2HD       PRO  37 -22.513  -2.745   2.813
  309   2HD   PRO  37          1HD       PRO  37 -22.124  -3.776   1.419
  310    H    LYS  38           H        LYS  38 -26.494  -2.235  -1.317
  311    HA   LYS  38           HA       LYS  38 -27.261   0.379  -1.044
  312   1HB   LYS  38          2HB       LYS  38 -28.297  -1.808  -2.309
  313   2HB   LYS  38          1HB       LYS  38 -29.525  -1.501  -1.088
  314   1HG   LYS  38          2HG       LYS  38 -30.182  -0.333  -3.034
  315   2HG   LYS  38          1HG       LYS  38 -29.588   0.876  -1.894
  316   1HD   LYS  38          2HD       LYS  38 -27.312   0.259  -3.242
  317   2HD   LYS  38          1HD       LYS  38 -28.525   0.055  -4.508
  318   1HE   LYS  38          2HE       LYS  38 -29.349   2.302  -4.116
  319   2HE   LYS  38          1HE       LYS  38 -28.217   2.509  -2.780
  320   1HZ   LYS  38          1HZ       LYS  38 -27.458   3.551  -4.855
  321   2HZ   LYS  38          2HZ       LYS  38 -27.426   2.034  -5.603
  322   3HZ   LYS  38          3HZ       LYS  38 -26.387   2.360  -4.308
  323    H    LYS  39           H        LYS  39 -27.676  -2.220   1.228
  324    HA   LYS  39           HA       LYS  39 -29.275  -0.469   2.968
  325   1HB   LYS  39          2HB       LYS  39 -29.704  -2.624   4.243
  326   2HB   LYS  39          1HB       LYS  39 -30.429  -2.507   2.646
  327   1HG   LYS  39          2HG       LYS  39 -27.768  -3.709   2.646
  328   2HG   LYS  39          1HG       LYS  39 -28.971  -4.614   3.567
  329   1HD   LYS  39          2HD       LYS  39 -30.366  -4.872   1.690
  330   2HD   LYS  39          1HD       LYS  39 -29.511  -3.623   0.781
  331   1HE   LYS  39          2HE       LYS  39 -27.552  -5.041   0.624
  332   2HE   LYS  39          1HE       LYS  39 -28.333  -6.271   1.615
  333   1HZ   LYS  39          1HZ       LYS  39 -29.321  -7.102  -0.169
  334   2HZ   LYS  39          2HZ       LYS  39 -28.416  -6.047  -1.132
  335   3HZ   LYS  39          3HZ       LYS  39 -29.960  -5.597  -0.607
  336    H    ARG  40           H        ARG  40 -26.614   0.157   2.799
  337    HA   ARG  40           HA       ARG  40 -24.970  -1.128   4.700
  338   1HB   ARG  40          2HB       ARG  40 -23.514   0.801   4.500
  339   2HB   ARG  40          1HB       ARG  40 -24.107   0.340   2.910
  340   1HG   ARG  40          2HG       ARG  40 -25.920   2.132   3.321
  341   2HG   ARG  40          1HG       ARG  40 -24.822   2.718   4.573
  342   1HD   ARG  40          2HD       ARG  40 -23.023   2.718   2.779
  343   2HD   ARG  40          1HD       ARG  40 -24.328   2.492   1.615
  344    HE   ARG  40           HE       ARG  40 -24.784   4.712   1.811
  345   1HH1  ARG  40          1HH1      ARG  40 -23.128   3.678   4.694
  346   2HH1  ARG  40          2HH1      ARG  40 -23.052   5.268   5.377
  347   1HH2  ARG  40          1HH2      ARG  40 -24.690   6.811   2.702
  348   2HH2  ARG  40          2HH2      ARG  40 -23.937   7.050   4.244
  349    H    LYS  41           H        LYS  41 -25.322  -1.243   6.812
  350    HA   LYS  41           HA       LYS  41 -26.995   0.690   8.158
  351   1HB   LYS  41          2HB       LYS  41 -25.476  -1.361   9.689
  352   2HB   LYS  41          1HB       LYS  41 -27.139  -0.821   9.879
  353   1HG   LYS  41          2HG       LYS  41 -27.037  -2.067   7.379
  354   2HG   LYS  41          1HG       LYS  41 -26.108  -3.096   8.470
  355   1HD   LYS  41          2HD       LYS  41 -27.921  -3.592   9.767
  356   2HD   LYS  41          1HD       LYS  41 -28.715  -2.051   9.438
  357   1HE   LYS  41          2HE       LYS  41 -29.558  -2.780   7.399
  358   2HE   LYS  41          1HE       LYS  41 -28.376  -4.081   7.264
  359   1HZ   LYS  41          1HZ       LYS  41 -30.953  -4.079   8.523
  360   2HZ   LYS  41          2HZ       LYS  41 -29.741  -4.695   9.528
  361   3HZ   LYS  41          3HZ       LYS  41 -30.005  -5.382   8.005
  362    H    ALA  42           H        ALA  42 -26.117   1.278  10.501
  363    HA   ALA  42           HA       ALA  42 -24.576   2.370  11.801
  364   1HB   ALA  42          1HB       ALA  42 -22.236   2.402  10.179
  365   2HB   ALA  42          2HB       ALA  42 -22.947   0.790  10.112
  366   3HB   ALA  42          3HB       ALA  42 -22.536   1.508  11.670
  Start of MODEL   10
    1   1H    ALA   1          1HT       ALA   1  33.466   0.478  -0.359
    2   2H    ALA   1          2HT       ALA   1  33.327   0.738   1.333
    3   3H    ALA   1          3HT       ALA   1  34.797   1.102   0.525
    4    HA   ALA   1           HA       ALA   1  32.482   2.664   0.891
    5   1HB   ALA   1          1HB       ALA   1  35.338   2.925   0.527
    6   2HB   ALA   1          2HB       ALA   1  34.203   3.996   1.348
    7   3HB   ALA   1          3HB       ALA   1  34.451   4.141  -0.392
    8    H    LYS   2           H        LYS   2  31.637   0.942  -1.005
    9    HA   LYS   2           HA       LYS   2  31.905   2.308  -3.578
   10   1HB   LYS   2          2HB       LYS   2  31.933  -0.363  -2.961
   11   2HB   LYS   2          1HB       LYS   2  30.264  -0.128  -3.463
   12   1HG   LYS   2          2HG       LYS   2  32.761   0.012  -5.037
   13   2HG   LYS   2          1HG       LYS   2  31.169  -0.607  -5.481
   14   1HD   LYS   2          2HD       LYS   2  30.426   1.854  -5.408
   15   2HD   LYS   2          1HD       LYS   2  32.150   2.228  -5.453
   16   1HE   LYS   2          2HE       LYS   2  31.847   2.182  -7.684
   17   2HE   LYS   2          1HE       LYS   2  31.978   0.436  -7.469
   18   1HZ   LYS   2          1HZ       LYS   2  30.035   0.528  -8.601
   19   2HZ   LYS   2          2HZ       LYS   2  29.624   2.068  -8.035
   20   3HZ   LYS   2          3HZ       LYS   2  29.403   0.716  -7.043
   21    H    ILE   3           H        ILE   3  30.285   3.222  -1.215
   22    HA   ILE   3           HA       ILE   3  28.297   4.261  -0.840
   23    HB   ILE   3           HB       ILE   3  27.996   3.935  -3.825
   24   1HG1  ILE   3          2HG1      ILE   3  29.796   5.379  -3.535
   25   2HG1  ILE   3          1HG1      ILE   3  28.439   6.498  -3.614
   26   1HG2  ILE   3          1HG2      ILE   3  25.830   4.375  -3.354
   27   2HG2  ILE   3          2HG2      ILE   3  26.423   6.032  -3.240
   28   3HG2  ILE   3          3HG2      ILE   3  26.202   5.072  -1.777
   29   1HD1  ILE   3          1HD1      ILE   3  30.181   5.781  -1.335
   30   2HD1  ILE   3          2HD1      ILE   3  28.491   6.148  -0.989
   31   3HD1  ILE   3          3HD1      ILE   3  29.504   7.340  -1.804
   32    HA   PRO   4           HA       PRO   4  26.313  -0.046  -1.222
   33   1HB   PRO   4          2HB       PRO   4  26.460  -0.640   1.446
   34   2HB   PRO   4          1HB       PRO   4  27.682  -1.117   0.263
   35   1HG   PRO   4          2HG       PRO   4  27.688   1.187   2.170
   36   2HG   PRO   4          1HG       PRO   4  29.013   0.094   1.728
   37   1HD   PRO   4          2HD       PRO   4  28.796   2.576   0.699
   38   2HD   PRO   4          1HD       PRO   4  29.454   1.219  -0.238
   39    H    ILE   5           H        ILE   5  25.985   2.741   0.852
   40    HA   ILE   5           HA       ILE   5  23.741   2.415   2.278
   41    HB   ILE   5           HB       ILE   5  23.125   4.820   1.165
   42   1HG1  ILE   5          2HG1      ILE   5  26.132   4.644   1.002
   43   2HG1  ILE   5          1HG1      ILE   5  25.096   4.450  -0.408
   44   1HG2  ILE   5          1HG2      ILE   5  24.438   5.802   3.006
   45   2HG2  ILE   5          2HG2      ILE   5  25.208   4.236   3.261
   46   3HG2  ILE   5          3HG2      ILE   5  23.473   4.419   3.521
   47   1HD1  ILE   5          1HD1      ILE   5  24.938   6.641  -0.646
   48   2HD1  ILE   5          2HD1      ILE   5  26.105   6.823   0.664
   49   3HD1  ILE   5          3HD1      ILE   5  24.376   6.830   1.015
   50    H    LYS   6           H        LYS   6  23.471   3.734  -1.013
   51    HA   LYS   6           HA       LYS   6  20.825   3.566  -1.446
   52   1HB   LYS   6          2HB       LYS   6  21.384   2.946  -3.858
   53   2HB   LYS   6          1HB       LYS   6  22.133   4.400  -3.215
   54   1HG   LYS   6          2HG       LYS   6  24.133   3.612  -3.723
   55   2HG   LYS   6          1HG       LYS   6  23.860   2.207  -2.691
   56   1HD   LYS   6          2HD       LYS   6  24.260   1.231  -4.752
   57   2HD   LYS   6          1HD       LYS   6  22.497   1.311  -4.715
   58   1HE   LYS   6          2HE       LYS   6  23.793   3.701  -5.808
   59   2HE   LYS   6          1HE       LYS   6  24.073   2.234  -6.745
   60   1HZ   LYS   6          1HZ       LYS   6  22.011   3.673  -7.240
   61   2HZ   LYS   6          2HZ       LYS   6  21.347   2.930  -5.874
   62   3HZ   LYS   6          3HZ       LYS   6  21.838   1.990  -7.191
   63    H    ALA   7           H        ALA   7  23.051   0.854  -1.390
   64    HA   ALA   7           HA       ALA   7  21.323  -1.116  -2.404
   65   1HB   ALA   7          1HB       ALA   7  22.891  -2.686  -1.699
   66   2HB   ALA   7          2HB       ALA   7  23.396  -1.703  -0.324
   67   3HB   ALA   7          3HB       ALA   7  23.856  -1.232  -1.960
   68    H    ILE   8           H        ILE   8  22.116  -0.301   0.964
   69    HA   ILE   8           HA       ILE   8  20.291  -2.059   2.164
   70    HB   ILE   8           HB       ILE   8  22.073  -1.042   3.457
   71   1HG1  ILE   8          2HG1      ILE   8  19.370  -0.129   4.469
   72   2HG1  ILE   8          1HG1      ILE   8  20.008  -1.763   4.623
   73   1HG2  ILE   8          1HG2      ILE   8  20.735   1.488   2.634
   74   2HG2  ILE   8          2HG2      ILE   8  22.451   1.083   2.686
   75   3HG2  ILE   8          3HG2      ILE   8  21.582   1.431   4.181
   76   1HD1  ILE   8          1HD1      ILE   8  21.359   0.658   5.780
   77   2HD1  ILE   8          2HD1      ILE   8  21.722  -1.039   6.095
   78   3HD1  ILE   8          3HD1      ILE   8  20.206  -0.342   6.664
   79    H    LYS   9           H        LYS   9  19.785   0.819   0.434
   80    HA   LYS   9           HA       LYS   9  17.296   1.528   1.716
   81   1HB   LYS   9          2HB       LYS   9  18.685   2.543  -0.764
   82   2HB   LYS   9          1HB       LYS   9  17.125   3.146  -0.221
   83   1HG   LYS   9          2HG       LYS   9  19.768   3.350   1.195
   84   2HG   LYS   9          1HG       LYS   9  18.779   4.660   0.545
   85   1HD   LYS   9          2HD       LYS   9  18.079   2.856   2.859
   86   2HD   LYS   9          1HD       LYS   9  18.536   4.558   2.954
   87   1HE   LYS   9          2HE       LYS   9  16.441   4.533   1.148
   88   2HE   LYS   9          1HE       LYS   9  15.961   3.348   2.361
   89   1HZ   LYS   9          1HZ       LYS   9  16.961   6.003   3.168
   90   2HZ   LYS   9          2HZ       LYS   9  15.978   4.930   4.031
   91   3HZ   LYS   9          3HZ       LYS   9  15.342   5.793   2.722
   92    H    THR  10           H        THR  10  18.359  -0.275  -1.085
   93    HA   THR  10           HA       THR  10  15.806  -0.452  -2.335
   94    HB   THR  10           HB       THR  10  18.295  -2.144  -2.622
   95    HG1  THR  10           1HG      THR  10  17.224   0.032  -4.073
   96   1HG2  THR  10          1HG2      THR  10  17.323  -2.807  -4.817
   97   2HG2  THR  10          2HG2      THR  10  15.783  -2.145  -4.269
   98   3HG2  THR  10          3HG2      THR  10  16.514  -3.502  -3.412
   99    H    VAL  11           H        VAL  11  17.544  -2.374   0.026
  100    HA   VAL  11           HA       VAL  11  15.672  -4.544  -0.003
  101    HB   VAL  11           HB       VAL  11  18.145  -4.550   0.799
  102   1HG1  VAL  11          1HG1      VAL  11  17.974  -2.784   2.444
  103   2HG1  VAL  11          2HG1      VAL  11  18.399  -4.303   3.232
  104   3HG1  VAL  11          3HG1      VAL  11  16.748  -3.693   3.327
  105   1HG2  VAL  11          1HG2      VAL  11  17.589  -6.643   1.285
  106   2HG2  VAL  11          2HG2      VAL  11  15.892  -6.166   1.357
  107   3HG2  VAL  11          3HG2      VAL  11  16.885  -6.115   2.814
  108    H    GLY  12           H        GLY  12  16.303  -1.770   2.074
  109   1HA   GLY  12          2HA       GLY  12  14.239  -2.309   3.948
  110   2HA   GLY  12          1HA       GLY  12  15.056  -0.770   3.725
  111    H    LYS  13           H        LYS  13  14.287  -0.645   0.861
  112    HA   LYS  13           HA       LYS  13  11.726   0.605   1.266
  113   1HB   LYS  13          2HB       LYS  13  11.906   1.215  -1.129
  114   2HB   LYS  13          1HB       LYS  13  13.322   1.683  -0.198
  115   1HG   LYS  13          2HG       LYS  13  14.322   0.805  -2.043
  116   2HG   LYS  13          1HG       LYS  13  14.232  -0.634  -1.027
  117   1HD   LYS  13          2HD       LYS  13  13.005  -1.670  -2.564
  118   2HD   LYS  13          1HD       LYS  13  11.795  -0.387  -2.488
  119   1HE   LYS  13          2HE       LYS  13  12.479   0.515  -4.417
  120   2HE   LYS  13          1HE       LYS  13  14.180   0.387  -3.969
  121   1HZ   LYS  13          1HZ       LYS  13  13.232  -2.189  -4.477
  122   2HZ   LYS  13          2HZ       LYS  13  14.367  -1.303  -5.365
  123   3HZ   LYS  13          3HZ       LYS  13  12.725  -1.208  -5.759
  124    H    ALA  14           H        ALA  14  12.907  -2.394  -0.040
  125    HA   ALA  14           HA       ALA  14  10.558  -3.096  -1.488
  126   1HB   ALA  14          1HB       ALA  14  13.129  -4.194  -1.094
  127   2HB   ALA  14          2HB       ALA  14  11.884  -4.717  -2.229
  128   3HB   ALA  14          3HB       ALA  14  11.960  -5.424  -0.615
  129    H    VAL  15           H        VAL  15  11.803  -3.979   1.708
  130    HA   VAL  15           HA       VAL  15   9.596  -5.602   2.431
  131    HB   VAL  15           HB       VAL  15  11.720  -4.229   4.071
  132   1HG1  VAL  15          1HG1      VAL  15  10.861  -5.838   5.896
  133   2HG1  VAL  15          2HG1      VAL  15   9.358  -5.835   4.972
  134   3HG1  VAL  15          3HG1      VAL  15   9.995  -4.325   5.624
  135   1HG2  VAL  15          1HG2      VAL  15  12.387  -6.635   4.457
  136   2HG2  VAL  15          2HG2      VAL  15  12.606  -6.030   2.815
  137   3HG2  VAL  15          3HG2      VAL  15  11.231  -7.066   3.197
  138    H    GLY  16           H        GLY  16  10.251  -2.177   2.636
  139   1HA   GLY  16          2HA       GLY  16   8.131  -1.570   4.458
  140   2HA   GLY  16          1HA       GLY  16   9.010  -0.418   3.462
  141    H    LYS  17           H        LYS  17   8.433  -1.705   0.955
  142    HA   LYS  17           HA       LYS  17   5.908  -0.497   0.420
  143   1HB   LYS  17          2HB       LYS  17   8.084  -1.058  -1.098
  144   2HB   LYS  17          1HB       LYS  17   7.016  -2.370  -1.577
  145   1HG   LYS  17          2HG       LYS  17   6.637  -0.639  -3.115
  146   2HG   LYS  17          1HG       LYS  17   5.259  -0.606  -2.013
  147   1HD   LYS  17          2HD       LYS  17   5.773   1.624  -2.073
  148   2HD   LYS  17          1HD       LYS  17   6.778   1.116  -0.715
  149   1HE   LYS  17          2HE       LYS  17   8.349   2.253  -1.900
  150   2HE   LYS  17          1HE       LYS  17   8.520   0.677  -2.671
  151   1HZ   LYS  17          1HZ       LYS  17   6.682   2.736  -3.733
  152   2HZ   LYS  17          2HZ       LYS  17   7.306   1.376  -4.523
  153   3HZ   LYS  17          3HZ       LYS  17   8.315   2.689  -4.175
  154    H    GLY  18           H        GLY  18   7.037  -3.808   0.823
  155   1HA   GLY  18          2HA       GLY  18   4.700  -5.115  -0.056
  156   2HA   GLY  18          1HA       GLY  18   5.894  -5.788   1.045
  157    H    LEU  19           H        LEU  19   5.707  -4.080   3.187
  158    HA   LEU  19           HA       LEU  19   3.506  -5.102   4.575
  159   1HB   LEU  19          2HB       LEU  19   4.725  -4.371   6.281
  160   2HB   LEU  19          1HB       LEU  19   5.787  -3.540   5.164
  161    HG   LEU  19           HG       LEU  19   4.178  -1.575   5.294
  162   1HD1  LEU  19          1HD1      LEU  19   3.168  -2.072   7.873
  163   2HD1  LEU  19          2HD1      LEU  19   2.741  -3.467   6.883
  164   3HD1  LEU  19          3HD1      LEU  19   2.263  -1.847   6.376
  165   1HD2  LEU  19          1HD2      LEU  19   6.365  -2.229   6.779
  166   2HD2  LEU  19          2HD2      LEU  19   5.166  -1.911   8.032
  167   3HD2  LEU  19          3HD2      LEU  19   5.538  -0.673   6.833
  168    H    ARG  20           H        ARG  20   3.995  -2.002   2.959
  169    HA   ARG  20           HA       ARG  20   1.598  -0.800   3.820
  170   1HB   ARG  20          2HB       ARG  20   3.765  -0.129   2.098
  171   2HB   ARG  20          1HB       ARG  20   2.276   0.136   1.205
  172   1HG   ARG  20          2HG       ARG  20   3.367   2.020   2.694
  173   2HG   ARG  20          1HG       ARG  20   1.617   1.858   2.536
  174   1HD   ARG  20          2HD       ARG  20   1.370   0.992   4.656
  175   2HD   ARG  20          1HD       ARG  20   3.023   0.384   4.714
  176    HE   ARG  20           HE       ARG  20   2.110   2.962   5.542
  177   1HH1  ARG  20          1HH1      ARG  20   4.837   1.233   4.235
  178   2HH1  ARG  20          2HH1      ARG  20   6.007   2.344   4.865
  179   1HH2  ARG  20          1HH2      ARG  20   3.644   4.433   6.370
  180   2HH2  ARG  20          2HH2      ARG  20   5.329   4.163   6.075
  181    H    ALA  21           H        ALA  21   2.363  -2.847   1.057
  182    HA   ALA  21           HA       ALA  21  -0.042  -2.567  -0.332
  183   1HB   ALA  21          1HB       ALA  21   1.983  -3.760  -1.176
  184   2HB   ALA  21          2HB       ALA  21   0.483  -4.657  -1.409
  185   3HB   ALA  21          3HB       ALA  21   1.583  -5.102  -0.105
  186    H    ILE  22           H        ILE  22   0.828  -4.494   2.460
  187    HA   ILE  22           HA       ILE  22  -1.659  -5.924   2.548
  188    HB   ILE  22           HB       ILE  22   0.542  -5.565   4.583
  189   1HG1  ILE  22          2HG1      ILE  22  -0.370  -7.974   2.990
  190   2HG1  ILE  22          1HG1      ILE  22   1.043  -6.989   2.623
  191   1HG2  ILE  22          1HG2      ILE  22  -0.600  -7.252   5.942
  192   2HG2  ILE  22          2HG2      ILE  22  -1.957  -7.237   4.817
  193   3HG2  ILE  22          3HG2      ILE  22  -1.576  -5.795   5.758
  194   1HD1  ILE  22          1HD1      ILE  22   0.915  -8.118   5.341
  195   2HD1  ILE  22          2HD1      ILE  22   2.285  -7.934   4.245
  196   3HD1  ILE  22          3HD1      ILE  22   1.147  -9.263   4.020
  197    H    ASN  23           H        ASN  23  -0.520  -2.835   3.516
  198    HA   ASN  23           HA       ASN  23  -2.487  -2.377   5.554
  199   1HB   ASN  23          2HB       ASN  23  -1.394  -0.435   5.935
  200   2HB   ASN  23          1HB       ASN  23  -0.136  -1.234   5.022
  201   1HD2  ASN  23          1HD2      ASN  23  -3.006   0.773   4.502
  202   2HD2  ASN  23          2HD2      ASN  23  -2.305   1.767   3.276
  203    H    ILE  24           H        ILE  24  -1.993  -1.046   2.301
  204    HA   ILE  24           HA       ILE  24  -4.489   0.249   2.188
  205    HB   ILE  24           HB       ILE  24  -3.959   0.881   0.080
  206   1HG1  ILE  24          2HG1      ILE  24  -4.328  -1.490  -0.802
  207   2HG1  ILE  24          1HG1      ILE  24  -3.217  -0.477  -1.711
  208   1HG2  ILE  24          1HG2      ILE  24  -1.632   1.149  -0.228
  209   2HG2  ILE  24          2HG2      ILE  24  -1.271  -0.307   0.699
  210   3HG2  ILE  24          3HG2      ILE  24  -1.914   1.119   1.513
  211   1HD1  ILE  24          1HD1      ILE  24  -2.735  -3.026  -0.827
  212   2HD1  ILE  24          2HD1      ILE  24  -1.875  -2.022   0.340
  213   3HD1  ILE  24          3HD1      ILE  24  -1.526  -1.868  -1.382
  214    H    ALA  25           H        ALA  25  -3.521  -2.999   1.979
  215    HA   ALA  25           HA       ALA  25  -5.876  -3.916   0.602
  216   1HB   ALA  25          1HB       ALA  25  -3.648  -5.398   1.993
  217   2HB   ALA  25          2HB       ALA  25  -3.862  -5.179   0.256
  218   3HB   ALA  25          3HB       ALA  25  -4.992  -6.183   1.163
  219    H    SER  26           H        SER  26  -4.770  -3.348   3.847
  220    HA   SER  26           HA       SER  26  -6.989  -4.850   5.008
  221   1HB   SER  26          2HB       SER  26  -4.482  -3.658   6.005
  222   2HB   SER  26          1HB       SER  26  -5.849  -3.530   7.111
  223    HG   SER  26           HG       SER  26  -5.514  -5.998   5.913
  224    H    THR  27           H        THR  27  -6.170  -1.632   4.106
  225    HA   THR  27           HA       THR  27  -8.262  -0.415   5.707
  226    HB   THR  27           HB       THR  27  -6.191   0.622   3.792
  227    HG1  THR  27           1HG      THR  27  -5.292   1.239   5.575
  228   1HG2  THR  27          1HG2      THR  27  -7.085   2.921   4.364
  229   2HG2  THR  27          2HG2      THR  27  -8.589   2.108   4.798
  230   3HG2  THR  27          3HG2      THR  27  -7.970   1.996   3.150
  231    H    ALA  28           H        ALA  28  -7.735  -1.590   2.486
  232    HA   ALA  28           HA       ALA  28  -9.985  -0.267   1.299
  233   1HB   ALA  28          1HB       ALA  28  -9.569  -1.784  -0.604
  234   2HB   ALA  28          2HB       ALA  28  -8.351  -2.622   0.358
  235   3HB   ALA  28          3HB       ALA  28  -8.114  -0.932  -0.086
  236    H    ASN  29           H        ASN  29  -9.481  -3.134   3.151
  237    HA   ASN  29           HA       ASN  29 -11.620  -4.716   2.307
  238   1HB   ASN  29          2HB       ASN  29 -10.209  -4.444   4.951
  239   2HB   ASN  29          1HB       ASN  29 -11.538  -5.580   4.730
  240   1HD2  ASN  29          1HD2      ASN  29  -9.321  -6.726   5.445
  241   2HD2  ASN  29          2HD2      ASN  29  -8.512  -7.499   4.128
  242    H    ASP  30           H        ASP  30 -11.626  -2.891   5.355
  243    HA   ASP  30           HA       ASP  30 -14.281  -2.935   5.918
  244   1HB   ASP  30          2HB       ASP  30 -12.113  -1.551   6.910
  245   2HB   ASP  30          1HB       ASP  30 -13.164  -0.257   6.344
  246    H    VAL  31           H        VAL  31 -12.662  -0.904   3.563
  247    HA   VAL  31           HA       VAL  31 -14.879   0.769   2.976
  248    HB   VAL  31           HB       VAL  31 -12.424   0.105   1.351
  249   1HG1  VAL  31          1HG1      VAL  31 -14.674   2.021   0.830
  250   2HG1  VAL  31          2HG1      VAL  31 -13.971   0.819  -0.253
  251   3HG1  VAL  31          3HG1      VAL  31 -13.064   2.275   0.157
  252   1HG2  VAL  31          1HG2      VAL  31 -13.106   2.579   2.933
  253   2HG2  VAL  31          2HG2      VAL  31 -11.593   2.240   2.093
  254   3HG2  VAL  31          3HG2      VAL  31 -12.054   1.282   3.500
  255    H    PHE  32           H        PHE  32 -13.495  -2.040   1.313
  256    HA   PHE  32           HA       PHE  32 -15.174  -2.244  -0.840
  257   1HB   PHE  32          2HB       PHE  32 -13.306  -3.749  -0.585
  258   2HB   PHE  32          1HB       PHE  32 -14.018  -4.462   0.859
  259    HD1  PHE  32           1HD      PHE  32 -15.960  -3.637  -2.144
  260    HD2  PHE  32           2HD      PHE  32 -14.006  -6.710   0.057
  261    HE1  PHE  32           1HE      PHE  32 -17.073  -5.333  -3.534
  262    HE2  PHE  32           2HE      PHE  32 -15.114  -8.414  -1.331
  263    HZ   PHE  32           HZ       PHE  32 -16.649  -7.726  -3.130
  264    H    ASN  33           H        ASN  33 -15.905  -2.799   2.491
  265    HA   ASN  33           HA       ASN  33 -18.417  -4.146   1.902
  266   1HB   ASN  33          2HB       ASN  33 -16.662  -4.250   4.042
  267   2HB   ASN  33          1HB       ASN  33 -18.005  -3.297   4.668
  268   1HD2  ASN  33          1HD2      ASN  33 -18.626  -4.912   6.082
  269   2HD2  ASN  33          2HD2      ASN  33 -19.402  -6.360   5.549
  270    H    PHE  34           H        PHE  34 -17.216  -1.008   2.833
  271    HA   PHE  34           HA       PHE  34 -19.634   0.127   3.723
  272   1HB   PHE  34          2HB       PHE  34 -17.175   1.003   3.880
  273   2HB   PHE  34          1HB       PHE  34 -17.541   1.759   2.332
  274    HD1  PHE  34           1HD      PHE  34 -17.537   2.228   5.779
  275    HD2  PHE  34           2HD      PHE  34 -19.853   3.073   2.310
  276    HE1  PHE  34           1HE      PHE  34 -18.609   4.104   6.957
  277    HE2  PHE  34           2HE      PHE  34 -20.929   4.951   3.481
  278    HZ   PHE  34           HZ       PHE  34 -20.307   5.468   5.808
  279    H    LEU  35           H        LEU  35 -18.155  -0.074   0.527
  280    HA   LEU  35           HA       LEU  35 -20.596   1.111  -0.614
  281   1HB   LEU  35          2HB       LEU  35 -19.327   1.777  -2.511
  282   2HB   LEU  35          1HB       LEU  35 -18.433   2.268  -1.084
  283    HG   LEU  35           HG       LEU  35 -17.541  -0.333  -1.865
  284   1HD1  LEU  35          1HD1      LEU  35 -16.633   0.168  -4.067
  285   2HD1  LEU  35          2HD1      LEU  35 -17.456   1.727  -4.064
  286   3HD1  LEU  35          3HD1      LEU  35 -18.396   0.235  -4.087
  287   1HD2  LEU  35          1HD2      LEU  35 -15.571   1.548  -2.446
  288   2HD2  LEU  35          2HD2      LEU  35 -15.787   0.665  -0.934
  289   3HD2  LEU  35          3HD2      LEU  35 -16.512   2.260  -1.135
  290    H    LYS  36           H        LYS  36 -20.804  -1.499   0.158
  291    HA   LYS  36           HA       LYS  36 -20.100  -3.515  -1.558
  292   1HB   LYS  36          2HB       LYS  36 -21.901  -3.209   0.558
  293   2HB   LYS  36          1HB       LYS  36 -22.871  -3.806  -0.781
  294   1HG   LYS  36          2HG       LYS  36 -22.009  -5.617   0.617
  295   2HG   LYS  36          1HG       LYS  36 -21.404  -5.712  -1.039
  296   1HD   LYS  36          2HD       LYS  36 -19.524  -4.157   0.271
  297   2HD   LYS  36          1HD       LYS  36 -19.953  -5.393   1.456
  298   1HE   LYS  36          2HE       LYS  36 -19.417  -6.219  -1.355
  299   2HE   LYS  36          1HE       LYS  36 -18.052  -5.807  -0.318
  300   1HZ   LYS  36          1HZ       LYS  36 -19.545  -7.433   1.247
  301   2HZ   LYS  36          2HZ       LYS  36 -18.192  -7.914   0.354
  302   3HZ   LYS  36          3HZ       LYS  36 -19.744  -8.129  -0.283
  303    HA   PRO  37           HA       PRO  37 -23.754  -2.450  -4.407
  304   1HB   PRO  37          2HB       PRO  37 -25.211  -0.251  -3.944
  305   2HB   PRO  37          1HB       PRO  37 -25.489  -1.756  -3.061
  306   1HG   PRO  37          2HG       PRO  37 -24.111   0.733  -2.174
  307   2HG   PRO  37          1HG       PRO  37 -25.132  -0.380  -1.251
  308   1HD   PRO  37          2HD       PRO  37 -22.340  -0.340  -1.249
  309   2HD   PRO  37          1HD       PRO  37 -23.360  -1.671  -0.672
  310    H    LYS  38           H        LYS  38 -23.783   0.988  -3.960
  311    HA   LYS  38           HA       LYS  38 -21.455   1.679  -5.367
  312   1HB   LYS  38          2HB       LYS  38 -22.269   2.169  -7.556
  313   2HB   LYS  38          1HB       LYS  38 -22.715   0.506  -7.198
  314   1HG   LYS  38          2HG       LYS  38 -24.718   2.562  -6.523
  315   2HG   LYS  38          1HG       LYS  38 -24.402   2.304  -8.240
  316   1HD   LYS  38          2HD       LYS  38 -24.802  -0.115  -7.909
  317   2HD   LYS  38          1HD       LYS  38 -25.211   0.210  -6.224
  318   1HE   LYS  38          2HE       LYS  38 -27.308   0.264  -7.091
  319   2HE   LYS  38          1HE       LYS  38 -26.865   1.946  -7.379
  320   1HZ   LYS  38          1HZ       LYS  38 -27.851   0.477  -9.280
  321   2HZ   LYS  38          2HZ       LYS  38 -26.249  -0.040  -9.446
  322   3HZ   LYS  38          3HZ       LYS  38 -26.629   1.600  -9.608
  323    H    LYS  39           H        LYS  39 -22.676   2.647  -3.110
  324    HA   LYS  39           HA       LYS  39 -23.288   4.578  -2.077
  325   1HB   LYS  39          2HB       LYS  39 -22.152   5.567  -4.666
  326   2HB   LYS  39          1HB       LYS  39 -22.912   6.705  -3.562
  327   1HG   LYS  39          2HG       LYS  39 -20.664   4.857  -2.797
  328   2HG   LYS  39          1HG       LYS  39 -20.448   6.529  -3.319
  329   1HD   LYS  39          2HD       LYS  39 -21.482   7.386  -1.415
  330   2HD   LYS  39          1HD       LYS  39 -22.288   5.859  -1.051
  331   1HE   LYS  39          2HE       LYS  39 -20.592   5.197   0.225
  332   2HE   LYS  39          1HE       LYS  39 -19.435   5.506  -1.068
  333   1HZ   LYS  39          1HZ       LYS  39 -18.680   7.167   0.167
  334   2HZ   LYS  39          2HZ       LYS  39 -19.947   7.021   1.278
  335   3HZ   LYS  39          3HZ       LYS  39 -20.138   7.984  -0.100
  336    H    ARG  40           H        ARG  40 -25.204   3.069  -3.858
  337    HA   ARG  40           HA       ARG  40 -27.408   3.202  -4.406
  338   1HB   ARG  40          2HB       ARG  40 -27.030   5.181  -2.365
  339   2HB   ARG  40          1HB       ARG  40 -28.185   5.784  -3.546
  340   1HG   ARG  40          2HG       ARG  40 -29.781   4.485  -2.731
  341   2HG   ARG  40          1HG       ARG  40 -28.771   3.049  -2.912
  342   1HD   ARG  40          2HD       ARG  40 -29.195   3.105  -0.632
  343   2HD   ARG  40          1HD       ARG  40 -27.612   3.869  -0.760
  344    HE   ARG  40           HE       ARG  40 -29.874   5.677  -0.787
  345   1HH1  ARG  40          1HH1      ARG  40 -27.431   4.072   1.102
  346   2HH1  ARG  40          2HH1      ARG  40 -27.525   5.193   2.420
  347   1HH2  ARG  40          1HH2      ARG  40 -30.006   7.166   0.943
  348   2HH2  ARG  40          2HH2      ARG  40 -28.990   6.951   2.329
  349    H    LYS  41           H        LYS  41 -25.101   4.797  -5.852
  350    HA   LYS  41           HA       LYS  41 -26.288   6.896  -7.275
  351   1HB   LYS  41          2HB       LYS  41 -24.110   5.042  -8.254
  352   2HB   LYS  41          1HB       LYS  41 -24.453   6.661  -8.848
  353   1HG   LYS  41          2HG       LYS  41 -24.058   6.904  -6.077
  354   2HG   LYS  41          1HG       LYS  41 -22.780   5.847  -6.680
  355   1HD   LYS  41          2HD       LYS  41 -23.482   8.575  -7.765
  356   2HD   LYS  41          1HD       LYS  41 -22.095   8.193  -6.741
  357   1HE   LYS  41          2HE       LYS  41 -20.902   7.482  -8.482
  358   2HE   LYS  41          1HE       LYS  41 -22.219   6.456  -9.048
  359   1HZ   LYS  41          1HZ       LYS  41 -22.953   8.026 -10.476
  360   2HZ   LYS  41          2HZ       LYS  41 -21.337   8.521 -10.422
  361   3HZ   LYS  41          3HZ       LYS  41 -22.497   9.324  -9.489
  362    H    ALA  42           H        ALA  42 -26.392   6.703  -9.821
  363    HA   ALA  42           HA       ALA  42 -27.772   4.254 -10.624
  364   1HB   ALA  42          1HB       ALA  42 -29.266   6.400 -11.710
  365   2HB   ALA  42          2HB       ALA  42 -29.121   6.670  -9.973
  366   3HB   ALA  42          3HB       ALA  42 -29.797   5.157 -10.577
  Start of MODEL   11
    1   1H    ALA   1          1HT       ALA   1  31.774  -5.380  -3.449
    2   2H    ALA   1          2HT       ALA   1  32.259  -4.388  -2.136
    3   3H    ALA   1          3HT       ALA   1  31.526  -3.685  -3.519
    4    HA   ALA   1           HA       ALA   1  29.492  -4.245  -2.930
    5   1HB   ALA   1          1HB       ALA   1  30.811  -6.746  -2.161
    6   2HB   ALA   1          2HB       ALA   1  29.254  -6.474  -2.944
    7   3HB   ALA   1          3HB       ALA   1  29.396  -6.334  -1.191
    8    H    LYS   2           H        LYS   2  30.453  -2.216  -1.772
    9    HA   LYS   2           HA       LYS   2  31.034  -2.295   0.972
   10   1HB   LYS   2          2HB       LYS   2  29.729  -0.018  -0.524
   11   2HB   LYS   2          1HB       LYS   2  30.654   0.090   0.968
   12   1HG   LYS   2          2HG       LYS   2  32.472  -1.070  -0.664
   13   2HG   LYS   2          1HG       LYS   2  31.567  -0.086  -1.816
   14   1HD   LYS   2          2HD       LYS   2  32.193   1.889  -0.830
   15   2HD   LYS   2          1HD       LYS   2  32.414   1.151   0.757
   16   1HE   LYS   2          2HE       LYS   2  34.603   1.311   0.285
   17   2HE   LYS   2          1HE       LYS   2  34.321  -0.129  -0.692
   18   1HZ   LYS   2          1HZ       LYS   2  35.503   1.853  -1.762
   19   2HZ   LYS   2          2HZ       LYS   2  33.971   2.568  -1.838
   20   3HZ   LYS   2          3HZ       LYS   2  34.262   1.106  -2.637
   21    H    ILE   3           H        ILE   3  29.413  -0.663   2.344
   22    HA   ILE   3           HA       ILE   3  27.105  -2.341   2.806
   23    HB   ILE   3           HB       ILE   3  27.630   0.202   4.297
   24   1HG1  ILE   3          2HG1      ILE   3  29.779  -0.665   4.473
   25   2HG1  ILE   3          1HG1      ILE   3  28.985  -1.400   5.862
   26   1HG2  ILE   3          1HG2      ILE   3  26.599  -2.482   5.198
   27   2HG2  ILE   3          2HG2      ILE   3  25.580  -1.129   4.705
   28   3HG2  ILE   3          3HG2      ILE   3  26.612  -0.983   6.127
   29   1HD1  ILE   3          1HD1      ILE   3  28.511  -3.269   3.979
   30   2HD1  ILE   3          2HD1      ILE   3  29.905  -3.277   5.059
   31   3HD1  ILE   3          3HD1      ILE   3  30.059  -2.629   3.426
   32    HA   PRO   4           HA       PRO   4  25.298   2.269   1.784
   33   1HB   PRO   4          2HB       PRO   4  26.946   2.193  -0.718
   34   2HB   PRO   4          1HB       PRO   4  26.316   3.590   0.165
   35   1HG   PRO   4          2HG       PRO   4  28.857   2.864   0.442
   36   2HG   PRO   4          1HG       PRO   4  27.918   3.421   1.840
   37   1HD   PRO   4          2HD       PRO   4  28.815   0.683   1.134
   38   2HD   PRO   4          1HD       PRO   4  28.498   1.391   2.730
   39    H    ILE   5           H        ILE   5  26.318   0.449  -1.091
   40    HA   ILE   5           HA       ILE   5  24.166   0.447  -2.635
   41    HB   ILE   5           HB       ILE   5  24.703  -2.277  -2.662
   42   1HG1  ILE   5          2HG1      ILE   5  27.333  -0.863  -2.264
   43   2HG1  ILE   5          1HG1      ILE   5  26.503  -1.657  -0.930
   44   1HG2  ILE   5          1HG2      ILE   5  26.022  -1.755  -4.650
   45   2HG2  ILE   5          2HG2      ILE   5  26.073  -0.058  -4.171
   46   3HG2  ILE   5          3HG2      ILE   5  24.534  -0.809  -4.594
   47   1HD1  ILE   5          1HD1      ILE   5  27.836  -2.833  -3.308
   48   2HD1  ILE   5          2HD1      ILE   5  26.481  -3.694  -2.577
   49   3HD1  ILE   5          3HD1      ILE   5  27.909  -3.315  -1.613
   50    H    LYS   6           H        LYS   6  24.468  -2.216  -0.298
   51    HA   LYS   6           HA       LYS   6  21.823  -3.073  -0.489
   52   1HB   LYS   6          2HB       LYS   6  22.250  -4.121   1.779
   53   2HB   LYS   6          1HB       LYS   6  23.385  -4.547   0.507
   54   1HG   LYS   6          2HG       LYS   6  24.977  -2.906   1.391
   55   2HG   LYS   6          1HG       LYS   6  23.841  -2.522   2.687
   56   1HD   LYS   6          2HD       LYS   6  25.602  -4.102   3.397
   57   2HD   LYS   6          1HD       LYS   6  23.979  -4.784   3.530
   58   1HE   LYS   6          2HE       LYS   6  24.294  -6.225   1.759
   59   2HE   LYS   6          1HE       LYS   6  25.548  -5.223   1.031
   60   1HZ   LYS   6          1HZ       LYS   6  26.262  -6.237   3.623
   61   2HZ   LYS   6          2HZ       LYS   6  27.133  -6.269   2.173
   62   3HZ   LYS   6          3HZ       LYS   6  25.977  -7.462   2.490
   63    H    ALA   7           H        ALA   7  23.238  -0.486   1.361
   64    HA   ALA   7           HA       ALA   7  21.053  -0.119   3.154
   65   1HB   ALA   7          1HB       ALA   7  23.448   1.504   2.404
   66   2HB   ALA   7          2HB       ALA   7  23.018   0.792   3.959
   67   3HB   ALA   7          3HB       ALA   7  22.162   2.219   3.375
   68    H    ILE   8           H        ILE   8  21.880   1.137  -0.024
   69    HA   ILE   8           HA       ILE   8  19.787   3.107  -0.033
   70    HB   ILE   8           HB       ILE   8  21.872   3.330  -1.389
   71   1HG1  ILE   8          2HG1      ILE   8  19.322   3.336  -3.019
   72   2HG1  ILE   8          1HG1      ILE   8  19.784   4.597  -1.880
   73   1HG2  ILE   8          1HG2      ILE   8  20.781   0.868  -2.595
   74   2HG2  ILE   8          2HG2      ILE   8  22.453   1.397  -2.403
   75   3HG2  ILE   8          3HG2      ILE   8  21.467   2.047  -3.713
   76   1HD1  ILE   8          1HD1      ILE   8  21.847   4.023  -3.847
   77   2HD1  ILE   8          2HD1      ILE   8  21.146   5.563  -3.348
   78   3HD1  ILE   8          3HD1      ILE   8  20.330   4.573  -4.558
   79    H    LYS   9           H        LYS   9  20.118  -0.230  -0.924
   80    HA   LYS   9           HA       LYS   9  17.773  -0.348  -2.563
   81   1HB   LYS   9          2HB       LYS   9  19.923  -2.062  -1.954
   82   2HB   LYS   9          1HB       LYS   9  18.475  -2.892  -1.399
   83   1HG   LYS   9          2HG       LYS   9  18.430  -3.634  -3.519
   84   2HG   LYS   9          1HG       LYS   9  17.637  -2.087  -3.819
   85   1HD   LYS   9          2HD       LYS   9  20.622  -2.341  -3.951
   86   2HD   LYS   9          1HD       LYS   9  19.612  -2.782  -5.330
   87   1HE   LYS   9          2HE       LYS   9  18.608  -0.529  -5.274
   88   2HE   LYS   9          1HE       LYS   9  19.695  -0.100  -3.953
   89   1HZ   LYS   9          1HZ       LYS   9  20.410   0.597  -6.242
   90   2HZ   LYS   9          2HZ       LYS   9  20.675  -1.038  -6.586
   91   3HZ   LYS   9          3HZ       LYS   9  21.557  -0.280  -5.359
   92    H    THR  10           H        THR  10  18.489  -0.655   0.824
   93    HA   THR  10           HA       THR  10  16.016  -1.896   1.550
   94    HB   THR  10           HB       THR  10  18.124  -0.446   3.152
   95    HG1  THR  10           1HG      THR  10  17.416  -3.176   3.239
   96   1HG2  THR  10          1HG2      THR  10  16.719  -0.285   4.850
   97   2HG2  THR  10          2HG2      THR  10  16.668  -2.048   4.889
   98   3HG2  THR  10          3HG2      THR  10  15.458  -1.151   3.971
   99    H    VAL  11           H        VAL  11  17.265   1.404   1.542
  100    HA   VAL  11           HA       VAL  11  14.916   2.578   2.644
  101    HB   VAL  11           HB       VAL  11  17.149   3.828   1.038
  102   1HG1  VAL  11          1HG1      VAL  11  15.788   5.590   0.874
  103   2HG1  VAL  11          2HG1      VAL  11  16.029   5.794   2.609
  104   3HG1  VAL  11          3HG1      VAL  11  14.628   4.905   2.012
  105   1HG2  VAL  11          1HG2      VAL  11  16.648   3.579   3.996
  106   2HG2  VAL  11          2HG2      VAL  11  17.838   4.675   3.295
  107   3HG2  VAL  11          3HG2      VAL  11  18.005   2.934   3.072
  108    H    GLY  12           H        GLY  12  16.163   2.121  -0.630
  109   1HA   GLY  12          2HA       GLY  12  14.072   3.513  -1.952
  110   2HA   GLY  12          1HA       GLY  12  15.149   2.330  -2.686
  111    H    LYS  13           H        LYS  13  14.443   0.245  -0.773
  112    HA   LYS  13           HA       LYS  13  12.080  -0.724  -2.118
  113   1HB   LYS  13          2HB       LYS  13  14.036  -1.894  -0.165
  114   2HB   LYS  13          1HB       LYS  13  12.510  -2.708  -0.482
  115   1HG   LYS  13          2HG       LYS  13  14.593  -2.014  -2.544
  116   2HG   LYS  13          1HG       LYS  13  14.315  -3.612  -1.847
  117   1HD   LYS  13          2HD       LYS  13  11.853  -3.165  -2.693
  118   2HD   LYS  13          1HD       LYS  13  12.683  -2.077  -3.808
  119   1HE   LYS  13          2HE       LYS  13  13.872  -3.807  -4.807
  120   2HE   LYS  13          1HE       LYS  13  13.632  -4.892  -3.438
  121   1HZ   LYS  13          1HZ       LYS  13  11.826  -4.263  -5.653
  122   2HZ   LYS  13          2HZ       LYS  13  11.134  -4.603  -4.148
  123   3HZ   LYS  13          3HZ       LYS  13  12.132  -5.746  -4.896
  124    H    ALA  14           H        ALA  14  12.889   0.776   0.888
  125    HA   ALA  14           HA       ALA  14  10.614  -0.089   2.369
  126   1HB   ALA  14          1HB       ALA  14  12.933   1.366   2.915
  127   2HB   ALA  14          2HB       ALA  14  11.659   0.924   4.052
  128   3HB   ALA  14          3HB       ALA  14  11.601   2.480   3.223
  129    H    VAL  15           H        VAL  15  11.397   2.928   0.674
  130    HA   VAL  15           HA       VAL  15   8.899   4.167   1.086
  131    HB   VAL  15           HB       VAL  15   9.627   5.435  -1.095
  132   1HG1  VAL  15          1HG1      VAL  15  11.324   6.720   0.329
  133   2HG1  VAL  15          2HG1      VAL  15  10.932   5.563   1.601
  134   3HG1  VAL  15          3HG1      VAL  15   9.671   6.597   0.931
  135   1HG2  VAL  15          1HG2      VAL  15  11.717   5.115  -1.914
  136   2HG2  VAL  15          2HG2      VAL  15  11.436   3.481  -1.312
  137   3HG2  VAL  15          3HG2      VAL  15  12.373   4.626  -0.352
  138    H    GLY  16           H        GLY  16  10.151   2.037  -1.416
  139   1HA   GLY  16          2HA       GLY  16   8.003   2.299  -3.236
  140   2HA   GLY  16          1HA       GLY  16   9.126   0.948  -3.158
  141    H    LYS  17           H        LYS  17   8.512   0.227  -0.435
  142    HA   LYS  17           HA       LYS  17   6.173  -1.364  -0.948
  143   1HB   LYS  17          2HB       LYS  17   8.315  -1.281   1.078
  144   2HB   LYS  17          1HB       LYS  17   6.753  -1.830   1.671
  145   1HG   LYS  17          2HG       LYS  17   6.724  -3.676   0.247
  146   2HG   LYS  17          1HG       LYS  17   7.975  -3.001  -0.800
  147   1HD   LYS  17          2HD       LYS  17   9.019  -4.709   0.466
  148   2HD   LYS  17          1HD       LYS  17   9.546  -3.179   1.172
  149   1HE   LYS  17          2HE       LYS  17   7.454  -3.556   2.722
  150   2HE   LYS  17          1HE       LYS  17   7.690  -5.241   2.261
  151   1HZ   LYS  17          1HZ       LYS  17   9.361  -3.514   3.912
  152   2HZ   LYS  17          2HZ       LYS  17  10.164  -4.617   2.914
  153   3HZ   LYS  17          3HZ       LYS  17   9.044  -5.170   4.054
  154    H    GLY  18           H        GLY  18   7.050   1.215   1.317
  155   1HA   GLY  18          2HA       GLY  18   4.629   1.329   2.723
  156   2HA   GLY  18          1HA       GLY  18   5.754   2.667   2.536
  157    H    LEU  19           H        LEU  19   5.646   2.954  -0.248
  158    HA   LEU  19           HA       LEU  19   3.334   4.558  -0.525
  159   1HB   LEU  19          2HB       LEU  19   4.973   5.377  -1.870
  160   2HB   LEU  19          1HB       LEU  19   5.635   3.789  -2.209
  161    HG   LEU  19           HG       LEU  19   3.709   3.400  -3.774
  162   1HD1  LEU  19          1HD1      LEU  19   2.295   5.156  -4.433
  163   2HD1  LEU  19          2HD1      LEU  19   3.258   6.363  -3.582
  164   3HD1  LEU  19          3HD1      LEU  19   2.298   5.198  -2.670
  165   1HD2  LEU  19          1HD2      LEU  19   5.450   3.892  -5.100
  166   2HD2  LEU  19          2HD2      LEU  19   5.935   5.274  -4.117
  167   3HD2  LEU  19          3HD2      LEU  19   4.644   5.447  -5.306
  168    H    ARG  20           H        ARG  20   4.266   1.434  -1.897
  169    HA   ARG  20           HA       ARG  20   2.029   1.001  -3.494
  170   1HB   ARG  20          2HB       ARG  20   4.300  -0.402  -2.924
  171   2HB   ARG  20          1HB       ARG  20   3.079  -1.386  -2.131
  172   1HG   ARG  20          2HG       ARG  20   3.382  -0.735  -5.033
  173   2HG   ARG  20          1HG       ARG  20   3.244  -2.310  -4.250
  174   1HD   ARG  20          2HD       ARG  20   1.001  -2.263  -4.292
  175   2HD   ARG  20          1HD       ARG  20   0.932  -0.567  -3.830
  176    HE   ARG  20           HE       ARG  20   0.791   0.007  -6.044
  177   1HH1  ARG  20          1HH1      ARG  20   1.766  -3.325  -5.770
  178   2HH1  ARG  20          2HH1      ARG  20   1.586  -3.651  -7.461
  179   1HH2  ARG  20          1HH2      ARG  20   0.551  -0.414  -8.274
  180   2HH2  ARG  20          2HH2      ARG  20   0.895  -1.998  -8.884
  181    H    ALA  21           H        ALA  21   2.584   0.210  -0.095
  182    HA   ALA  21           HA       ALA  21   0.167  -1.141   0.346
  183   1HB   ALA  21          1HB       ALA  21   2.406  -0.453   1.866
  184   2HB   ALA  21          2HB       ALA  21   1.046  -1.458   2.365
  185   3HB   ALA  21          3HB       ALA  21   1.033   0.274   2.701
  186    H    ILE  22           H        ILE  22   0.947   2.273   0.318
  187    HA   ILE  22           HA       ILE  22  -1.503   3.116   1.531
  188    HB   ILE  22           HB       ILE  22   0.512   4.618  -0.145
  189   1HG1  ILE  22          2HG1      ILE  22   1.304   3.889   2.069
  190   2HG1  ILE  22          1HG1      ILE  22   1.150   5.641   1.987
  191   1HG2  ILE  22          1HG2      ILE  22  -0.664   6.661   0.720
  192   2HG2  ILE  22          2HG2      ILE  22  -1.976   5.600   1.234
  193   3HG2  ILE  22          3HG2      ILE  22  -1.561   5.725  -0.475
  194   1HD1  ILE  22          1HD1      ILE  22   0.355   4.648   4.110
  195   2HD1  ILE  22          2HD1      ILE  22  -0.909   3.817   3.203
  196   3HD1  ILE  22          3HD1      ILE  22  -0.875   5.580   3.256
  197    H    ASN  23           H        ASN  23  -0.541   2.072  -1.571
  198    HA   ASN  23           HA       ASN  23  -2.663   3.366  -3.017
  199   1HB   ASN  23          2HB       ASN  23  -1.331   2.851  -4.725
  200   2HB   ASN  23          1HB       ASN  23  -0.279   1.972  -3.644
  201   1HD2  ASN  23          1HD2      ASN  23  -3.140   1.680  -5.666
  202   2HD2  ASN  23          2HD2      ASN  23  -2.933   0.006  -6.036
  203    H    ILE  24           H        ILE  24  -1.882  -0.033  -2.414
  204    HA   ILE  24           HA       ILE  24  -4.412  -1.027  -3.097
  205    HB   ILE  24           HB       ILE  24  -3.657  -3.079  -2.532
  206   1HG1  ILE  24          2HG1      ILE  24  -3.937  -2.691  -0.101
  207   2HG1  ILE  24          1HG1      ILE  24  -2.549  -3.709  -0.467
  208   1HG2  ILE  24          1HG2      ILE  24  -1.040  -1.646  -2.144
  209   2HG2  ILE  24          2HG2      ILE  24  -1.776  -2.014  -3.705
  210   3HG2  ILE  24          3HG2      ILE  24  -1.271  -3.323  -2.638
  211   1HD1  ILE  24          1HD1      ILE  24  -1.703  -0.993  -0.382
  212   2HD1  ILE  24          2HD1      ILE  24  -1.231  -2.343   0.651
  213   3HD1  ILE  24          3HD1      ILE  24  -2.633  -1.359   1.070
  214    H    ALA  25           H        ALA  25  -3.236   0.671  -0.386
  215    HA   ALA  25           HA       ALA  25  -5.380  -0.116   1.363
  216   1HB   ALA  25          1HB       ALA  25  -4.427   1.581   2.898
  217   2HB   ALA  25          2HB       ALA  25  -3.251   2.000   1.652
  218   3HB   ALA  25          3HB       ALA  25  -3.241   0.388   2.368
  219    H    SER  26           H        SER  26  -4.656   2.332  -0.976
  220    HA   SER  26           HA       SER  26  -6.792   4.093  -0.107
  221   1HB   SER  26          2HB       SER  26  -4.613   4.191  -2.082
  222   2HB   SER  26          1HB       SER  26  -6.110   4.949  -2.625
  223    HG   SER  26           HG       SER  26  -6.068   6.170  -0.658
  224    H    THR  27           H        THR  27  -6.165   1.843  -2.765
  225    HA   THR  27           HA       THR  27  -8.714   2.242  -3.996
  226    HB   THR  27           HB       THR  27  -6.604   0.102  -4.307
  227    HG1  THR  27           1HG      THR  27  -7.426   2.000  -6.218
  228   1HG2  THR  27          1HG2      THR  27  -7.733  -0.740  -6.221
  229   2HG2  THR  27          2HG2      THR  27  -9.000   0.479  -6.080
  230   3HG2  THR  27          3HG2      THR  27  -8.857  -0.790  -4.864
  231    H    ALA  28           H        ALA  28  -7.438   0.248  -1.473
  232    HA   ALA  28           HA       ALA  28  -9.468  -1.736  -1.449
  233   1HB   ALA  28          1HB       ALA  28  -8.640  -1.934   1.020
  234   2HB   ALA  28          2HB       ALA  28  -7.368  -0.840   0.476
  235   3HB   ALA  28          3HB       ALA  28  -7.580  -2.405  -0.308
  236    H    ASN  29           H        ASN  29  -9.222   1.498  -0.183
  237    HA   ASN  29           HA       ASN  29 -11.143   1.447   1.820
  238   1HB   ASN  29          2HB       ASN  29  -9.626   3.399   0.574
  239   2HB   ASN  29          1HB       ASN  29 -11.282   3.863   0.191
  240   1HD2  ASN  29          1HD2      ASN  29  -8.921   3.454   2.680
  241   2HD2  ASN  29          2HD2      ASN  29  -9.813   4.220   3.945
  242    H    ASP  30           H        ASP  30 -11.747   2.718  -1.446
  243    HA   ASP  30           HA       ASP  30 -14.482   2.797  -1.359
  244   1HB   ASP  30          2HB       ASP  30 -13.438   3.742  -3.259
  245   2HB   ASP  30          1HB       ASP  30 -12.612   2.237  -3.653
  246    H    VAL  31           H        VAL  31 -12.442   0.045  -2.222
  247    HA   VAL  31           HA       VAL  31 -14.473  -1.758  -2.909
  248    HB   VAL  31           HB       VAL  31 -11.815  -2.387  -1.615
  249   1HG1  VAL  31          1HG1      VAL  31 -13.983  -4.063  -2.249
  250   2HG1  VAL  31          2HG1      VAL  31 -12.356  -4.532  -1.754
  251   3HG1  VAL  31          3HG1      VAL  31 -12.742  -4.359  -3.466
  252   1HG2  VAL  31          1HG2      VAL  31 -12.507  -2.304  -4.546
  253   2HG2  VAL  31          2HG2      VAL  31 -10.925  -2.613  -3.830
  254   3HG2  VAL  31          3HG2      VAL  31 -11.664  -1.018  -3.684
  255    H    PHE  32           H        PHE  32 -13.053  -0.887   0.177
  256    HA   PHE  32           HA       PHE  32 -14.285  -2.890   1.742
  257   1HB   PHE  32          2HB       PHE  32 -12.344  -1.148   2.255
  258   2HB   PHE  32          1HB       PHE  32 -13.681  -0.217   2.921
  259    HD1  PHE  32           1HD      PHE  32 -12.311  -3.685   3.024
  260    HD2  PHE  32           2HD      PHE  32 -14.180  -0.500   5.141
  261    HE1  PHE  32           1HE      PHE  32 -12.172  -4.992   5.104
  262    HE2  PHE  32           2HE      PHE  32 -14.044  -1.802   7.226
  263    HZ   PHE  32           HZ       PHE  32 -13.038  -4.050   7.209
  264    H    ASN  33           H        ASN  33 -15.452   0.038   0.365
  265    HA   ASN  33           HA       ASN  33 -17.742   0.183   2.157
  266   1HB   ASN  33          2HB       ASN  33 -16.520   1.953   0.118
  267   2HB   ASN  33          1HB       ASN  33 -18.270   2.059   0.291
  268   1HD2  ASN  33          1HD2      ASN  33 -15.685   3.631   1.127
  269   2HD2  ASN  33          2HD2      ASN  33 -16.083   4.155   2.724
  270    H    PHE  34           H        PHE  34 -16.889  -1.082  -0.927
  271    HA   PHE  34           HA       PHE  34 -19.553  -1.191  -1.985
  272   1HB   PHE  34          2HB       PHE  34 -16.870  -2.178  -2.824
  273   2HB   PHE  34          1HB       PHE  34 -18.284  -2.962  -3.519
  274    HD1  PHE  34           1HD      PHE  34 -18.257   0.586  -2.587
  275    HD2  PHE  34           2HD      PHE  34 -17.846  -2.228  -5.754
  276    HE1  PHE  34           1HE      PHE  34 -18.453   2.409  -4.228
  277    HE2  PHE  34           2HE      PHE  34 -18.040  -0.411  -7.400
  278    HZ   PHE  34           HZ       PHE  34 -18.344   1.912  -6.638
  279    H    LEU  35           H        LEU  35 -17.547  -3.253  -0.024
  280    HA   LEU  35           HA       LEU  35 -19.323  -5.529  -0.352
  281   1HB   LEU  35          2HB       LEU  35 -17.628  -6.788   0.407
  282   2HB   LEU  35          1HB       LEU  35 -16.655  -5.365   0.097
  283    HG   LEU  35           HG       LEU  35 -17.900  -5.907   2.785
  284   1HD1  LEU  35          1HD1      LEU  35 -15.557  -6.653   3.400
  285   2HD1  LEU  35          2HD1      LEU  35 -15.268  -6.829   1.669
  286   3HD1  LEU  35          3HD1      LEU  35 -16.524  -7.786   2.456
  287   1HD2  LEU  35          1HD2      LEU  35 -17.269  -3.679   2.710
  288   2HD2  LEU  35          2HD2      LEU  35 -15.859  -4.006   1.703
  289   3HD2  LEU  35          3HD2      LEU  35 -15.851  -4.461   3.407
  290    H    LYS  36           H        LYS  36 -19.387  -2.751   1.432
  291    HA   LYS  36           HA       LYS  36 -20.981  -4.037   3.539
  292   1HB   LYS  36          2HB       LYS  36 -19.074  -3.344   4.691
  293   2HB   LYS  36          1HB       LYS  36 -18.907  -1.882   3.732
  294   1HG   LYS  36          2HG       LYS  36 -21.389  -1.934   5.219
  295   2HG   LYS  36          1HG       LYS  36 -19.971  -2.073   6.261
  296   1HD   LYS  36          2HD       LYS  36 -19.874  -0.045   4.105
  297   2HD   LYS  36          1HD       LYS  36 -20.949   0.280   5.466
  298   1HE   LYS  36          2HE       LYS  36 -18.322  -0.686   6.280
  299   2HE   LYS  36          1HE       LYS  36 -18.251   0.820   5.366
  300   1HZ   LYS  36          1HZ       LYS  36 -18.497   1.482   7.567
  301   2HZ   LYS  36          2HZ       LYS  36 -19.637   0.284   7.919
  302   3HZ   LYS  36          3HZ       LYS  36 -20.068   1.601   6.949
  303    HA   PRO  37           HA       PRO  37 -23.454  -0.708   1.409
  304   1HB   PRO  37          2HB       PRO  37 -25.095  -2.178  -0.090
  305   2HB   PRO  37          1HB       PRO  37 -23.443  -1.841  -0.622
  306   1HG   PRO  37          2HG       PRO  37 -24.577  -4.328   0.581
  307   2HG   PRO  37          1HG       PRO  37 -23.377  -4.152  -0.711
  308   1HD   PRO  37          2HD       PRO  37 -22.814  -4.672   1.974
  309   2HD   PRO  37          1HD       PRO  37 -21.655  -4.073   0.772
  310    H    LYS  38           H        LYS  38 -23.717  -1.888   4.026
  311    HA   LYS  38           HA       LYS  38 -26.136  -3.068   4.616
  312   1HB   LYS  38          2HB       LYS  38 -24.155  -1.476   6.080
  313   2HB   LYS  38          1HB       LYS  38 -25.776  -1.393   6.757
  314   1HG   LYS  38          2HG       LYS  38 -24.185  -3.896   6.241
  315   2HG   LYS  38          1HG       LYS  38 -24.503  -3.156   7.811
  316   1HD   LYS  38          2HD       LYS  38 -26.987  -3.438   7.213
  317   2HD   LYS  38          1HD       LYS  38 -26.417  -4.544   5.962
  318   1HE   LYS  38          2HE       LYS  38 -25.944  -6.158   7.440
  319   2HE   LYS  38          1HE       LYS  38 -25.233  -5.026   8.589
  320   1HZ   LYS  38          1HZ       LYS  38 -27.918  -6.085   8.464
  321   2HZ   LYS  38          2HZ       LYS  38 -27.841  -4.421   8.759
  322   3HZ   LYS  38          3HZ       LYS  38 -27.044  -5.500   9.790
  323    H    LYS  39           H        LYS  39 -25.575   0.142   3.504
  324    HA   LYS  39           HA       LYS  39 -28.436   0.709   3.839
  325   1HB   LYS  39          2HB       LYS  39 -26.213   2.670   4.425
  326   2HB   LYS  39          1HB       LYS  39 -27.931   3.044   4.433
  327   1HG   LYS  39          2HG       LYS  39 -27.457   2.749   6.672
  328   2HG   LYS  39          1HG       LYS  39 -28.098   1.173   6.201
  329   1HD   LYS  39          2HD       LYS  39 -26.238   0.417   7.236
  330   2HD   LYS  39          1HD       LYS  39 -25.484   0.789   5.684
  331   1HE   LYS  39          2HE       LYS  39 -24.051   1.934   7.015
  332   2HE   LYS  39          1HE       LYS  39 -25.278   3.188   6.837
  333   1HZ   LYS  39          1HZ       LYS  39 -25.644   3.139   9.005
  334   2HZ   LYS  39          2HZ       LYS  39 -24.373   2.038   9.187
  335   3HZ   LYS  39          3HZ       LYS  39 -25.955   1.476   8.978
  336    H    ARG  40           H        ARG  40 -26.086   0.214   1.702
  337    HA   ARG  40           HA       ARG  40 -25.636   0.862  -0.443
  338   1HB   ARG  40          2HB       ARG  40 -28.611   1.217  -0.197
  339   2HB   ARG  40          1HB       ARG  40 -27.784   1.549  -1.713
  340   1HG   ARG  40          2HG       ARG  40 -27.544  -1.076  -0.274
  341   2HG   ARG  40          1HG       ARG  40 -28.803  -0.744  -1.466
  342   1HD   ARG  40          2HD       ARG  40 -26.423   0.079  -2.666
  343   2HD   ARG  40          1HD       ARG  40 -26.030  -1.439  -1.860
  344    HE   ARG  40           HE       ARG  40 -28.437  -1.434  -3.484
  345   1HH1  ARG  40          1HH1      ARG  40 -25.040  -2.176  -3.256
  346   2HH1  ARG  40          2HH1      ARG  40 -25.063  -3.288  -4.583
  347   1HH2  ARG  40          1HH2      ARG  40 -28.477  -2.900  -5.229
  348   2HH2  ARG  40          2HH2      ARG  40 -27.016  -3.701  -5.703
  349    H    LYS  41           H        LYS  41 -26.449   2.793  -2.121
  350    HA   LYS  41           HA       LYS  41 -25.032   5.020  -1.508
  351   1HB   LYS  41          2HB       LYS  41 -27.569   4.878  -3.144
  352   2HB   LYS  41          1HB       LYS  41 -26.468   6.248  -3.142
  353   1HG   LYS  41          2HG       LYS  41 -26.042   3.495  -4.227
  354   2HG   LYS  41          1HG       LYS  41 -25.863   5.054  -5.036
  355   1HD   LYS  41          2HD       LYS  41 -24.036   5.332  -3.080
  356   2HD   LYS  41          1HD       LYS  41 -23.976   3.582  -3.305
  357   1HE   LYS  41          2HE       LYS  41 -23.893   5.377  -5.688
  358   2HE   LYS  41          1HE       LYS  41 -22.437   5.158  -4.718
  359   1HZ   LYS  41          1HZ       LYS  41 -23.085   3.570  -6.732
  360   2HZ   LYS  41          2HZ       LYS  41 -23.858   2.736  -5.479
  361   3HZ   LYS  41          3HZ       LYS  41 -22.196   3.036  -5.395
  362    H    ALA  42           H        ALA  42 -28.541   4.675  -0.994
  363    HA   ALA  42           HA       ALA  42 -30.013   5.877   0.273
  364   1HB   ALA  42          1HB       ALA  42 -28.843   6.517   2.589
  365   2HB   ALA  42          2HB       ALA  42 -27.662   5.352   1.991
  366   3HB   ALA  42          3HB       ALA  42 -29.347   4.874   2.194
  Start of MODEL   12
    1   1H    ALA   1          1HT       ALA   1  29.498  10.243   2.215
    2   2H    ALA   1          2HT       ALA   1  29.186  11.134   0.782
    3   3H    ALA   1          3HT       ALA   1  30.802  10.789   1.245
    4    HA   ALA   1           HA       ALA   1  28.822   8.705   0.666
    5   1HB   ALA   1          1HB       ALA   1  30.285  10.461  -1.169
    6   2HB   ALA   1          2HB       ALA   1  28.856   9.465  -1.444
    7   3HB   ALA   1          3HB       ALA   1  30.462   8.739  -1.504
    8    H    LYS   2           H        LYS   2  29.617   7.134   1.949
    9    HA   LYS   2           HA       LYS   2  32.303   6.179   1.385
   10   1HB   LYS   2          2HB       LYS   2  32.635   5.890   3.937
   11   2HB   LYS   2          1HB       LYS   2  32.935   7.465   3.217
   12   1HG   LYS   2          2HG       LYS   2  30.224   7.446   3.929
   13   2HG   LYS   2          1HG       LYS   2  31.099   6.735   5.286
   14   1HD   LYS   2          2HD       LYS   2  31.898   9.324   3.969
   15   2HD   LYS   2          1HD       LYS   2  30.826   9.236   5.368
   16   1HE   LYS   2          2HE       LYS   2  32.623   9.220   6.673
   17   2HE   LYS   2          1HE       LYS   2  33.042   7.645   6.001
   18   1HZ   LYS   2          1HZ       LYS   2  34.120   8.983   4.138
   19   2HZ   LYS   2          2HZ       LYS   2  34.912   8.950   5.631
   20   3HZ   LYS   2          3HZ       LYS   2  34.014  10.310   5.183
   21    H    ILE   3           H        ILE   3  29.282   5.720   3.175
   22    HA   ILE   3           HA       ILE   3  29.154   2.973   2.309
   23    HB   ILE   3           HB       ILE   3  28.697   2.904   5.153
   24   1HG1  ILE   3          2HG1      ILE   3  31.570   3.432   4.390
   25   2HG1  ILE   3          1HG1      ILE   3  30.514   4.690   5.024
   26   1HG2  ILE   3          1HG2      ILE   3  30.385   1.413   3.175
   27   2HG2  ILE   3          2HG2      ILE   3  28.929   0.881   4.017
   28   3HG2  ILE   3          3HG2      ILE   3  30.447   1.049   4.900
   29   1HD1  ILE   3          1HD1      ILE   3  30.462   2.329   6.685
   30   2HD1  ILE   3          2HD1      ILE   3  30.824   4.003   7.107
   31   3HD1  ILE   3          3HD1      ILE   3  32.098   2.956   6.482
   32    HA   PRO   4           HA       PRO   4  25.125   5.184   3.323
   33   1HB   PRO   4          2HB       PRO   4  24.396   6.069   0.900
   34   2HB   PRO   4          1HB       PRO   4  25.502   6.991   1.926
   35   1HG   PRO   4          2HG       PRO   4  26.111   5.227  -0.411
   36   2HG   PRO   4          1HG       PRO   4  26.814   6.796   0.023
   37   1HD   PRO   4          2HD       PRO   4  27.999   4.363   0.543
   38   2HD   PRO   4          1HD       PRO   4  28.330   5.852   1.449
   39    H    ILE   5           H        ILE   5  26.248   2.613   1.532
   40    HA   ILE   5           HA       ILE   5  24.126   1.695   0.029
   41    HB   ILE   5           HB       ILE   5  25.920  -0.030   1.737
   42   1HG1  ILE   5          2HG1      ILE   5  26.609   0.148  -1.073
   43   2HG1  ILE   5          1HG1      ILE   5  26.638   1.737  -0.314
   44   1HG2  ILE   5          1HG2      ILE   5  24.790  -1.742   0.893
   45   2HG2  ILE   5          2HG2      ILE   5  25.275  -1.241  -0.727
   46   3HG2  ILE   5          3HG2      ILE   5  23.767  -0.643  -0.033
   47   1HD1  ILE   5          1HD1      ILE   5  27.983  -0.505   1.086
   48   2HD1  ILE   5          2HD1      ILE   5  28.392   1.210   1.033
   49   3HD1  ILE   5          3HD1      ILE   5  28.752   0.175  -0.348
   50    H    LYS   6           H        LYS   6  24.820   0.559   3.326
   51    HA   LYS   6           HA       LYS   6  22.567  -0.825   3.885
   52   1HB   LYS   6          2HB       LYS   6  23.925   1.107   5.774
   53   2HB   LYS   6          1HB       LYS   6  22.859  -0.208   6.250
   54   1HG   LYS   6          2HG       LYS   6  24.766  -1.345   6.520
   55   2HG   LYS   6          1HG       LYS   6  24.688  -1.545   4.769
   56   1HD   LYS   6          2HD       LYS   6  25.902   0.859   4.925
   57   2HD   LYS   6          1HD       LYS   6  26.490   0.113   6.412
   58   1HE   LYS   6          2HE       LYS   6  26.621  -1.771   4.254
   59   2HE   LYS   6          1HE       LYS   6  27.432  -0.276   3.791
   60   1HZ   LYS   6          1HZ       LYS   6  28.098  -1.062   6.449
   61   2HZ   LYS   6          2HZ       LYS   6  29.118  -0.730   5.141
   62   3HZ   LYS   6          3HZ       LYS   6  28.472  -2.281   5.337
   63    H    ALA   7           H        ALA   7  22.851   2.645   3.617
   64    HA   ALA   7           HA       ALA   7  20.385   3.333   4.820
   65   1HB   ALA   7          1HB       ALA   7  21.275   5.351   4.557
   66   2HB   ALA   7          2HB       ALA   7  20.978   5.236   2.823
   67   3HB   ALA   7          3HB       ALA   7  22.516   4.693   3.492
   68    H    ILE   8           H        ILE   8  21.325   2.642   1.485
   69    HA   ILE   8           HA       ILE   8  18.780   3.170   0.346
   70    HB   ILE   8           HB       ILE   8  20.880   3.097  -0.976
   71   1HG1  ILE   8          2HG1      ILE   8  19.404   1.028  -2.389
   72   2HG1  ILE   8          1HG1      ILE   8  18.327   2.234  -1.694
   73   1HG2  ILE   8          1HG2      ILE   8  22.247   1.376  -0.617
   74   2HG2  ILE   8          2HG2      ILE   8  21.164   0.428  -1.636
   75   3HG2  ILE   8          3HG2      ILE   8  20.965   0.413   0.116
   76   1HD1  ILE   8          1HD1      ILE   8  20.108   3.871  -2.798
   77   2HD1  ILE   8          2HD1      ILE   8  18.721   3.232  -3.679
   78   3HD1  ILE   8          3HD1      ILE   8  20.307   2.484  -3.868
   79    H    LYS   9           H        LYS   9  20.086   0.536   2.114
   80    HA   LYS   9           HA       LYS   9  18.344  -1.497   1.129
   81   1HB   LYS   9          2HB       LYS   9  20.446  -1.269   3.117
   82   2HB   LYS   9          1HB       LYS   9  19.097  -2.222   3.718
   83   1HG   LYS   9          2HG       LYS   9  20.933  -3.504   2.576
   84   2HG   LYS   9          1HG       LYS   9  19.300  -3.797   1.976
   85   1HD   LYS   9          2HD       LYS   9  20.619  -1.607   0.591
   86   2HD   LYS   9          1HD       LYS   9  21.509  -3.126   0.454
   87   1HE   LYS   9          2HE       LYS   9  18.595  -3.313   0.065
   88   2HE   LYS   9          1HE       LYS   9  19.470  -2.409  -1.169
   89   1HZ   LYS   9          1HZ       LYS   9  19.599  -5.250  -0.505
   90   2HZ   LYS   9          2HZ       LYS   9  21.031  -4.510  -1.017
   91   3HZ   LYS   9          3HZ       LYS   9  19.666  -4.488  -2.015
   92    H    THR  10           H        THR  10  18.333   0.620   3.966
   93    HA   THR  10           HA       THR  10  15.928  -0.396   5.067
   94    HB   THR  10           HB       THR  10  17.234   2.311   5.425
   95    HG1  THR  10           1HG      THR  10  17.309   0.143   7.223
   96   1HG2  THR  10          1HG2      THR  10  14.722   1.414   6.366
   97   2HG2  THR  10          2HG2      THR  10  15.574   2.911   6.744
   98   3HG2  THR  10          3HG2      THR  10  15.833   1.475   7.735
   99    H    VAL  11           H        VAL  11  16.661   2.352   2.972
  100    HA   VAL  11           HA       VAL  11  13.999   3.299   2.770
  101    HB   VAL  11           HB       VAL  11  16.267   4.435   2.100
  102   1HG1  VAL  11          1HG1      VAL  11  15.447   3.174  -0.510
  103   2HG1  VAL  11          2HG1      VAL  11  16.920   2.836   0.399
  104   3HG1  VAL  11          3HG1      VAL  11  16.671   4.429  -0.316
  105   1HG2  VAL  11          1HG2      VAL  11  13.525   4.787   1.079
  106   2HG2  VAL  11          2HG2      VAL  11  14.791   5.665   0.219
  107   3HG2  VAL  11          3HG2      VAL  11  14.567   5.912   1.951
  108    H    GLY  12           H        GLY  12  15.959   1.079   0.876
  109   1HA   GLY  12          2HA       GLY  12  14.188   0.640  -1.253
  110   2HA   GLY  12          1HA       GLY  12  15.399  -0.505  -0.691
  111    H    LYS  13           H        LYS  13  14.425  -0.931   1.916
  112    HA   LYS  13           HA       LYS  13  12.545  -2.959   1.474
  113   1HB   LYS  13          2HB       LYS  13  13.365  -1.514   3.995
  114   2HB   LYS  13          1HB       LYS  13  12.254  -2.876   3.996
  115   1HG   LYS  13          2HG       LYS  13  14.890  -3.202   2.661
  116   2HG   LYS  13          1HG       LYS  13  14.825  -3.201   4.425
  117   1HD   LYS  13          2HD       LYS  13  12.741  -4.858   3.306
  118   2HD   LYS  13          1HD       LYS  13  14.330  -5.354   2.720
  119   1HE   LYS  13          2HE       LYS  13  13.759  -4.866   5.632
  120   2HE   LYS  13          1HE       LYS  13  13.503  -6.435   4.870
  121   1HZ   LYS  13          1HZ       LYS  13  15.795  -5.701   6.002
  122   2HZ   LYS  13          2HZ       LYS  13  16.099  -5.221   4.410
  123   3HZ   LYS  13          3HZ       LYS  13  15.699  -6.830   4.744
  124    H    ALA  14           H        ALA  14  12.178   0.367   2.589
  125    HA   ALA  14           HA       ALA  14   9.390   0.228   3.095
  126   1HB   ALA  14          1HB       ALA  14  11.311   2.058   3.631
  127   2HB   ALA  14          2HB       ALA  14   9.580   2.383   3.727
  128   3HB   ALA  14          3HB       ALA  14  10.483   2.836   2.282
  129    H    VAL  15           H        VAL  15  11.324   0.750   0.254
  130    HA   VAL  15           HA       VAL  15   9.299   1.854  -1.402
  131    HB   VAL  15           HB       VAL  15  11.745   0.281  -2.230
  132   1HG1  VAL  15          1HG1      VAL  15   9.674   0.905  -3.818
  133   2HG1  VAL  15          2HG1      VAL  15  11.345   0.853  -4.381
  134   3HG1  VAL  15          3HG1      VAL  15  10.608   2.396  -3.948
  135   1HG2  VAL  15          1HG2      VAL  15  11.772   3.201  -2.482
  136   2HG2  VAL  15          2HG2      VAL  15  13.029   2.097  -1.925
  137   3HG2  VAL  15          3HG2      VAL  15  11.753   2.610  -0.821
  138    H    GLY  16           H        GLY  16  10.395  -1.419  -0.704
  139   1HA   GLY  16          2HA       GLY  16   8.881  -2.752  -2.678
  140   2HA   GLY  16          1HA       GLY  16   9.492  -3.474  -1.195
  141    H    LYS  17           H        LYS  17   8.172  -1.996   0.717
  142    HA   LYS  17           HA       LYS  17   5.623  -3.239   0.727
  143   1HB   LYS  17          2HB       LYS  17   5.448  -2.522   2.901
  144   2HB   LYS  17          1HB       LYS  17   7.190  -2.412   2.696
  145   1HG   LYS  17          2HG       LYS  17   6.724   0.032   2.007
  146   2HG   LYS  17          1HG       LYS  17   5.159  -0.220   2.782
  147   1HD   LYS  17          2HD       LYS  17   6.376  -0.951   4.834
  148   2HD   LYS  17          1HD       LYS  17   7.885  -0.489   4.044
  149   1HE   LYS  17          2HE       LYS  17   7.229   1.327   5.436
  150   2HE   LYS  17          1HE       LYS  17   6.932   1.810   3.767
  151   1HZ   LYS  17          1HZ       LYS  17   5.127   2.300   5.459
  152   2HZ   LYS  17          2HZ       LYS  17   4.799   0.641   5.449
  153   3HZ   LYS  17          3HZ       LYS  17   4.641   1.542   4.026
  154    H    GLY  18           H        GLY  18   6.800  -0.209  -0.410
  155   1HA   GLY  18          2HA       GLY  18   4.413   1.302  -0.301
  156   2HA   GLY  18          1HA       GLY  18   5.768   1.599  -1.381
  157    H    LEU  19           H        LEU  19   5.865  -0.527  -2.997
  158    HA   LEU  19           HA       LEU  19   3.754  -0.085  -4.798
  159   1HB   LEU  19          2HB       LEU  19   4.720  -1.790  -6.153
  160   2HB   LEU  19          1HB       LEU  19   6.033  -0.905  -5.403
  161    HG   LEU  19           HG       LEU  19   5.345  -3.161  -3.763
  162   1HD1  LEU  19          1HD1      LEU  19   5.475  -4.969  -5.143
  163   2HD1  LEU  19          2HD1      LEU  19   6.354  -4.091  -6.395
  164   3HD1  LEU  19          3HD1      LEU  19   4.618  -3.848  -6.202
  165   1HD2  LEU  19          1HD2      LEU  19   7.818  -2.637  -5.398
  166   2HD2  LEU  19          2HD2      LEU  19   7.678  -3.636  -3.951
  167   3HD2  LEU  19          3HD2      LEU  19   7.485  -1.887  -3.837
  168    H    ARG  20           H        ARG  20   4.309  -2.567  -2.369
  169    HA   ARG  20           HA       ARG  20   2.049  -4.146  -3.124
  170   1HB   ARG  20          2HB       ARG  20   4.243  -4.592  -1.545
  171   2HB   ARG  20          1HB       ARG  20   2.985  -4.363  -0.339
  172   1HG   ARG  20          2HG       ARG  20   3.472  -6.740  -1.176
  173   2HG   ARG  20          1HG       ARG  20   1.791  -6.223  -1.042
  174   1HD   ARG  20          2HD       ARG  20   1.461  -6.263  -3.277
  175   2HD   ARG  20          1HD       ARG  20   3.092  -5.699  -3.634
  176    HE   ARG  20           HE       ARG  20   3.809  -7.892  -3.730
  177   1HH1  ARG  20          1HH1      ARG  20   0.557  -7.741  -2.499
  178   2HH1  ARG  20          2HH1      ARG  20   0.282  -9.444  -2.646
  179   1HH2  ARG  20          1HH2      ARG  20   3.459 -10.139  -3.932
  180   2HH2  ARG  20          2HH2      ARG  20   1.931 -10.808  -3.465
  181    H    ALA  21           H        ALA  21   2.584  -1.343  -1.211
  182    HA   ALA  21           HA       ALA  21   0.274  -1.510   0.429
  183   1HB   ALA  21          1HB       ALA  21   2.354   0.451  -0.132
  184   2HB   ALA  21          2HB       ALA  21   1.461   0.149   1.358
  185   3HB   ALA  21          3HB       ALA  21   0.772   1.191   0.114
  186    H    ILE  22           H        ILE  22   0.930  -0.304  -2.795
  187    HA   ILE  22           HA       ILE  22  -1.608   0.953  -3.163
  188    HB   ILE  22           HB       ILE  22   0.196  -0.144  -5.325
  189   1HG1  ILE  22          2HG1      ILE  22   1.584   1.276  -3.985
  190   2HG1  ILE  22          1HG1      ILE  22   1.120   2.200  -5.410
  191   1HG2  ILE  22          1HG2      ILE  22  -1.259   2.330  -5.814
  192   2HG2  ILE  22          2HG2      ILE  22  -2.312   0.953  -5.484
  193   3HG2  ILE  22          3HG2      ILE  22  -1.136   0.870  -6.796
  194   1HD1  ILE  22          1HD1      ILE  22   0.208   3.781  -4.162
  195   2HD1  ILE  22          2HD1      ILE  22   0.891   2.970  -2.753
  196   3HD1  ILE  22          3HD1      ILE  22  -0.757   2.608  -3.268
  197    H    ASN  23           H        ASN  23  -0.248  -2.217  -3.591
  198    HA   ASN  23           HA       ASN  23  -2.317  -3.389  -5.091
  199   1HB   ASN  23          2HB       ASN  23  -0.858  -5.077  -5.075
  200   2HB   ASN  23          1HB       ASN  23   0.129  -4.181  -3.948
  201   1HD2  ASN  23          1HD2      ASN  23   0.463  -5.031  -2.007
  202   2HD2  ASN  23          2HD2      ASN  23  -0.395  -6.373  -1.339
  203    H    ILE  24           H        ILE  24  -1.607  -3.740  -1.651
  204    HA   ILE  24           HA       ILE  24  -3.937  -5.020  -0.897
  205    HB   ILE  24           HB       ILE  24  -3.576  -3.955   1.349
  206   1HG1  ILE  24          2HG1      ILE  24  -1.241  -2.792   1.466
  207   2HG1  ILE  24          1HG1      ILE  24  -1.513  -2.476  -0.245
  208   1HG2  ILE  24          1HG2      ILE  24  -2.084  -5.553   1.821
  209   2HG2  ILE  24          2HG2      ILE  24  -0.891  -4.895   0.701
  210   3HG2  ILE  24          3HG2      ILE  24  -2.178  -5.943   0.103
  211   1HD1  ILE  24          1HD1      ILE  24  -3.656  -1.765   1.677
  212   2HD1  ILE  24          2HD1      ILE  24  -3.200  -0.999   0.160
  213   3HD1  ILE  24          3HD1      ILE  24  -2.216  -0.752   1.598
  214    H    ALA  25           H        ALA  25  -3.296  -1.793  -1.859
  215    HA   ALA  25           HA       ALA  25  -5.696  -0.661  -0.806
  216   1HB   ALA  25          1HB       ALA  25  -5.015   1.360  -1.775
  217   2HB   ALA  25          2HB       ALA  25  -4.053   0.545  -3.008
  218   3HB   ALA  25          3HB       ALA  25  -3.503   0.568  -1.332
  219    H    SER  26           H        SER  26  -4.613  -2.170  -3.756
  220    HA   SER  26           HA       SER  26  -6.840  -1.379  -5.363
  221   1HB   SER  26          2HB       SER  26  -4.485  -3.089  -5.655
  222   2HB   SER  26          1HB       SER  26  -5.908  -3.746  -6.463
  223    HG   SER  26           HG       SER  26  -5.544  -1.054  -6.855
  224    H    THR  27           H        THR  27  -6.121  -4.090  -3.253
  225    HA   THR  27           HA       THR  27  -8.397  -5.644  -3.954
  226    HB   THR  27           HB       THR  27  -7.253  -5.866  -1.220
  227    HG1  THR  27           1HG      THR  27  -5.286  -6.157  -1.850
  228   1HG2  THR  27          1HG2      THR  27  -6.981  -8.273  -2.525
  229   2HG2  THR  27          2HG2      THR  27  -8.477  -7.606  -3.180
  230   3HG2  THR  27          3HG2      THR  27  -8.290  -7.810  -1.438
  231    H    ALA  28           H        ALA  28  -7.692  -3.293  -1.416
  232    HA   ALA  28           HA       ALA  28 -10.040  -3.485   0.060
  233   1HB   ALA  28          1HB       ALA  28  -9.560  -1.267   0.871
  234   2HB   ALA  28          2HB       ALA  28  -8.501  -0.951  -0.503
  235   3HB   ALA  28          3HB       ALA  28  -8.044  -2.152   0.704
  236    H    ASN  29           H        ASN  29  -9.428  -2.113  -3.064
  237    HA   ASN  29           HA       ASN  29 -11.724  -0.459  -3.236
  238   1HB   ASN  29          2HB       ASN  29  -9.541  -1.191  -4.926
  239   2HB   ASN  29          1HB       ASN  29 -11.038  -1.437  -5.821
  240   1HD2  ASN  29          1HD2      ASN  29  -9.559   0.939  -3.641
  241   2HD2  ASN  29          2HD2      ASN  29 -10.085   2.329  -4.523
  242    H    ASP  30           H        ASP  30 -11.039  -3.687  -4.554
  243    HA   ASP  30           HA       ASP  30 -13.572  -4.238  -5.563
  244   1HB   ASP  30          2HB       ASP  30 -11.208  -5.610  -5.436
  245   2HB   ASP  30          1HB       ASP  30 -12.207  -6.536  -4.319
  246    H    VAL  31           H        VAL  31 -12.270  -4.496  -2.320
  247    HA   VAL  31           HA       VAL  31 -14.278  -5.956  -1.067
  248    HB   VAL  31           HB       VAL  31 -12.694  -3.644   0.069
  249   1HG1  VAL  31          1HG1      VAL  31 -13.131  -5.047   2.220
  250   2HG1  VAL  31          2HG1      VAL  31 -14.510  -5.663   1.309
  251   3HG1  VAL  31          3HG1      VAL  31 -14.365  -3.935   1.629
  252   1HG2  VAL  31          1HG2      VAL  31 -12.058  -6.475  -0.462
  253   2HG2  VAL  31          2HG2      VAL  31 -11.553  -5.845   1.106
  254   3HG2  VAL  31          3HG2      VAL  31 -10.999  -5.068  -0.377
  255    H    PHE  32           H        PHE  32 -14.033  -2.491  -1.707
  256    HA   PHE  32           HA       PHE  32 -16.368  -1.661  -0.415
  257   1HB   PHE  32          2HB       PHE  32 -14.395  -0.471  -2.014
  258   2HB   PHE  32          1HB       PHE  32 -15.910  -0.178  -2.862
  259    HD1  PHE  32           1HD      PHE  32 -16.827   1.865  -2.427
  260    HD2  PHE  32           2HD      PHE  32 -14.783  -0.171   0.700
  261    HE1  PHE  32           1HE      PHE  32 -17.324   3.726  -0.896
  262    HE2  PHE  32           2HE      PHE  32 -15.277   1.685   2.237
  263    HZ   PHE  32           HZ       PHE  32 -16.550   3.637   1.440
  264    H    ASN  33           H        ASN  33 -15.815  -2.958  -3.633
  265    HA   ASN  33           HA       ASN  33 -18.477  -2.561  -4.569
  266   1HB   ASN  33          2HB       ASN  33 -16.020  -3.858  -5.547
  267   2HB   ASN  33          1HB       ASN  33 -17.514  -4.595  -6.117
  268   1HD2  ASN  33          1HD2      ASN  33 -15.342  -2.013  -6.438
  269   2HD2  ASN  33          2HD2      ASN  33 -16.218  -1.107  -7.621
  270    H    PHE  34           H        PHE  34 -17.012  -4.827  -2.485
  271    HA   PHE  34           HA       PHE  34 -18.935  -6.939  -2.952
  272   1HB   PHE  34          2HB       PHE  34 -16.641  -6.561  -1.045
  273   2HB   PHE  34          1HB       PHE  34 -17.795  -7.869  -0.812
  274    HD1  PHE  34           1HD      PHE  34 -16.136  -9.590  -1.112
  275    HD2  PHE  34           2HD      PHE  34 -16.868  -6.703  -4.152
  276    HE1  PHE  34           1HE      PHE  34 -14.890 -10.973  -2.719
  277    HE2  PHE  34           2HE      PHE  34 -15.623  -8.081  -5.766
  278    HZ   PHE  34           HZ       PHE  34 -14.633 -10.220  -5.050
  279    H    LEU  35           H        LEU  35 -18.577  -4.180  -0.909
  280    HA   LEU  35           HA       LEU  35 -20.818  -5.056   0.775
  281   1HB   LEU  35          2HB       LEU  35 -18.816  -4.351   1.980
  282   2HB   LEU  35          1HB       LEU  35 -18.849  -2.803   1.157
  283    HG   LEU  35           HG       LEU  35 -21.050  -2.337   2.246
  284   1HD1  LEU  35          1HD1      LEU  35 -22.125  -4.101   3.082
  285   2HD1  LEU  35          2HD1      LEU  35 -21.028  -3.971   4.456
  286   3HD1  LEU  35          3HD1      LEU  35 -20.659  -5.079   3.135
  287   1HD2  LEU  35          1HD2      LEU  35 -19.571  -1.178   3.461
  288   2HD2  LEU  35          2HD2      LEU  35 -18.436  -2.525   3.545
  289   3HD2  LEU  35          3HD2      LEU  35 -19.796  -2.445   4.666
  290    H    LYS  36           H        LYS  36 -19.640  -2.202  -0.968
  291    HA   LYS  36           HA       LYS  36 -20.792  -0.268  -1.545
  292   1HB   LYS  36          2HB       LYS  36 -22.332  -0.780  -3.425
  293   2HB   LYS  36          1HB       LYS  36 -20.788  -1.613  -3.543
  294   1HG   LYS  36          2HG       LYS  36 -22.193  -3.502  -2.279
  295   2HG   LYS  36          1HG       LYS  36 -23.504  -2.695  -3.137
  296   1HD   LYS  36          2HD       LYS  36 -21.312  -3.012  -4.925
  297   2HD   LYS  36          1HD       LYS  36 -21.620  -4.562  -4.140
  298   1HE   LYS  36          2HE       LYS  36 -23.222  -4.839  -5.671
  299   2HE   LYS  36          1HE       LYS  36 -24.147  -3.665  -4.735
  300   1HZ   LYS  36          1HZ       LYS  36 -22.290  -2.486  -6.597
  301   2HZ   LYS  36          2HZ       LYS  36 -23.917  -2.120  -6.312
  302   3HZ   LYS  36          3HZ       LYS  36 -23.505  -3.402  -7.336
  303    HA   PRO  37           HA       PRO  37 -24.157  -0.360   1.558
  304   1HB   PRO  37          2HB       PRO  37 -24.071   2.387   1.865
  305   2HB   PRO  37          1HB       PRO  37 -23.136   1.235   2.821
  306   1HG   PRO  37          2HG       PRO  37 -22.302   2.866   0.464
  307   2HG   PRO  37          1HG       PRO  37 -21.391   2.461   1.931
  308   1HD   PRO  37          2HD       PRO  37 -20.950   1.210  -0.411
  309   2HD   PRO  37          1HD       PRO  37 -20.815   0.363   1.145
  310    H    LYS  38           H        LYS  38 -25.834   1.854   1.618
  311    HA   LYS  38           HA       LYS  38 -27.336   1.429  -0.823
  312   1HB   LYS  38          2HB       LYS  38 -27.908   2.593   1.861
  313   2HB   LYS  38          1HB       LYS  38 -28.929   3.071   0.512
  314   1HG   LYS  38          2HG       LYS  38 -30.086   1.281   1.358
  315   2HG   LYS  38          1HG       LYS  38 -29.115   0.506   0.104
  316   1HD   LYS  38          2HD       LYS  38 -27.538   0.535   2.436
  317   2HD   LYS  38          1HD       LYS  38 -29.152   0.019   2.930
  318   1HE   LYS  38          2HE       LYS  38 -28.021  -1.194   0.471
  319   2HE   LYS  38          1HE       LYS  38 -27.318  -1.683   2.012
  320   1HZ   LYS  38          1HZ       LYS  38 -30.044  -1.758   2.384
  321   2HZ   LYS  38          2HZ       LYS  38 -29.008  -3.083   2.205
  322   3HZ   LYS  38          3HZ       LYS  38 -29.796  -2.440   0.854
  323    H    LYS  39           H        LYS  39 -24.983   2.834  -1.297
  324    HA   LYS  39           HA       LYS  39 -24.112   4.799  -2.099
  325   1HB   LYS  39          2HB       LYS  39 -26.872   5.062  -3.294
  326   2HB   LYS  39          1HB       LYS  39 -25.366   5.702  -3.940
  327   1HG   LYS  39          2HG       LYS  39 -26.238   2.833  -3.783
  328   2HG   LYS  39          1HG       LYS  39 -25.911   3.797  -5.225
  329   1HD   LYS  39          2HD       LYS  39 -23.571   3.853  -4.740
  330   2HD   LYS  39          1HD       LYS  39 -23.828   3.128  -3.152
  331   1HE   LYS  39          2HE       LYS  39 -23.137   1.301  -4.360
  332   2HE   LYS  39          1HE       LYS  39 -24.887   1.183  -4.544
  333   1HZ   LYS  39          1HZ       LYS  39 -24.614   2.412  -6.679
  334   2HZ   LYS  39          2HZ       LYS  39 -23.915   0.872  -6.668
  335   3HZ   LYS  39          3HZ       LYS  39 -22.939   2.244  -6.512
  336    H    ARG  40           H        ARG  40 -24.582   5.378   0.392
  337    HA   ARG  40           HA       ARG  40 -25.422   8.137   0.322
  338   1HB   ARG  40          2HB       ARG  40 -27.103   7.992   2.035
  339   2HB   ARG  40          1HB       ARG  40 -27.540   6.888   0.739
  340   1HG   ARG  40          2HG       ARG  40 -26.142   5.224   2.333
  341   2HG   ARG  40          1HG       ARG  40 -26.807   6.336   3.531
  342   1HD   ARG  40          2HD       ARG  40 -28.608   5.249   1.421
  343   2HD   ARG  40          1HD       ARG  40 -28.140   4.201   2.759
  344    HE   ARG  40           HE       ARG  40 -29.034   6.678   3.762
  345   1HH1  ARG  40          1HH1      ARG  40 -30.219   3.784   2.232
  346   2HH1  ARG  40          2HH1      ARG  40 -31.791   3.890   2.951
  347   1HH2  ARG  40          1HH2      ARG  40 -31.100   6.827   4.722
  348   2HH2  ARG  40          2HH2      ARG  40 -32.292   5.620   4.369
  349    H    LYS  41           H        LYS  41 -23.074   6.335   0.940
  350    HA   LYS  41           HA       LYS  41 -22.437   7.495   3.570
  351   1HB   LYS  41          2HB       LYS  41 -22.349   4.720   2.690
  352   2HB   LYS  41          1HB       LYS  41 -20.798   5.267   3.312
  353   1HG   LYS  41          2HG       LYS  41 -21.694   4.593   5.265
  354   2HG   LYS  41          1HG       LYS  41 -22.385   6.217   5.238
  355   1HD   LYS  41          2HD       LYS  41 -24.451   5.365   4.318
  356   2HD   LYS  41          1HD       LYS  41 -23.763   3.745   4.191
  357   1HE   LYS  41          2HE       LYS  41 -23.985   3.329   6.409
  358   2HE   LYS  41          1HE       LYS  41 -23.687   5.007   6.863
  359   1HZ   LYS  41          1HZ       LYS  41 -25.856   5.336   7.036
  360   2HZ   LYS  41          2HZ       LYS  41 -26.132   3.701   6.702
  361   3HZ   LYS  41          3HZ       LYS  41 -26.115   4.829   5.442
  362    H    ALA  42           H        ALA  42 -21.792   9.119   1.696
  363    HA   ALA  42           HA       ALA  42 -18.949   9.173   1.667
  364   1HB   ALA  42          1HB       ALA  42 -18.501   8.934  -0.661
  365   2HB   ALA  42          2HB       ALA  42 -20.220   8.826  -1.041
  366   3HB   ALA  42          3HB       ALA  42 -19.429   7.522  -0.156
  Start of MODEL   13
    1   1H    ALA   1          1HT       ALA   1  30.445   4.405   1.648
    2   2H    ALA   1          2HT       ALA   1  30.061   4.280  -0.020
    3   3H    ALA   1          3HT       ALA   1  31.184   3.192   0.689
    4    HA   ALA   1           HA       ALA   1  29.486   2.278   2.058
    5   1HB   ALA   1          1HB       ALA   1  27.295   3.574   0.594
    6   2HB   ALA   1          2HB       ALA   1  28.191   4.632   1.684
    7   3HB   ALA   1          3HB       ALA   1  27.436   3.163   2.304
    8    H    LYS   2           H        LYS   2  30.846   1.130   0.219
    9    HA   LYS   2           HA       LYS   2  29.047   0.303  -1.949
   10   1HB   LYS   2          2HB       LYS   2  31.143  -0.750  -2.898
   11   2HB   LYS   2          1HB       LYS   2  31.140   1.007  -2.817
   12   1HG   LYS   2          2HG       LYS   2  33.015   0.969  -1.651
   13   2HG   LYS   2          1HG       LYS   2  32.232   0.010  -0.393
   14   1HD   LYS   2          2HD       LYS   2  33.116  -1.939  -1.141
   15   2HD   LYS   2          1HD       LYS   2  33.051  -1.442  -2.834
   16   1HE   LYS   2          2HE       LYS   2  35.021  -0.122  -2.602
   17   2HE   LYS   2          1HE       LYS   2  35.014  -0.313  -0.849
   18   1HZ   LYS   2          1HZ       LYS   2  35.171  -2.829  -1.487
   19   2HZ   LYS   2          2HZ       LYS   2  36.558  -1.862  -1.443
   20   3HZ   LYS   2          3HZ       LYS   2  35.822  -2.219  -2.924
   21    H    ILE   3           H        ILE   3  30.007  -0.673   1.084
   22    HA   ILE   3           HA       ILE   3  30.076  -3.517   0.550
   23    HB   ILE   3           HB       ILE   3  30.029  -2.041   3.186
   24   1HG1  ILE   3          2HG1      ILE   3  32.485  -3.372   2.728
   25   2HG1  ILE   3          1HG1      ILE   3  32.109  -2.480   1.257
   26   1HG2  ILE   3          1HG2      ILE   3  30.659  -4.934   2.621
   27   2HG2  ILE   3          2HG2      ILE   3  29.157  -4.339   3.331
   28   3HG2  ILE   3          3HG2      ILE   3  30.681  -4.140   4.196
   29   1HD1  ILE   3          1HD1      ILE   3  32.037  -0.423   2.421
   30   2HD1  ILE   3          2HD1      ILE   3  33.495  -1.262   2.951
   31   3HD1  ILE   3          3HD1      ILE   3  32.069  -1.232   3.988
   32    HA   PRO   4           HA       PRO   4  25.796  -3.190   2.670
   33   1HB   PRO   4          2HB       PRO   4  24.728  -0.798   3.179
   34   2HB   PRO   4          1HB       PRO   4  25.962  -1.490   4.240
   35   1HG   PRO   4          2HG       PRO   4  26.236   0.613   2.134
   36   2HG   PRO   4          1HG       PRO   4  26.992   0.524   3.734
   37   1HD   PRO   4          2HD       PRO   4  28.214  -0.198   1.350
   38   2HD   PRO   4          1HD       PRO   4  28.721  -0.741   2.961
   39    H    ILE   5           H        ILE   5  26.699  -2.371  -0.209
   40    HA   ILE   5           HA       ILE   5  24.868  -0.930  -1.591
   41    HB   ILE   5           HB       ILE   5  25.144  -2.896  -3.364
   42   1HG1  ILE   5          2HG1      ILE   5  27.702  -3.311  -1.914
   43   2HG1  ILE   5          1HG1      ILE   5  26.288  -4.152  -1.289
   44   1HG2  ILE   5          1HG2      ILE   5  27.717  -1.601  -3.021
   45   2HG2  ILE   5          2HG2      ILE   5  26.369  -0.477  -2.845
   46   3HG2  ILE   5          3HG2      ILE   5  26.533  -1.435  -4.317
   47   1HD1  ILE   5          1HD1      ILE   5  25.936  -5.076  -3.583
   48   2HD1  ILE   5          2HD1      ILE   5  27.407  -5.619  -2.776
   49   3HD1  ILE   5          3HD1      ILE   5  27.495  -4.382  -4.030
   50    H    LYS   6           H        LYS   6  24.510  -4.418  -1.919
   51    HA   LYS   6           HA       LYS   6  21.938  -4.601  -2.630
   52   1HB   LYS   6          2HB       LYS   6  21.823  -6.801  -1.533
   53   2HB   LYS   6          1HB       LYS   6  23.352  -6.563  -2.367
   54   1HG   LYS   6          2HG       LYS   6  24.533  -6.294  -0.364
   55   2HG   LYS   6          1HG       LYS   6  23.059  -6.031   0.569
   56   1HD   LYS   6          2HD       LYS   6  23.175  -8.604  -0.839
   57   2HD   LYS   6          1HD       LYS   6  24.399  -8.396   0.414
   58   1HE   LYS   6          2HE       LYS   6  22.896  -8.598   2.054
   59   2HE   LYS   6          1HE       LYS   6  21.769  -7.497   1.264
   60   1HZ   LYS   6          1HZ       LYS   6  22.093 -10.397   0.713
   61   2HZ   LYS   6          2HZ       LYS   6  21.096  -9.362  -0.180
   62   3HZ   LYS   6          3HZ       LYS   6  20.769  -9.647   1.454
   63    H    ALA   7           H        ALA   7  23.081  -3.824   0.577
   64    HA   ALA   7           HA       ALA   7  20.668  -4.162   1.985
   65   1HB   ALA   7          1HB       ALA   7  23.233  -3.490   2.659
   66   2HB   ALA   7          2HB       ALA   7  21.850  -3.469   3.754
   67   3HB   ALA   7          3HB       ALA   7  22.359  -1.986   2.947
   68    H    ILE   8           H        ILE   8  22.131  -1.238   0.591
   69    HA   ILE   8           HA       ILE   8  20.067   0.528   1.230
   70    HB   ILE   8           HB       ILE   8  21.000   2.012  -0.420
   71   1HG1  ILE   8          2HG1      ILE   8  23.134   0.409  -1.471
   72   2HG1  ILE   8          1HG1      ILE   8  21.598  -0.385  -1.802
   73   1HG2  ILE   8          1HG2      ILE   8  22.252   1.871   1.602
   74   2HG2  ILE   8          2HG2      ILE   8  23.403   1.946   0.268
   75   3HG2  ILE   8          3HG2      ILE   8  23.069   0.405   1.059
   76   1HD1  ILE   8          1HD1      ILE   8  22.591   2.270  -2.730
   77   2HD1  ILE   8          2HD1      ILE   8  20.860   1.941  -2.652
   78   3HD1  ILE   8          3HD1      ILE   8  21.904   0.939  -3.661
   79    H    LYS   9           H        LYS   9  20.281  -1.910  -1.193
   80    HA   LYS   9           HA       LYS   9  18.293  -0.820  -2.943
   81   1HB   LYS   9          2HB       LYS   9  19.895  -3.294  -2.780
   82   2HB   LYS   9          1HB       LYS   9  18.324  -3.464  -3.551
   83   1HG   LYS   9          2HG       LYS   9  19.109  -2.586  -5.421
   84   2HG   LYS   9          1HG       LYS   9  19.605  -1.125  -4.564
   85   1HD   LYS   9          2HD       LYS   9  21.580  -2.754  -3.797
   86   2HD   LYS   9          1HD       LYS   9  21.187  -3.506  -5.344
   87   1HE   LYS   9          2HE       LYS   9  21.402  -0.569  -5.369
   88   2HE   LYS   9          1HE       LYS   9  22.903  -1.438  -5.053
   89   1HZ   LYS   9          1HZ       LYS   9  21.575  -1.063  -7.504
   90   2HZ   LYS   9          2HZ       LYS   9  21.632  -2.720  -7.170
   91   3HZ   LYS   9          3HZ       LYS   9  23.061  -1.817  -7.213
   92    H    THR  10           H        THR  10  18.341  -3.330  -0.452
   93    HA   THR  10           HA       THR  10  15.626  -4.068  -0.714
   94    HB   THR  10           HB       THR  10  17.671  -4.403   1.464
   95    HG1  THR  10           1HG      THR  10  18.022  -5.998   0.141
   96   1HG2  THR  10          1HG2      THR  10  16.214  -5.709   2.778
   97   2HG2  THR  10          2HG2      THR  10  14.926  -5.607   1.578
   98   3HG2  THR  10          3HG2      THR  10  15.394  -4.173   2.491
   99    H    VAL  11           H        VAL  11  17.201  -1.419   0.836
  100    HA   VAL  11           HA       VAL  11  15.071  -0.787   2.642
  101    HB   VAL  11           HB       VAL  11  17.302   0.987   1.644
  102   1HG1  VAL  11          1HG1      VAL  11  15.482   2.281   2.573
  103   2HG1  VAL  11          2HG1      VAL  11  16.845   2.286   3.692
  104   3HG1  VAL  11          3HG1      VAL  11  15.449   1.256   4.008
  105   1HG2  VAL  11          1HG2      VAL  11  18.696   0.020   3.095
  106   2HG2  VAL  11          2HG2      VAL  11  17.534  -1.305   3.141
  107   3HG2  VAL  11          3HG2      VAL  11  17.473  -0.035   4.364
  108    H    GLY  12           H        GLY  12  16.171   0.481  -0.479
  109   1HA   GLY  12          2HA       GLY  12  14.230   2.488  -0.765
  110   2HA   GLY  12          1HA       GLY  12  15.074   1.697  -2.091
  111    H    LYS  13           H        LYS  13  14.146  -0.952  -1.472
  112    HA   LYS  13           HA       LYS  13  11.590  -0.817  -2.790
  113   1HB   LYS  13          2HB       LYS  13  11.706  -3.300  -2.720
  114   2HB   LYS  13          1HB       LYS  13  13.118  -2.559  -3.458
  115   1HG   LYS  13          2HG       LYS  13  14.157  -4.076  -2.135
  116   2HG   LYS  13          1HG       LYS  13  14.048  -2.741  -0.986
  117   1HD   LYS  13          2HD       LYS  13  13.098  -4.264   0.365
  118   2HD   LYS  13          1HD       LYS  13  11.653  -3.981  -0.609
  119   1HE   LYS  13          2HE       LYS  13  13.461  -5.913  -1.817
  120   2HE   LYS  13          1HE       LYS  13  12.914  -6.407  -0.215
  121   1HZ   LYS  13          1HZ       LYS  13  11.536  -6.826  -2.466
  122   2HZ   LYS  13          2HZ       LYS  13  10.846  -5.369  -1.956
  123   3HZ   LYS  13          3HZ       LYS  13  10.825  -6.716  -0.934
  124    H    ALA  14           H        ALA  14  12.768  -1.254   0.443
  125    HA   ALA  14           HA       ALA  14  10.463  -2.470   1.550
  126   1HB   ALA  14          1HB       ALA  14  11.396  -1.929   3.691
  127   2HB   ALA  14          2HB       ALA  14  12.452  -0.712   2.975
  128   3HB   ALA  14          3HB       ALA  14  12.711  -2.421   2.624
  129    H    VAL  15           H        VAL  15  11.568   0.902   1.495
  130    HA   VAL  15           HA       VAL  15   9.300   1.992   2.754
  131    HB   VAL  15           HB       VAL  15  10.055   4.116   1.454
  132   1HG1  VAL  15          1HG1      VAL  15  12.104   4.268   3.005
  133   2HG1  VAL  15          2HG1      VAL  15  11.596   2.680   3.581
  134   3HG1  VAL  15          3HG1      VAL  15  10.512   4.062   3.734
  135   1HG2  VAL  15          1HG2      VAL  15  12.683   2.788   1.190
  136   2HG2  VAL  15          2HG2      VAL  15  11.965   4.085   0.235
  137   3HG2  VAL  15          3HG2      VAL  15  11.472   2.413  -0.037
  138    H    GLY  16           H        GLY  16  10.075   1.281  -0.598
  139   1HA   GLY  16          2HA       GLY  16   7.915   2.638  -1.800
  140   2HA   GLY  16          1HA       GLY  16   8.793   1.287  -2.502
  141    H    LYS  17           H        LYS  17   8.154  -0.502  -0.267
  142    HA   LYS  17           HA       LYS  17   5.725  -1.558  -1.280
  143   1HB   LYS  17          2HB       LYS  17   7.260  -3.130  -0.425
  144   2HB   LYS  17          1HB       LYS  17   7.464  -2.239   1.077
  145   1HG   LYS  17          2HG       LYS  17   4.726  -3.144   0.576
  146   2HG   LYS  17          1HG       LYS  17   5.908  -4.441   0.767
  147   1HD   LYS  17          2HD       LYS  17   6.641  -3.443   2.888
  148   2HD   LYS  17          1HD       LYS  17   5.434  -2.169   2.697
  149   1HE   LYS  17          2HE       LYS  17   4.152  -3.534   3.942
  150   2HE   LYS  17          1HE       LYS  17   3.890  -4.371   2.412
  151   1HZ   LYS  17          1HZ       LYS  17   4.730  -6.165   3.374
  152   2HZ   LYS  17          2HZ       LYS  17   5.178  -5.303   4.759
  153   3HZ   LYS  17          3HZ       LYS  17   6.235  -5.393   3.441
  154    H    GLY  18           H        GLY  18   6.558   0.038   1.779
  155   1HA   GLY  18          2HA       GLY  18   4.088  -0.093   3.035
  156   2HA   GLY  18          1HA       GLY  18   5.252   1.203   3.270
  157    H    LEU  19           H        LEU  19   5.281   2.389   0.794
  158    HA   LEU  19           HA       LEU  19   2.986   4.021   0.895
  159   1HB   LEU  19          2HB       LEU  19   4.742   5.160  -0.016
  160   2HB   LEU  19          1HB       LEU  19   5.354   3.755  -0.866
  161    HG   LEU  19           HG       LEU  19   3.549   4.015  -2.546
  162   1HD1  LEU  19          1HD1      LEU  19   1.913   5.557  -2.420
  163   2HD1  LEU  19          2HD1      LEU  19   2.955   6.760  -1.660
  164   3HD1  LEU  19          3HD1      LEU  19   2.249   5.466  -0.691
  165   1HD2  LEU  19          1HD2      LEU  19   4.916   5.302  -3.750
  166   2HD2  LEU  19          2HD2      LEU  19   5.896   5.448  -2.291
  167   3HD2  LEU  19          3HD2      LEU  19   4.695   6.682  -2.674
  168    H    ARG  20           H        ARG  20   3.977   1.480  -1.357
  169    HA   ARG  20           HA       ARG  20   1.820   1.622  -3.114
  170   1HB   ARG  20          2HB       ARG  20   3.747   0.316  -3.688
  171   2HB   ARG  20          1HB       ARG  20   3.533  -0.719  -2.282
  172   1HG   ARG  20          2HG       ARG  20   2.841  -1.749  -4.434
  173   2HG   ARG  20          1HG       ARG  20   1.570  -1.700  -3.210
  174   1HD   ARG  20          2HD       ARG  20   0.456  -0.997  -5.112
  175   2HD   ARG  20          1HD       ARG  20   0.901   0.528  -4.346
  176    HE   ARG  20           HE       ARG  20   2.360   0.951  -6.083
  177   1HH1  ARG  20          1HH1      ARG  20   1.180  -2.318  -6.274
  178   2HH1  ARG  20          2HH1      ARG  20   1.804  -2.590  -7.867
  179   1HH2  ARG  20          1HH2      ARG  20   3.190   0.606  -8.182
  180   2HH2  ARG  20          2HH2      ARG  20   2.949  -0.927  -8.951
  181    H    ALA  21           H        ALA  21   2.127   0.050   0.009
  182    HA   ALA  21           HA       ALA  21  -0.221  -1.504  -0.147
  183   1HB   ALA  21          1HB       ALA  21   1.678  -1.739   1.526
  184   2HB   ALA  21          2HB       ALA  21   0.043  -1.909   2.165
  185   3HB   ALA  21          3HB       ALA  21   0.932  -0.405   2.405
  186    H    ILE  22           H        ILE  22   0.399   1.775   0.983
  187    HA   ILE  22           HA       ILE  22  -2.211   2.262   1.980
  188    HB   ILE  22           HB       ILE  22  -0.100   4.176   0.971
  189   1HG1  ILE  22          2HG1      ILE  22  -0.822   4.216   3.805
  190   2HG1  ILE  22          1HG1      ILE  22  -0.179   2.661   3.287
  191   1HG2  ILE  22          1HG2      ILE  22  -1.749   5.675   0.868
  192   2HG2  ILE  22          2HG2      ILE  22  -1.757   5.608   2.630
  193   3HG2  ILE  22          3HG2      ILE  22  -2.883   4.615   1.703
  194   1HD1  ILE  22          1HD1      ILE  22   1.815   3.569   3.683
  195   2HD1  ILE  22          2HD1      ILE  22   1.168   5.210   3.686
  196   3HD1  ILE  22          3HD1      ILE  22   1.578   4.427   2.160
  197    H    ASN  23           H        ASN  23  -0.836   2.063  -1.137
  198    HA   ASN  23           HA       ASN  23  -2.601   3.722  -2.576
  199   1HB   ASN  23          2HB       ASN  23  -1.147   3.205  -4.181
  200   2HB   ASN  23          1HB       ASN  23  -0.402   2.036  -3.122
  201   1HD2  ASN  23          1HD2      ASN  23  -0.709  -0.109  -3.493
  202   2HD2  ASN  23          2HD2      ASN  23  -1.578  -0.733  -4.850
  203    H    ILE  24           H        ILE  24  -2.492   0.181  -2.427
  204    HA   ILE  24           HA       ILE  24  -4.941  -0.278  -3.647
  205    HB   ILE  24           HB       ILE  24  -4.876  -2.480  -2.832
  206   1HG1  ILE  24          2HG1      ILE  24  -4.257  -1.418  -0.375
  207   2HG1  ILE  24          1HG1      ILE  24  -4.271  -3.131  -0.758
  208   1HG2  ILE  24          1HG2      ILE  24  -1.998  -1.616  -2.934
  209   2HG2  ILE  24          2HG2      ILE  24  -3.032  -1.835  -4.345
  210   3HG2  ILE  24          3HG2      ILE  24  -2.645  -3.212  -3.314
  211   1HD1  ILE  24          1HD1      ILE  24  -1.798  -1.508  -1.150
  212   2HD1  ILE  24          2HD1      ILE  24  -1.968  -3.244  -0.893
  213   3HD1  ILE  24          3HD1      ILE  24  -2.237  -2.124   0.442
  214    H    ALA  25           H        ALA  25  -4.100   0.776  -0.492
  215    HA   ALA  25           HA       ALA  25  -6.666   0.293   0.666
  216   1HB   ALA  25          1HB       ALA  25  -5.827   1.249   2.632
  217   2HB   ALA  25          2HB       ALA  25  -4.635   2.211   1.757
  218   3HB   ALA  25          3HB       ALA  25  -4.425   0.466   1.903
  219    H    SER  26           H        SER  26  -5.082   2.803  -1.120
  220    HA   SER  26           HA       SER  26  -6.862   4.924  -0.437
  221   1HB   SER  26          2HB       SER  26  -4.591   4.529  -2.208
  222   2HB   SER  26          1HB       SER  26  -5.853   5.487  -2.981
  223    HG   SER  26           HG       SER  26  -5.819   6.816  -1.062
  224    H    THR  27           H        THR  27  -6.694   2.610  -3.116
  225    HA   THR  27           HA       THR  27  -8.857   3.597  -4.600
  226    HB   THR  27           HB       THR  27  -8.323   0.658  -4.477
  227    HG1  THR  27           1HG      THR  27  -6.470   0.999  -5.771
  228   1HG2  THR  27          1HG2      THR  27  -8.527   2.464  -6.865
  229   2HG2  THR  27          2HG2      THR  27  -9.917   1.670  -6.124
  230   3HG2  THR  27          3HG2      THR  27  -8.616   0.703  -6.819
  231    H    ALA  28           H        ALA  28  -8.698   1.220  -1.991
  232    HA   ALA  28           HA       ALA  28 -11.355   0.376  -2.002
  233   1HB   ALA  28          1HB       ALA  28  -9.149   0.388  -0.050
  234   2HB   ALA  28          2HB       ALA  28 -10.217  -0.923  -0.551
  235   3HB   ALA  28          3HB       ALA  28 -10.771   0.263   0.631
  236    H    ASN  29           H        ASN  29  -9.970   3.383  -1.053
  237    HA   ASN  29           HA       ASN  29 -12.049   4.238   0.695
  238   1HB   ASN  29          2HB       ASN  29 -10.113   5.936  -0.890
  239   2HB   ASN  29          1HB       ASN  29 -11.040   6.444   0.519
  240   1HD2  ASN  29          1HD2      ASN  29 -10.603   3.782   1.779
  241   2HD2  ASN  29          2HD2      ASN  29  -8.988   3.838   2.387
  242    H    ASP  30           H        ASP  30 -11.232   5.241  -2.622
  243    HA   ASP  30           HA       ASP  30 -13.535   6.732  -3.104
  244   1HB   ASP  30          2HB       ASP  30 -11.304   6.258  -4.529
  245   2HB   ASP  30          1HB       ASP  30 -12.412   5.188  -5.382
  246    H    VAL  31           H        VAL  31 -12.897   3.298  -3.491
  247    HA   VAL  31           HA       VAL  31 -15.356   2.634  -4.741
  248    HB   VAL  31           HB       VAL  31 -13.424   0.940  -3.156
  249   1HG1  VAL  31          1HG1      VAL  31 -15.926   0.215  -4.638
  250   2HG1  VAL  31          2HG1      VAL  31 -15.414  -0.265  -3.021
  251   3HG1  VAL  31          3HG1      VAL  31 -14.611  -0.944  -4.437
  252   1HG2  VAL  31          1HG2      VAL  31 -12.340   0.482  -5.098
  253   2HG2  VAL  31          2HG2      VAL  31 -12.937   2.091  -5.504
  254   3HG2  VAL  31          3HG2      VAL  31 -13.792   0.662  -6.082
  255    H    PHE  32           H        PHE  32 -14.209   2.443  -1.401
  256    HA   PHE  32           HA       PHE  32 -16.532   1.381  -0.259
  257   1HB   PHE  32          2HB       PHE  32 -14.500   1.393   1.015
  258   2HB   PHE  32          1HB       PHE  32 -14.376   3.146   0.907
  259    HD1  PHE  32           1HD      PHE  32 -14.259   3.555   3.251
  260    HD2  PHE  32           2HD      PHE  32 -17.514   1.368   1.600
  261    HE1  PHE  32           1HE      PHE  32 -15.477   3.771   5.377
  262    HE2  PHE  32           2HE      PHE  32 -18.739   1.580   3.724
  263    HZ   PHE  32           HZ       PHE  32 -17.720   2.784   5.615
  264    H    ASN  33           H        ASN  33 -15.645   4.667  -1.083
  265    HA   ASN  33           HA       ASN  33 -17.802   5.910   0.309
  266   1HB   ASN  33          2HB       ASN  33 -15.692   6.755  -1.591
  267   2HB   ASN  33          1HB       ASN  33 -17.146   7.748  -1.554
  268   1HD2  ASN  33          1HD2      ASN  33 -14.175   7.188  -0.165
  269   2HD2  ASN  33          2HD2      ASN  33 -14.379   8.104   1.285
  270    H    PHE  34           H        PHE  34 -17.419   4.424  -2.801
  271    HA   PHE  34           HA       PHE  34 -19.711   5.623  -4.021
  272   1HB   PHE  34          2HB       PHE  34 -17.982   3.256  -4.713
  273   2HB   PHE  34          1HB       PHE  34 -19.415   3.658  -5.652
  274    HD1  PHE  34           1HD      PHE  34 -19.206   6.653  -5.520
  275    HD2  PHE  34           2HD      PHE  34 -16.294   3.645  -6.281
  276    HE1  PHE  34           1HE      PHE  34 -17.889   8.265  -6.834
  277    HE2  PHE  34           2HE      PHE  34 -14.972   5.250  -7.595
  278    HZ   PHE  34           HZ       PHE  34 -15.768   7.564  -7.871
  279    H    LEU  35           H        LEU  35 -19.141   2.801  -2.045
  280    HA   LEU  35           HA       LEU  35 -22.033   2.322  -1.990
  281   1HB   LEU  35          2HB       LEU  35 -20.770  -0.188  -1.695
  282   2HB   LEU  35          1HB       LEU  35 -21.872   0.335  -2.955
  283    HG   LEU  35           HG       LEU  35 -18.960   0.993  -3.150
  284   1HD1  LEU  35          1HD1      LEU  35 -20.270  -1.652  -3.565
  285   2HD1  LEU  35          2HD1      LEU  35 -18.688  -1.272  -2.884
  286   3HD1  LEU  35          3HD1      LEU  35 -18.950  -1.156  -4.624
  287   1HD2  LEU  35          1HD2      LEU  35 -19.718   1.932  -5.015
  288   2HD2  LEU  35          2HD2      LEU  35 -21.322   1.238  -4.784
  289   3HD2  LEU  35          3HD2      LEU  35 -20.071   0.312  -5.613
  290    H    LYS  36           H        LYS  36 -21.912   3.439   0.002
  291    HA   LYS  36           HA       LYS  36 -20.787   1.821   2.193
  292   1HB   LYS  36          2HB       LYS  36 -20.683   3.988   3.479
  293   2HB   LYS  36          1HB       LYS  36 -19.557   3.857   2.136
  294   1HG   LYS  36          2HG       LYS  36 -20.886   5.291   0.779
  295   2HG   LYS  36          1HG       LYS  36 -22.207   5.264   1.948
  296   1HD   LYS  36          2HD       LYS  36 -19.815   6.109   3.260
  297   2HD   LYS  36          1HD       LYS  36 -20.040   7.071   1.799
  298   1HE   LYS  36          2HE       LYS  36 -21.137   7.818   4.046
  299   2HE   LYS  36          1HE       LYS  36 -22.028   7.967   2.531
  300   1HZ   LYS  36          1HZ       LYS  36 -23.393   6.215   3.058
  301   2HZ   LYS  36          2HZ       LYS  36 -23.150   6.897   4.587
  302   3HZ   LYS  36          3HZ       LYS  36 -22.289   5.514   4.132
  303    HA   PRO  37           HA       PRO  37 -25.431   2.339   2.666
  304   1HB   PRO  37          2HB       PRO  37 -26.191  -0.210   2.285
  305   2HB   PRO  37          1HB       PRO  37 -25.942   0.900   0.932
  306   1HG   PRO  37          2HG       PRO  37 -24.117  -1.218   2.003
  307   2HG   PRO  37          1HG       PRO  37 -24.499  -0.818   0.319
  308   1HD   PRO  37          2HD       PRO  37 -22.232   0.021   1.595
  309   2HD   PRO  37          1HD       PRO  37 -22.990   0.908   0.258
  310    H    LYS  38           H        LYS  38 -26.823   1.280   4.308
  311    HA   LYS  38           HA       LYS  38 -25.303   0.740   6.694
  312   1HB   LYS  38          2HB       LYS  38 -27.766   1.882   6.171
  313   2HB   LYS  38          1HB       LYS  38 -28.190   0.327   6.874
  314   1HG   LYS  38          2HG       LYS  38 -27.798   1.133   8.893
  315   2HG   LYS  38          1HG       LYS  38 -26.120   1.451   8.449
  316   1HD   LYS  38          2HD       LYS  38 -26.533   3.658   7.940
  317   2HD   LYS  38          1HD       LYS  38 -28.234   3.364   7.576
  318   1HE   LYS  38          2HE       LYS  38 -28.679   3.030   9.963
  319   2HE   LYS  38          1HE       LYS  38 -26.981   3.342  10.320
  320   1HZ   LYS  38          1HZ       LYS  38 -27.359   5.511  10.292
  321   2HZ   LYS  38          2HZ       LYS  38 -29.014   5.198  10.142
  322   3HZ   LYS  38          3HZ       LYS  38 -28.072   5.440   8.759
  323    H    LYS  39           H        LYS  39 -26.521  -1.133   4.190
  324    HA   LYS  39           HA       LYS  39 -26.901  -3.505   5.862
  325   1HB   LYS  39          2HB       LYS  39 -27.523  -4.519   3.561
  326   2HB   LYS  39          1HB       LYS  39 -28.642  -3.396   4.322
  327   1HG   LYS  39          2HG       LYS  39 -28.186  -1.710   2.816
  328   2HG   LYS  39          1HG       LYS  39 -26.612  -2.381   2.383
  329   1HD   LYS  39          2HD       LYS  39 -28.343  -2.628   0.608
  330   2HD   LYS  39          1HD       LYS  39 -27.642  -4.157   1.142
  331   1HE   LYS  39          2HE       LYS  39 -29.809  -3.777   2.827
  332   2HE   LYS  39          1HE       LYS  39 -30.389  -3.229   1.255
  333   1HZ   LYS  39          1HZ       LYS  39 -29.160  -5.872   1.831
  334   2HZ   LYS  39          2HZ       LYS  39 -29.682  -5.348   0.311
  335   3HZ   LYS  39          3HZ       LYS  39 -30.804  -5.579   1.555
  336    H    ARG  40           H        ARG  40 -24.375  -1.976   4.475
  337    HA   ARG  40           HA       ARG  40 -22.231  -2.595   4.023
  338   1HB   ARG  40          2HB       ARG  40 -23.328  -4.974   5.396
  339   2HB   ARG  40          1HB       ARG  40 -21.901  -5.258   4.409
  340   1HG   ARG  40          2HG       ARG  40 -22.189  -3.425   6.768
  341   2HG   ARG  40          1HG       ARG  40 -21.128  -4.823   6.589
  342   1HD   ARG  40          2HD       ARG  40 -20.330  -3.293   4.498
  343   2HD   ARG  40          1HD       ARG  40 -20.787  -2.053   5.665
  344    HE   ARG  40           HE       ARG  40 -18.498  -3.749   5.777
  345   1HH1  ARG  40          1HH1      ARG  40 -20.833  -2.062   7.731
  346   2HH1  ARG  40          2HH1      ARG  40 -19.780  -1.919   9.100
  347   1HH2  ARG  40          1HH2      ARG  40 -17.102  -3.575   7.576
  348   2HH2  ARG  40          2HH2      ARG  40 -17.660  -2.785   9.014
  349    H    LYS  41           H        LYS  41 -20.932  -3.886   2.467
  350    HA   LYS  41           HA       LYS  41 -20.571  -4.784   0.406
  351   1HB   LYS  41          2HB       LYS  41 -23.390  -5.827   0.380
  352   2HB   LYS  41          1HB       LYS  41 -21.957  -6.517  -0.370
  353   1HG   LYS  41          2HG       LYS  41 -22.677  -6.486   2.548
  354   2HG   LYS  41          1HG       LYS  41 -22.505  -7.883   1.484
  355   1HD   LYS  41          2HD       LYS  41 -20.100  -7.328   1.225
  356   2HD   LYS  41          1HD       LYS  41 -20.310  -6.028   2.401
  357   1HE   LYS  41          2HE       LYS  41 -21.325  -8.002   3.846
  358   2HE   LYS  41          1HE       LYS  41 -20.293  -8.974   2.798
  359   1HZ   LYS  41          1HZ       LYS  41 -19.030  -6.628   3.929
  360   2HZ   LYS  41          2HZ       LYS  41 -18.442  -8.206   3.772
  361   3HZ   LYS  41          3HZ       LYS  41 -19.467  -7.811   5.058
  362    H    ALA  42           H        ALA  42 -21.870  -4.955  -1.889
  363    HA   ALA  42           HA       ALA  42 -22.091  -2.373  -2.834
  364   1HB   ALA  42          1HB       ALA  42 -23.795  -4.061  -4.391
  365   2HB   ALA  42          2HB       ALA  42 -22.364  -4.966  -3.898
  366   3HB   ALA  42          3HB       ALA  42 -22.187  -3.445  -4.774
  Start of MODEL   14
    1   1H    ALA   1          1HT       ALA   1 -32.709   3.044  -2.732
    2   2H    ALA   1          2HT       ALA   1 -34.099   2.628  -3.648
    3   3H    ALA   1          3HT       ALA   1 -32.599   2.897  -4.436
    4    HA   ALA   1           HA       ALA   1 -33.650   0.542  -3.451
    5   1HB   ALA   1          1HB       ALA   1 -31.111  -0.037  -4.225
    6   2HB   ALA   1          2HB       ALA   1 -31.382   1.502  -5.041
    7   3HB   ALA   1          3HB       ALA   1 -32.478   0.149  -5.323
    8    H    LYS   2           H        LYS   2 -31.876  -1.099  -2.548
    9    HA   LYS   2           HA       LYS   2 -30.784   0.086  -0.082
   10   1HB   LYS   2          2HB       LYS   2 -31.367  -2.706   0.255
   11   2HB   LYS   2          1HB       LYS   2 -31.971  -1.333   1.171
   12   1HG   LYS   2          2HG       LYS   2 -33.940  -2.155   0.404
   13   2HG   LYS   2          1HG       LYS   2 -33.546  -1.085  -0.943
   14   1HD   LYS   2          2HD       LYS   2 -32.951  -2.831  -2.330
   15   2HD   LYS   2          1HD       LYS   2 -32.583  -3.911  -0.983
   16   1HE   LYS   2          2HE       LYS   2 -35.243  -3.440  -0.611
   17   2HE   LYS   2          1HE       LYS   2 -35.118  -3.414  -2.370
   18   1HZ   LYS   2          1HZ       LYS   2 -35.389  -5.639  -0.900
   19   2HZ   LYS   2          2HZ       LYS   2 -33.710  -5.590  -1.091
   20   3HZ   LYS   2          3HZ       LYS   2 -34.715  -5.601  -2.451
   21    H    ILE   3           H        ILE   3 -29.920  -1.170  -2.929
   22    HA   ILE   3           HA       ILE   3 -27.854  -2.989  -2.009
   23    HB   ILE   3           HB       ILE   3 -27.862  -2.053  -4.819
   24   1HG1  ILE   3          2HG1      ILE   3 -30.236  -2.151  -4.506
   25   2HG1  ILE   3          1HG1      ILE   3 -29.759  -3.625  -5.344
   26   1HG2  ILE   3          1HG2      ILE   3 -27.196  -4.231  -5.291
   27   2HG2  ILE   3          2HG2      ILE   3 -27.915  -4.874  -3.815
   28   3HG2  ILE   3          3HG2      ILE   3 -26.446  -3.902  -3.729
   29   1HD1  ILE   3          1HD1      ILE   3 -29.660  -4.575  -2.890
   30   2HD1  ILE   3          2HD1      ILE   3 -31.175  -4.485  -3.789
   31   3HD1  ILE   3          3HD1      ILE   3 -30.788  -3.253  -2.588
   32    HA   PRO   4           HA       PRO   4 -25.400   0.855  -4.033
   33   1HB   PRO   4          2HB       PRO   4 -27.248   2.856  -2.811
   34   2HB   PRO   4          1HB       PRO   4 -26.332   2.944  -4.321
   35   1HG   PRO   4          2HG       PRO   4 -28.947   2.455  -4.353
   36   2HG   PRO   4          1HG       PRO   4 -27.853   1.625  -5.475
   37   1HD   PRO   4          2HD       PRO   4 -29.190   0.594  -3.018
   38   2HD   PRO   4          1HD       PRO   4 -28.797  -0.248  -4.531
   39    H    ILE   5           H        ILE   5 -27.053   0.614  -0.956
   40    HA   ILE   5           HA       ILE   5 -25.393   2.209   0.617
   41    HB   ILE   5           HB       ILE   5 -27.564   1.104   1.324
   42   1HG1  ILE   5          2HG1      ILE   5 -25.948   2.321   2.838
   43   2HG1  ILE   5          1HG1      ILE   5 -26.970   1.131   3.640
   44   1HG2  ILE   5          1HG2      ILE   5 -25.743  -1.211   1.963
   45   2HG2  ILE   5          2HG2      ILE   5 -26.905  -1.183   0.637
   46   3HG2  ILE   5          3HG2      ILE   5 -27.469  -1.093   2.306
   47   1HD1  ILE   5          1HD1      ILE   5 -25.112   0.314   4.526
   48   2HD1  ILE   5          2HD1      ILE   5 -24.094   1.272   3.451
   49   3HD1  ILE   5          3HD1      ILE   5 -24.710  -0.293   2.920
   50    H    LYS   6           H        LYS   6 -25.149  -1.263  -0.087
   51    HA   LYS   6           HA       LYS   6 -22.828  -1.753   1.406
   52   1HB   LYS   6          2HB       LYS   6 -23.626  -3.155  -1.150
   53   2HB   LYS   6          1HB       LYS   6 -22.613  -3.794   0.136
   54   1HG   LYS   6          2HG       LYS   6 -24.375  -4.545   1.249
   55   2HG   LYS   6          1HG       LYS   6 -25.175  -2.973   1.164
   56   1HD   LYS   6          2HD       LYS   6 -26.347  -3.520  -0.727
   57   2HD   LYS   6          1HD       LYS   6 -25.116  -4.651  -1.291
   58   1HE   LYS   6          2HE       LYS   6 -26.715  -5.240   1.170
   59   2HE   LYS   6          1HE       LYS   6 -27.379  -5.569  -0.430
   60   1HZ   LYS   6          1HZ       LYS   6 -24.895  -6.647  -0.548
   61   2HZ   LYS   6          2HZ       LYS   6 -26.323  -7.506  -0.256
   62   3HZ   LYS   6          3HZ       LYS   6 -25.366  -6.990   1.041
   63    H    ALA   7           H        ALA   7 -23.317  -0.386  -1.754
   64    HA   ALA   7           HA       ALA   7 -20.705  -0.660  -2.762
   65   1HB   ALA   7          1HB       ALA   7 -21.791   0.091  -4.545
   66   2HB   ALA   7          2HB       ALA   7 -21.777   1.701  -3.825
   67   3HB   ALA   7          3HB       ALA   7 -23.145   0.622  -3.547
   68    H    ILE   8           H        ILE   8 -22.259   1.952  -0.938
   69    HA   ILE   8           HA       ILE   8 -20.103   3.745  -1.002
   70    HB   ILE   8           HB       ILE   8 -22.568   4.083  -0.173
   71   1HG1  ILE   8          2HG1      ILE   8 -20.690   5.613   1.525
   72   2HG1  ILE   8          1HG1      ILE   8 -20.345   5.618  -0.202
   73   1HG2  ILE   8          1HG2      ILE   8 -21.323   3.880   2.531
   74   2HG2  ILE   8          2HG2      ILE   8 -22.027   2.446   1.788
   75   3HG2  ILE   8          3HG2      ILE   8 -23.025   3.870   2.073
   76   1HD1  ILE   8          1HD1      ILE   8 -22.941   6.445   1.076
   77   2HD1  ILE   8          2HD1      ILE   8 -22.584   6.465  -0.651
   78   3HD1  ILE   8          3HD1      ILE   8 -21.701   7.528   0.446
   79    H    LYS   9           H        LYS   9 -20.886   1.123   1.213
   80    HA   LYS   9           HA       LYS   9 -18.887   1.666   3.128
   81   1HB   LYS   9          2HB       LYS   9 -19.916  -1.090   2.483
   82   2HB   LYS   9          1HB       LYS   9 -19.364  -0.470   4.033
   83   1HG   LYS   9          2HG       LYS   9 -21.490   1.179   3.323
   84   2HG   LYS   9          1HG       LYS   9 -22.001  -0.449   2.876
   85   1HD   LYS   9          2HD       LYS   9 -20.752  -0.651   5.396
   86   2HD   LYS   9          1HD       LYS   9 -21.835   0.740   5.474
   87   1HE   LYS   9          2HE       LYS   9 -23.658  -0.550   5.451
   88   2HE   LYS   9          1HE       LYS   9 -23.036  -1.545   4.136
   89   1HZ   LYS   9          1HZ       LYS   9 -22.208  -3.067   5.559
   90   2HZ   LYS   9          2HZ       LYS   9 -23.401  -2.459   6.592
   91   3HZ   LYS   9          3HZ       LYS   9 -21.802  -1.929   6.744
   92    H    THR  10           H        THR  10 -18.910  -0.259   0.177
   93    HA   THR  10           HA       THR  10 -16.406  -1.487   0.501
   94    HB   THR  10           HB       THR  10 -18.015  -0.783  -1.948
   95    HG1  THR  10           1HG      THR  10 -18.933  -2.558  -1.355
   96   1HG2  THR  10          1HG2      THR  10 -16.178  -2.810  -2.588
   97   2HG2  THR  10          2HG2      THR  10 -15.250  -1.474  -1.907
   98   3HG2  THR  10          3HG2      THR  10 -16.311  -1.196  -3.288
   99    H    VAL  11           H        VAL  11 -17.348   1.599  -0.931
  100    HA   VAL  11           HA       VAL  11 -14.883   2.339  -2.007
  101    HB   VAL  11           HB       VAL  11 -16.881   4.230  -0.768
  102   1HG1  VAL  11          1HG1      VAL  11 -14.481   4.537  -2.445
  103   2HG1  VAL  11          2HG1      VAL  11 -15.237   5.669  -1.324
  104   3HG1  VAL  11          3HG1      VAL  11 -15.885   5.475  -2.953
  105   1HG2  VAL  11          1HG2      VAL  11 -17.172   2.443  -2.989
  106   2HG2  VAL  11          2HG2      VAL  11 -17.226   4.113  -3.552
  107   3HG2  VAL  11          3HG2      VAL  11 -18.343   3.567  -2.302
  108    H    GLY  12           H        GLY  12 -16.236   2.986   1.215
  109   1HA   GLY  12          2HA       GLY  12 -14.118   4.478   2.246
  110   2HA   GLY  12          1HA       GLY  12 -15.184   3.461   3.210
  111    H    LYS  13           H        LYS  13 -14.531   0.999   1.951
  112    HA   LYS  13           HA       LYS  13 -12.189   0.324   3.432
  113   1HB   LYS  13          2HB       LYS  13 -13.985  -1.197   1.556
  114   2HB   LYS  13          1HB       LYS  13 -12.511  -1.916   2.189
  115   1HG   LYS  13          2HG       LYS  13 -14.611  -0.750   3.985
  116   2HG   LYS  13          1HG       LYS  13 -14.673  -2.420   3.418
  117   1HD   LYS  13          2HD       LYS  13 -12.198  -1.348   4.716
  118   2HD   LYS  13          1HD       LYS  13 -13.558  -1.894   5.699
  119   1HE   LYS  13          2HE       LYS  13 -12.096  -3.745   5.482
  120   2HE   LYS  13          1HE       LYS  13 -13.466  -4.059   4.417
  121   1HZ   LYS  13          1HZ       LYS  13 -11.167  -2.694   3.253
  122   2HZ   LYS  13          2HZ       LYS  13 -12.199  -3.847   2.571
  123   3HZ   LYS  13          3HZ       LYS  13 -10.972  -4.332   3.628
  124    H    ALA  14           H        ALA  14 -12.915   1.009   0.071
  125    HA   ALA  14           HA       ALA  14 -10.651   0.018  -1.180
  126   1HB   ALA  14          1HB       ALA  14 -12.742   1.250  -2.139
  127   2HB   ALA  14          2HB       ALA  14 -11.200   1.345  -2.989
  128   3HB   ALA  14          3HB       ALA  14 -11.732   2.686  -1.975
  129    H    VAL  15           H        VAL  15 -11.131   3.297   0.104
  130    HA   VAL  15           HA       VAL  15  -8.514   4.206  -0.265
  131    HB   VAL  15           HB       VAL  15 -10.249   5.050   2.050
  132   1HG1  VAL  15          1HG1      VAL  15  -9.196   7.282   1.448
  133   2HG1  VAL  15          2HG1      VAL  15  -8.097   6.367   0.416
  134   3HG1  VAL  15          3HG1      VAL  15  -8.129   6.068   2.154
  135   1HG2  VAL  15          1HG2      VAL  15 -11.727   5.080   0.183
  136   2HG2  VAL  15          2HG2      VAL  15 -10.501   5.805  -0.855
  137   3HG2  VAL  15          3HG2      VAL  15 -11.207   6.742   0.461
  138    H    GLY  16           H        GLY  16 -10.013   2.376   2.330
  139   1HA   GLY  16          2HA       GLY  16  -7.952   2.543   4.229
  140   2HA   GLY  16          1HA       GLY  16  -9.118   1.232   4.108
  141    H    LYS  17           H        LYS  17  -8.455   0.274   1.556
  142    HA   LYS  17           HA       LYS  17  -6.153  -1.298   2.217
  143   1HB   LYS  17          2HB       LYS  17  -7.826  -1.170  -0.299
  144   2HB   LYS  17          1HB       LYS  17  -6.548  -2.344  -0.015
  145   1HG   LYS  17          2HG       LYS  17  -9.026  -2.040   1.671
  146   2HG   LYS  17          1HG       LYS  17  -8.787  -3.254   0.413
  147   1HD   LYS  17          2HD       LYS  17  -7.979  -4.560   2.037
  148   2HD   LYS  17          1HD       LYS  17  -6.544  -3.535   1.987
  149   1HE   LYS  17          2HE       LYS  17  -8.311  -2.119   3.574
  150   2HE   LYS  17          1HE       LYS  17  -8.581  -3.797   4.045
  151   1HZ   LYS  17          1HZ       LYS  17  -6.677  -2.296   5.096
  152   2HZ   LYS  17          2HZ       LYS  17  -5.808  -2.944   3.798
  153   3HZ   LYS  17          3HZ       LYS  17  -6.527  -3.973   4.930
  154    H    GLY  18           H        GLY  18  -6.774   1.555   0.363
  155   1HA   GLY  18          2HA       GLY  18  -4.584   1.530  -1.387
  156   2HA   GLY  18          1HA       GLY  18  -5.381   2.976  -0.784
  157    H    LEU  19           H        LEU  19  -4.857   3.053   1.829
  158    HA   LEU  19           HA       LEU  19  -2.168   3.889   1.946
  159   1HB   LEU  19          2HB       LEU  19  -2.563   4.162   4.361
  160   2HB   LEU  19          1HB       LEU  19  -3.827   4.884   3.383
  161    HG   LEU  19           HG       LEU  19  -4.884   2.419   3.844
  162   1HD1  LEU  19          1HD1      LEU  19  -4.358   2.712   6.573
  163   2HD1  LEU  19          2HD1      LEU  19  -2.786   2.786   5.777
  164   3HD1  LEU  19          3HD1      LEU  19  -3.842   1.398   5.517
  165   1HD2  LEU  19          1HD2      LEU  19  -6.023   4.564   4.087
  166   2HD2  LEU  19          2HD2      LEU  19  -5.142   4.871   5.584
  167   3HD2  LEU  19          3HD2      LEU  19  -6.297   3.541   5.498
  168    H    ARG  20           H        ARG  20  -3.804   1.058   3.337
  169    HA   ARG  20           HA       ARG  20  -1.663  -0.112   4.612
  170   1HB   ARG  20          2HB       ARG  20  -3.785  -1.113   4.899
  171   2HB   ARG  20          1HB       ARG  20  -4.035  -1.298   3.178
  172   1HG   ARG  20          2HG       ARG  20  -2.004  -2.827   4.796
  173   2HG   ARG  20          1HG       ARG  20  -3.602  -3.422   4.363
  174   1HD   ARG  20          2HD       ARG  20  -1.204  -2.987   2.635
  175   2HD   ARG  20          1HD       ARG  20  -2.275  -4.375   2.736
  176    HE   ARG  20           HE       ARG  20  -3.447  -1.942   1.667
  177   1HH1  ARG  20          1HH1      ARG  20  -1.941  -5.014   1.011
  178   2HH1  ARG  20          2HH1      ARG  20  -2.544  -5.107  -0.609
  179   1HH2  ARG  20          1HH2      ARG  20  -4.239  -2.054  -0.464
  180   2HH2  ARG  20          2HH2      ARG  20  -3.849  -3.424  -1.448
  181    H    ALA  21           H        ALA  21  -2.617  -0.322   1.213
  182    HA   ALA  21           HA       ALA  21  -0.634  -2.074   0.342
  183   1HB   ALA  21          1HB       ALA  21  -1.004  -0.297  -1.768
  184   2HB   ALA  21          2HB       ALA  21  -2.531  -0.269  -0.887
  185   3HB   ALA  21          3HB       ALA  21  -1.886  -1.798  -1.484
  186    H    ILE  22           H        ILE  22  -0.568   1.342   1.036
  187    HA   ILE  22           HA       ILE  22   2.003   1.826  -0.113
  188    HB   ILE  22           HB       ILE  22   0.241   3.367   1.776
  189   1HG1  ILE  22          2HG1      ILE  22   1.435   4.431  -0.744
  190   2HG1  ILE  22          1HG1      ILE  22   0.144   3.241  -0.869
  191   1HG2  ILE  22          1HG2      ILE  22   2.360   3.849   2.689
  192   2HG2  ILE  22          2HG2      ILE  22   1.980   5.202   1.624
  193   3HG2  ILE  22          3HG2      ILE  22   3.108   3.954   1.096
  194   1HD1  ILE  22          1HD1      ILE  22   0.063   6.041   0.088
  195   2HD1  ILE  22          2HD1      ILE  22  -1.032   4.879   0.839
  196   3HD1  ILE  22          3HD1      ILE  22  -1.087   5.144  -0.904
  197    H    ASN  23           H        ASN  23   0.919   0.166   2.614
  198    HA   ASN  23           HA       ASN  23   3.168   0.737   4.317
  199   1HB   ASN  23          2HB       ASN  23   1.985  -0.326   5.898
  200   2HB   ASN  23          1HB       ASN  23   0.670  -0.239   4.750
  201   1HD2  ASN  23          1HD2      ASN  23  -0.370  -2.059   4.488
  202   2HD2  ASN  23          2HD2      ASN  23   0.276  -3.650   4.675
  203    H    ILE  24           H        ILE  24   2.066  -2.209   2.677
  204    HA   ILE  24           HA       ILE  24   4.450  -3.635   3.085
  205    HB   ILE  24           HB       ILE  24   3.608  -5.292   1.706
  206   1HG1  ILE  24          2HG1      ILE  24   3.383  -3.632  -0.290
  207   2HG1  ILE  24          1HG1      ILE  24   2.353  -5.054  -0.247
  208   1HG2  ILE  24          1HG2      ILE  24   2.071  -4.561   3.602
  209   2HG2  ILE  24          2HG2      ILE  24   1.398  -5.629   2.371
  210   3HG2  ILE  24          3HG2      ILE  24   1.030  -3.905   2.339
  211   1HD1  ILE  24          1HD1      ILE  24   0.467  -3.844   0.191
  212   2HD1  ILE  24          2HD1      ILE  24   1.372  -2.713  -0.815
  213   3HD1  ILE  24          3HD1      ILE  24   1.357  -2.518   0.938
  214    H    ALA  25           H        ALA  25   3.521  -1.169   0.912
  215    HA   ALA  25           HA       ALA  25   5.711  -1.644  -0.908
  216   1HB   ALA  25          1HB       ALA  25   4.414   0.931  -1.197
  217   2HB   ALA  25          2HB       ALA  25   3.252  -0.395  -1.171
  218   3HB   ALA  25          3HB       ALA  25   4.560  -0.393  -2.353
  219    H    SER  26           H        SER  26   4.965   0.204   1.921
  220    HA   SER  26           HA       SER  26   7.087   2.122   1.584
  221   1HB   SER  26          2HB       SER  26   5.064   1.493   3.659
  222   2HB   SER  26          1HB       SER  26   6.562   2.219   4.242
  223    HG   SER  26           HG       SER  26   5.321   3.355   2.010
  224    H    THR  27           H        THR  27   6.652  -0.954   3.215
  225    HA   THR  27           HA       THR  27   9.177  -0.917   4.555
  226    HB   THR  27           HB       THR  27   7.085  -3.004   4.021
  227    HG1  THR  27           1HG      THR  27   8.217  -2.375   6.503
  228   1HG2  THR  27          1HG2      THR  27   9.000  -4.354   3.816
  229   2HG2  THR  27          2HG2      THR  27   8.441  -4.543   5.478
  230   3HG2  THR  27          3HG2      THR  27   9.827  -3.511   5.125
  231    H    ALA  28           H        ALA  28   7.950  -2.117   1.496
  232    HA   ALA  28           HA       ALA  28  10.138  -3.680   0.715
  233   1HB   ALA  28          1HB       ALA  28   9.101  -2.525  -1.615
  234   2HB   ALA  28          2HB       ALA  28   7.744  -2.646  -0.496
  235   3HB   ALA  28          3HB       ALA  28   8.676  -4.085  -0.910
  236    H    ASN  29           H        ASN  29   9.566  -0.212   0.536
  237    HA   ASN  29           HA       ASN  29  11.748   0.385  -1.168
  238   1HB   ASN  29          2HB       ASN  29  11.133   2.569  -0.924
  239   2HB   ASN  29          1HB       ASN  29   9.670   1.838  -0.279
  240   1HD2  ASN  29          1HD2      ASN  29   8.983   2.921   1.409
  241   2HD2  ASN  29          2HD2      ASN  29   9.962   3.588   2.666
  242    H    ASP  30           H        ASP  30  11.389   0.409   2.353
  243    HA   ASP  30           HA       ASP  30  14.044   1.198   2.921
  244   1HB   ASP  30          2HB       ASP  30  11.749   0.738   4.411
  245   2HB   ASP  30          1HB       ASP  30  12.839  -0.541   4.937
  246    H    VAL  31           H        VAL  31  12.490  -1.898   2.385
  247    HA   VAL  31           HA       VAL  31  14.520  -3.609   3.247
  248    HB   VAL  31           HB       VAL  31  12.650  -4.045   0.914
  249   1HG1  VAL  31          1HG1      VAL  31  13.777  -6.197   2.658
  250   2HG1  VAL  31          2HG1      VAL  31  14.712  -5.569   1.301
  251   3HG1  VAL  31          3HG1      VAL  31  13.135  -6.306   1.019
  252   1HG2  VAL  31          1HG2      VAL  31  10.970  -4.278   2.348
  253   2HG2  VAL  31          2HG2      VAL  31  12.027  -3.663   3.618
  254   3HG2  VAL  31          3HG2      VAL  31  11.905  -5.400   3.336
  255    H    PHE  32           H        PHE  32  14.009  -1.989   0.151
  256    HA   PHE  32           HA       PHE  32  16.147  -3.210  -1.221
  257   1HB   PHE  32          2HB       PHE  32  14.161  -1.515  -1.968
  258   2HB   PHE  32          1HB       PHE  32  15.534  -0.412  -1.941
  259    HD1  PHE  32           1HD      PHE  32  16.110  -0.007  -4.140
  260    HD2  PHE  32           2HD      PHE  32  15.321  -4.000  -2.898
  261    HE1  PHE  32           1HE      PHE  32  16.802  -0.828  -6.354
  262    HE2  PHE  32           2HE      PHE  32  16.014  -4.829  -5.108
  263    HZ   PHE  32           HZ       PHE  32  16.756  -3.243  -6.840
  264    H    ASN  33           H        ASN  33  15.930  -0.267   0.724
  265    HA   ASN  33           HA       ASN  33  18.465   0.768   0.279
  266   1HB   ASN  33          2HB       ASN  33  16.498   0.924   2.503
  267   2HB   ASN  33          1HB       ASN  33  18.152   1.402   2.875
  268   1HD2  ASN  33          1HD2      ASN  33  15.537   2.879   2.539
  269   2HD2  ASN  33          2HD2      ASN  33  15.921   4.172   1.461
  270    H    PHE  34           H        PHE  34  17.431  -1.945   2.212
  271    HA   PHE  34           HA       PHE  34  19.916  -2.291   3.592
  272   1HB   PHE  34          2HB       PHE  34  17.847  -3.182   4.535
  273   2HB   PHE  34          1HB       PHE  34  17.623  -4.213   3.125
  274    HD1  PHE  34           1HD      PHE  34  20.076  -3.534   5.843
  275    HD2  PHE  34           2HD      PHE  34  18.363  -6.394   3.198
  276    HE1  PHE  34           1HE      PHE  34  21.355  -5.320   6.952
  277    HE2  PHE  34           2HE      PHE  34  19.637  -8.186   4.304
  278    HZ   PHE  34           HZ       PHE  34  21.136  -7.649   6.183
  279    H    LEU  35           H        LEU  35  18.507  -3.442   0.601
  280    HA   LEU  35           HA       LEU  35  20.723  -5.260   0.101
  281   1HB   LEU  35          2HB       LEU  35  18.765  -6.211  -0.665
  282   2HB   LEU  35          1HB       LEU  35  18.110  -4.681  -1.215
  283    HG   LEU  35           HG       LEU  35  20.477  -5.860  -2.616
  284   1HD1  LEU  35          1HD1      LEU  35  17.875  -7.084  -2.422
  285   2HD1  LEU  35          2HD1      LEU  35  19.334  -7.666  -3.222
  286   3HD1  LEU  35          3HD1      LEU  35  18.224  -6.598  -4.080
  287   1HD2  LEU  35          1HD2      LEU  35  20.154  -4.075  -3.892
  288   2HD2  LEU  35          2HD2      LEU  35  18.726  -3.629  -2.959
  289   3HD2  LEU  35          3HD2      LEU  35  18.572  -4.710  -4.343
  290    H    LYS  36           H        LYS  36  19.736  -2.054  -0.664
  291    HA   LYS  36           HA       LYS  36  20.481  -0.489  -2.151
  292   1HB   LYS  36          2HB       LYS  36  23.049  -0.311  -2.038
  293   2HB   LYS  36          1HB       LYS  36  22.128  -0.113  -0.554
  294   1HG   LYS  36          2HG       LYS  36  23.306  -2.750  -1.356
  295   2HG   LYS  36          1HG       LYS  36  24.218  -1.545  -0.448
  296   1HD   LYS  36          2HD       LYS  36  21.657  -1.866   0.765
  297   2HD   LYS  36          1HD       LYS  36  22.381  -3.459   0.534
  298   1HE   LYS  36          2HE       LYS  36  23.751  -1.117   1.849
  299   2HE   LYS  36          1HE       LYS  36  22.944  -2.424   2.715
  300   1HZ   LYS  36          1HZ       LYS  36  25.357  -2.740   2.543
  301   2HZ   LYS  36          2HZ       LYS  36  25.233  -2.788   0.857
  302   3HZ   LYS  36          3HZ       LYS  36  24.499  -3.990   1.792
  303    HA   PRO  37           HA       PRO  37  20.815  -3.004  -5.919
  304   1HB   PRO  37          2HB       PRO  37  20.346  -0.782  -7.520
  305   2HB   PRO  37          1HB       PRO  37  19.102  -1.871  -6.899
  306   1HG   PRO  37          2HG       PRO  37  19.999   0.779  -5.852
  307   2HG   PRO  37          1HG       PRO  37  18.363   0.103  -5.942
  308   1HD   PRO  37          2HD       PRO  37  19.709   0.170  -3.635
  309   2HD   PRO  37          1HD       PRO  37  18.670  -1.212  -4.045
  310    H    LYS  38           H        LYS  38  21.854   0.357  -6.346
  311    HA   LYS  38           HA       LYS  38  24.281  -0.515  -7.648
  312   1HB   LYS  38          2HB       LYS  38  24.607   1.739  -8.257
  313   2HB   LYS  38          1HB       LYS  38  22.866   1.500  -8.330
  314   1HG   LYS  38          2HG       LYS  38  22.837   2.431  -5.941
  315   2HG   LYS  38          1HG       LYS  38  24.472   2.994  -6.294
  316   1HD   LYS  38          2HD       LYS  38  22.767   3.667  -8.482
  317   2HD   LYS  38          1HD       LYS  38  22.013   4.210  -6.982
  318   1HE   LYS  38          2HE       LYS  38  24.802   4.815  -6.898
  319   2HE   LYS  38          1HE       LYS  38  24.132   5.412  -8.416
  320   1HZ   LYS  38          1HZ       LYS  38  23.141   7.062  -7.346
  321   2HZ   LYS  38          2HZ       LYS  38  23.943   6.596  -5.932
  322   3HZ   LYS  38          3HZ       LYS  38  22.393   6.004  -6.258
  323    H    LYS  39           H        LYS  39  26.166   1.298  -6.914
  324    HA   LYS  39           HA       LYS  39  26.942   0.289  -4.320
  325   1HB   LYS  39          2HB       LYS  39  28.495   2.308  -5.911
  326   2HB   LYS  39          1HB       LYS  39  29.094   1.084  -4.800
  327   1HG   LYS  39          2HG       LYS  39  28.380  -0.656  -6.423
  328   2HG   LYS  39          1HG       LYS  39  27.962   0.635  -7.551
  329   1HD   LYS  39          2HD       LYS  39  30.677   0.703  -6.369
  330   2HD   LYS  39          1HD       LYS  39  30.346  -0.569  -7.546
  331   1HE   LYS  39          2HE       LYS  39  29.813   2.359  -8.024
  332   2HE   LYS  39          1HE       LYS  39  31.288   1.530  -8.522
  333   1HZ   LYS  39          1HZ       LYS  39  28.542   0.816  -9.404
  334   2HZ   LYS  39          2HZ       LYS  39  29.974   0.071  -9.911
  335   3HZ   LYS  39          3HZ       LYS  39  29.670   1.683 -10.321
  336    H    ARG  40           H        ARG  40  24.721   1.834  -3.975
  337    HA   ARG  40           HA       ARG  40  25.314   4.554  -3.383
  338   1HB   ARG  40          2HB       ARG  40  23.014   2.781  -3.224
  339   2HB   ARG  40          1HB       ARG  40  23.111   3.849  -1.830
  340   1HG   ARG  40          2HG       ARG  40  23.493   5.082  -4.492
  341   2HG   ARG  40          1HG       ARG  40  21.870   4.522  -4.083
  342   1HD   ARG  40          2HD       ARG  40  23.147   5.990  -1.915
  343   2HD   ARG  40          1HD       ARG  40  22.977   6.949  -3.385
  344    HE   ARG  40           HE       ARG  40  20.530   5.861  -3.107
  345   1HH1  ARG  40          1HH1      ARG  40  22.606   7.586  -0.906
  346   2HH1  ARG  40          2HH1      ARG  40  21.296   8.266   0.000
  347   1HH2  ARG  40          1HH2      ARG  40  18.798   6.750  -1.922
  348   2HH2  ARG  40          2HH2      ARG  40  19.131   7.792  -0.579
  349    H    LYS  41           H        LYS  41  26.431   5.324  -1.728
  350    HA   LYS  41           HA       LYS  41  27.053   3.591   0.523
  351   1HB   LYS  41          2HB       LYS  41  28.040   6.383  -0.085
  352   2HB   LYS  41          1HB       LYS  41  28.687   5.292   1.134
  353   1HG   LYS  41          2HG       LYS  41  29.349   3.730  -0.648
  354   2HG   LYS  41          1HG       LYS  41  28.752   4.877  -1.849
  355   1HD   LYS  41          2HD       LYS  41  30.439   6.413  -1.402
  356   2HD   LYS  41          1HD       LYS  41  30.779   5.723   0.187
  357   1HE   LYS  41          2HE       LYS  41  32.579   5.106  -1.233
  358   2HE   LYS  41          1HE       LYS  41  31.595   3.663  -0.995
  359   1HZ   LYS  41          1HZ       LYS  41  30.467   4.433  -3.171
  360   2HZ   LYS  41          2HZ       LYS  41  31.965   3.651  -3.252
  361   3HZ   LYS  41          3HZ       LYS  41  31.881   5.334  -3.401
  362    H    ALA  42           H        ALA  42  25.559   3.517   2.077
  363    HA   ALA  42           HA       ALA  42  24.024   5.904   2.749
  364   1HB   ALA  42          1HB       ALA  42  23.625   3.364   4.227
  365   2HB   ALA  42          2HB       ALA  42  23.191   3.391   2.518
  366   3HB   ALA  42          3HB       ALA  42  22.443   4.531   3.637
  Start of MODEL   15
    1   1H    ALA   1          1HT       ALA   1 -28.196   7.512  -5.472
    2   2H    ALA   1          2HT       ALA   1 -28.240   6.498  -6.856
    3   3H    ALA   1          3HT       ALA   1 -26.734   6.992  -6.199
    4    HA   ALA   1           HA       ALA   1 -27.940   4.681  -5.715
    5   1HB   ALA   1          1HB       ALA   1 -26.377   5.496  -3.440
    6   2HB   ALA   1          2HB       ALA   1 -25.643   6.061  -4.941
    7   3HB   ALA   1          3HB       ALA   1 -25.985   4.345  -4.719
    8    H    LYS   2           H        LYS   2 -29.861   4.230  -4.852
    9    HA   LYS   2           HA       LYS   2 -31.451   5.768  -3.256
   10   1HB   LYS   2          2HB       LYS   2 -31.176   2.775  -3.419
   11   2HB   LYS   2          1HB       LYS   2 -32.393   3.538  -2.405
   12   1HG   LYS   2          2HG       LYS   2 -33.728   3.896  -4.140
   13   2HG   LYS   2          1HG       LYS   2 -32.425   4.636  -5.072
   14   1HD   LYS   2          2HD       LYS   2 -31.748   1.986  -5.131
   15   2HD   LYS   2          1HD       LYS   2 -33.510   1.920  -5.181
   16   1HE   LYS   2          2HE       LYS   2 -32.145   3.873  -6.953
   17   2HE   LYS   2          1HE       LYS   2 -32.035   2.165  -7.378
   18   1HZ   LYS   2          1HZ       LYS   2 -34.519   3.748  -7.010
   19   2HZ   LYS   2          2HZ       LYS   2 -34.487   2.075  -7.252
   20   3HZ   LYS   2          3HZ       LYS   2 -33.924   3.114  -8.461
   21    H    ILE   3           H        ILE   3 -30.329   2.882  -1.626
   22    HA   ILE   3           HA       ILE   3 -29.086   4.511   0.467
   23    HB   ILE   3           HB       ILE   3 -30.374   2.485   1.874
   24   1HG1  ILE   3          2HG1      ILE   3 -32.816   3.158   1.253
   25   2HG1  ILE   3          1HG1      ILE   3 -32.123   3.589  -0.306
   26   1HG2  ILE   3          1HG2      ILE   3 -30.291   5.361   1.756
   27   2HG2  ILE   3          2HG2      ILE   3 -30.487   4.298   3.149
   28   3HG2  ILE   3          3HG2      ILE   3 -31.897   4.793   2.212
   29   1HD1  ILE   3          1HD1      ILE   3 -32.629   0.954   0.880
   30   2HD1  ILE   3          2HD1      ILE   3 -31.102   1.117   0.013
   31   3HD1  ILE   3          3HD1      ILE   3 -32.624   1.463  -0.808
   32    HA   PRO   4           HA       PRO   4 -26.994   0.332  -0.291
   33   1HB   PRO   4          2HB       PRO   4 -25.362   0.718  -2.353
   34   2HB   PRO   4          1HB       PRO   4 -27.078   0.378  -2.621
   35   1HG   PRO   4          2HG       PRO   4 -25.631   2.997  -2.707
   36   2HG   PRO   4          1HG       PRO   4 -26.878   2.372  -3.801
   37   1HD   PRO   4          2HD       PRO   4 -27.346   4.131  -1.714
   38   2HD   PRO   4          1HD       PRO   4 -28.568   3.081  -2.456
   39    H    ILE   5           H        ILE   5 -26.389   3.026   1.089
   40    HA   ILE   5           HA       ILE   5 -23.825   3.850   1.009
   41    HB   ILE   5           HB       ILE   5 -25.577   4.632   2.628
   42   1HG1  ILE   5          2HG1      ILE   5 -23.096   5.227   2.683
   43   2HG1  ILE   5          1HG1      ILE   5 -23.995   5.475   4.178
   44   1HG2  ILE   5          1HG2      ILE   5 -25.953   3.544   4.665
   45   2HG2  ILE   5          2HG2      ILE   5 -24.553   2.491   4.463
   46   3HG2  ILE   5          3HG2      ILE   5 -25.987   2.254   3.463
   47   1HD1  ILE   5          1HD1      ILE   5 -22.228   4.422   5.074
   48   2HD1  ILE   5          2HD1      ILE   5 -21.808   3.609   3.567
   49   3HD1  ILE   5          3HD1      ILE   5 -23.105   2.975   4.580
   50    H    LYS   6           H        LYS   6 -24.941   0.914   2.644
   51    HA   LYS   6           HA       LYS   6 -22.406   0.193   3.673
   52   1HB   LYS   6          2HB       LYS   6 -24.860  -1.472   3.099
   53   2HB   LYS   6          1HB       LYS   6 -23.435  -2.082   3.929
   54   1HG   LYS   6          2HG       LYS   6 -25.373   0.012   4.855
   55   2HG   LYS   6          1HG       LYS   6 -24.970  -1.529   5.615
   56   1HD   LYS   6          2HD       LYS   6 -22.583  -0.560   5.788
   57   2HD   LYS   6          1HD       LYS   6 -23.361   0.998   5.499
   58   1HE   LYS   6          2HE       LYS   6 -24.572   0.900   7.483
   59   2HE   LYS   6          1HE       LYS   6 -24.383  -0.847   7.624
   60   1HZ   LYS   6          1HZ       LYS   6 -22.388  -0.639   8.610
   61   2HZ   LYS   6          2HZ       LYS   6 -22.945   0.906   9.012
   62   3HZ   LYS   6          3HZ       LYS   6 -21.925   0.697   7.679
   63    H    ALA   7           H        ALA   7 -23.937  -0.258   0.580
   64    HA   ALA   7           HA       ALA   7 -22.161  -2.312  -0.328
   65   1HB   ALA   7          1HB       ALA   7 -24.372  -2.097  -1.303
   66   2HB   ALA   7          2HB       ALA   7 -23.137  -1.880  -2.543
   67   3HB   ALA   7          3HB       ALA   7 -23.980  -0.478  -1.884
   68    H    ILE   8           H        ILE   8 -22.376   1.193  -0.793
   69    HA   ILE   8           HA       ILE   8 -20.157   1.390  -2.529
   70    HB   ILE   8           HB       ILE   8 -20.193   3.795  -1.969
   71   1HG1  ILE   8          2HG1      ILE   8 -22.328   2.943  -0.010
   72   2HG1  ILE   8          1HG1      ILE   8 -20.782   3.692   0.377
   73   1HG2  ILE   8          1HG2      ILE   8 -21.709   3.847  -3.587
   74   2HG2  ILE   8          2HG2      ILE   8 -22.973   3.674  -2.369
   75   3HG2  ILE   8          3HG2      ILE   8 -22.287   2.243  -3.137
   76   1HD1  ILE   8          1HD1      ILE   8 -22.658   5.258   0.530
   77   2HD1  ILE   8          2HD1      ILE   8 -22.999   4.998  -1.181
   78   3HD1  ILE   8          3HD1      ILE   8 -21.479   5.745  -0.688
   79    H    LYS   9           H        LYS   9 -20.435   0.964   0.864
   80    HA   LYS   9           HA       LYS   9 -17.875   2.078   1.542
   81   1HB   LYS   9          2HB       LYS   9 -19.281   2.134   3.370
   82   2HB   LYS   9          1HB       LYS   9 -20.011   0.581   2.990
   83   1HG   LYS   9          2HG       LYS   9 -17.158   0.534   3.741
   84   2HG   LYS   9          1HG       LYS   9 -18.304   0.956   5.015
   85   1HD   LYS   9          2HD       LYS   9 -18.821  -1.419   3.273
   86   2HD   LYS   9          1HD       LYS   9 -17.669  -1.542   4.605
   87   1HE   LYS   9          2HE       LYS   9 -19.470  -0.652   6.110
   88   2HE   LYS   9          1HE       LYS   9 -20.590  -0.822   4.759
   89   1HZ   LYS   9          1HZ       LYS   9 -20.848  -2.786   5.925
   90   2HZ   LYS   9          2HZ       LYS   9 -19.201  -2.930   6.282
   91   3HZ   LYS   9          3HZ       LYS   9 -19.756  -3.233   4.713
   92    H    THR  10           H        THR  10 -19.186  -1.198   1.183
   93    HA   THR  10           HA       THR  10 -16.737  -2.526   1.701
   94    HB   THR  10           HB       THR  10 -19.239  -3.408   0.255
   95    HG1  THR  10           1HG      THR  10 -18.264  -3.596   2.870
   96   1HG2  THR  10          1HG2      THR  10 -17.711  -5.593   1.273
   97   2HG2  THR  10          2HG2      THR  10 -16.743  -4.673   0.122
   98   3HG2  THR  10          3HG2      THR  10 -18.313  -5.314  -0.361
   99    H    VAL  11           H        VAL  11 -18.242  -1.223  -1.179
  100    HA   VAL  11           HA       VAL  11 -16.437  -2.412  -3.037
  101    HB   VAL  11           HB       VAL  11 -18.218   0.010  -3.322
  102   1HG1  VAL  11          1HG1      VAL  11 -16.230  -0.131  -4.894
  103   2HG1  VAL  11          2HG1      VAL  11 -17.822  -0.031  -5.646
  104   3HG1  VAL  11          3HG1      VAL  11 -16.985  -1.581  -5.556
  105   1HG2  VAL  11          1HG2      VAL  11 -18.817  -2.729  -3.161
  106   2HG2  VAL  11          2HG2      VAL  11 -18.992  -2.280  -4.858
  107   3HG2  VAL  11          3HG2      VAL  11 -19.897  -1.412  -3.618
  108    H    GLY  12           H        GLY  12 -16.663   0.775  -1.504
  109   1HA   GLY  12          2HA       GLY  12 -14.406   1.902  -2.779
  110   2HA   GLY  12          1HA       GLY  12 -15.105   2.450  -1.258
  111    H    LYS  13           H        LYS  13 -14.763  -0.336  -0.188
  112    HA   LYS  13           HA       LYS  13 -12.120   0.062   0.894
  113   1HB   LYS  13          2HB       LYS  13 -14.413  -1.770   1.446
  114   2HB   LYS  13          1HB       LYS  13 -12.814  -2.254   1.991
  115   1HG   LYS  13          2HG       LYS  13 -14.540  -0.777   3.444
  116   2HG   LYS  13          1HG       LYS  13 -12.790  -0.756   3.658
  117   1HD   LYS  13          2HD       LYS  13 -13.958   1.087   1.642
  118   2HD   LYS  13          1HD       LYS  13 -14.211   1.469   3.346
  119   1HE   LYS  13          2HE       LYS  13 -12.052   2.012   3.676
  120   2HE   LYS  13          1HE       LYS  13 -11.462   0.710   2.643
  121   1HZ   LYS  13          1HZ       LYS  13 -10.949   2.374   1.260
  122   2HZ   LYS  13          2HZ       LYS  13 -12.001   3.472   1.999
  123   3HZ   LYS  13          3HZ       LYS  13 -12.593   2.370   0.860
  124    H    ALA  14           H        ALA  14 -13.696  -2.043  -1.417
  125    HA   ALA  14           HA       ALA  14 -11.663  -3.996  -1.603
  126   1HB   ALA  14          1HB       ALA  14 -12.716  -4.290  -3.966
  127   2HB   ALA  14          2HB       ALA  14 -13.925  -3.158  -3.362
  128   3HB   ALA  14          3HB       ALA  14 -13.659  -4.691  -2.531
  129    H    VAL  15           H        VAL  15 -12.382  -1.187  -3.657
  130    HA   VAL  15           HA       VAL  15 -10.105  -1.447  -5.299
  131    HB   VAL  15           HB       VAL  15 -11.557   1.125  -4.665
  132   1HG1  VAL  15          1HG1      VAL  15  -9.676   1.728  -5.870
  133   2HG1  VAL  15          2HG1      VAL  15 -10.876   1.502  -7.142
  134   3HG1  VAL  15          3HG1      VAL  15  -9.682   0.243  -6.822
  135   1HG2  VAL  15          1HG2      VAL  15 -13.125  -0.657  -5.336
  136   2HG2  VAL  15          2HG2      VAL  15 -12.193  -0.893  -6.814
  137   3HG2  VAL  15          3HG2      VAL  15 -13.022   0.637  -6.530
  138    H    GLY  16           H        GLY  16 -10.683   0.175  -2.243
  139   1HA   GLY  16          2HA       GLY  16  -8.283   1.677  -2.161
  140   2HA   GLY  16          1HA       GLY  16  -9.269   1.235  -0.775
  141    H    LYS  17           H        LYS  17  -9.068  -1.629  -1.300
  142    HA   LYS  17           HA       LYS  17  -6.669  -2.133   0.147
  143   1HB   LYS  17          2HB       LYS  17  -9.053  -3.534  -0.436
  144   2HB   LYS  17          1HB       LYS  17  -7.733  -4.523  -1.045
  145   1HG   LYS  17          2HG       LYS  17  -7.435  -5.279   1.012
  146   2HG   LYS  17          1HG       LYS  17  -6.913  -3.660   1.484
  147   1HD   LYS  17          2HD       LYS  17  -9.500  -3.226   1.651
  148   2HD   LYS  17          1HD       LYS  17  -9.565  -4.981   1.826
  149   1HE   LYS  17          2HE       LYS  17  -7.761  -3.250   3.497
  150   2HE   LYS  17          1HE       LYS  17  -9.419  -3.620   3.967
  151   1HZ   LYS  17          1HZ       LYS  17  -8.906  -5.932   4.042
  152   2HZ   LYS  17          2HZ       LYS  17  -7.730  -5.120   4.947
  153   3HZ   LYS  17          3HZ       LYS  17  -7.363  -5.681   3.394
  154    H    GLY  18           H        GLY  18  -7.693  -2.646  -3.197
  155   1HA   GLY  18          2HA       GLY  18  -5.466  -4.057  -4.116
  156   2HA   GLY  18          1HA       GLY  18  -6.464  -3.003  -5.109
  157    H    LEU  19           H        LEU  19  -6.041  -0.544  -4.193
  158    HA   LEU  19           HA       LEU  19  -3.588   0.209  -5.264
  159   1HB   LEU  19          2HB       LEU  19  -5.355   1.811  -5.100
  160   2HB   LEU  19          1HB       LEU  19  -5.437   1.632  -3.358
  161    HG   LEU  19           HG       LEU  19  -4.368   3.753  -4.155
  162   1HD1  LEU  19          1HD1      LEU  19  -3.316   3.815  -2.202
  163   2HD1  LEU  19          2HD1      LEU  19  -2.149   2.596  -2.715
  164   3HD1  LEU  19          3HD1      LEU  19  -3.697   2.101  -2.031
  165   1HD2  LEU  19          1HD2      LEU  19  -2.039   3.612  -4.943
  166   2HD2  LEU  19          2HD2      LEU  19  -3.180   2.895  -6.080
  167   3HD2  LEU  19          3HD2      LEU  19  -2.198   1.859  -5.045
  168    H    ARG  20           H        ARG  20  -4.551  -0.163  -1.872
  169    HA   ARG  20           HA       ARG  20  -2.159   0.607  -0.694
  170   1HB   ARG  20          2HB       ARG  20  -4.417   0.032   0.410
  171   2HB   ARG  20          1HB       ARG  20  -3.838  -1.629   0.409
  172   1HG   ARG  20          2HG       ARG  20  -3.489  -0.259   2.525
  173   2HG   ARG  20          1HG       ARG  20  -2.103  -1.152   1.896
  174   1HD   ARG  20          2HD       ARG  20  -1.468   1.103   2.581
  175   2HD   ARG  20          1HD       ARG  20  -1.256   0.881   0.847
  176    HE   ARG  20           HE       ARG  20  -2.883   2.462   0.473
  177   1HH1  ARG  20          1HH1      ARG  20  -2.935   1.507   3.824
  178   2HH1  ARG  20          2HH1      ARG  20  -4.033   2.759   4.299
  179   1HH2  ARG  20          1HH2      ARG  20  -4.329   4.117   1.090
  180   2HH2  ARG  20          2HH2      ARG  20  -4.824   4.244   2.745
  181    H    ALA  21           H        ALA  21  -3.194  -2.583  -1.819
  182    HA   ALA  21           HA       ALA  21  -0.984  -4.057  -0.984
  183   1HB   ALA  21          1HB       ALA  21  -3.250  -4.707  -2.250
  184   2HB   ALA  21          2HB       ALA  21  -1.839  -5.765  -2.222
  185   3HB   ALA  21          3HB       ALA  21  -2.147  -4.740  -3.625
  186    H    ILE  22           H        ILE  22  -1.364  -1.806  -3.596
  187    HA   ILE  22           HA       ILE  22   1.059  -2.573  -4.951
  188    HB   ILE  22           HB       ILE  22  -0.705  -0.130  -5.187
  189   1HG1  ILE  22          2HG1      ILE  22  -1.776  -2.027  -6.137
  190   2HG1  ILE  22          1HG1      ILE  22  -1.087  -1.137  -7.490
  191   1HG2  ILE  22          1HG2      ILE  22   0.846  -0.107  -7.425
  192   2HG2  ILE  22          2HG2      ILE  22   2.000  -0.615  -6.191
  193   3HG2  ILE  22          3HG2      ILE  22   1.112   0.896  -5.999
  194   1HD1  ILE  22          1HD1      ILE  22   0.925  -2.868  -6.856
  195   2HD1  ILE  22          2HD1      ILE  22  -0.278  -3.113  -8.121
  196   3HD1  ILE  22          3HD1      ILE  22  -0.519  -3.825  -6.526
  197    H    ASN  23           H        ASN  23   0.142  -0.649  -2.276
  198    HA   ASN  23           HA       ASN  23   2.430   1.067  -2.232
  199   1HB   ASN  23          2HB       ASN  23   1.159   2.134  -0.753
  200   2HB   ASN  23          1HB       ASN  23  -0.035   0.868  -0.892
  201   1HD2  ASN  23          1HD2      ASN  23   2.734   2.007   0.915
  202   2HD2  ASN  23          2HD2      ASN  23   2.383   1.140   2.368
  203    H    ILE  24           H        ILE  24   1.404  -1.524  -0.031
  204    HA   ILE  24           HA       ILE  24   3.888  -1.793   1.235
  205    HB   ILE  24           HB       ILE  24   3.017  -3.529   2.403
  206   1HG1  ILE  24          2HG1      ILE  24   3.137  -5.132   0.530
  207   2HG1  ILE  24          1HG1      ILE  24   1.697  -5.374   1.514
  208   1HG2  ILE  24          1HG2      ILE  24   0.459  -2.653   1.087
  209   2HG2  ILE  24          2HG2      ILE  24   1.294  -1.763   2.361
  210   3HG2  ILE  24          3HG2      ILE  24   0.647  -3.370   2.687
  211   1HD1  ILE  24          1HD1      ILE  24   0.940  -3.602  -0.503
  212   2HD1  ILE  24          2HD1      ILE  24   0.508  -5.305  -0.343
  213   3HD1  ILE  24          3HD1      ILE  24   1.924  -4.838  -1.287
  214    H    ALA  25           H        ALA  25   2.665  -2.834  -1.793
  215    HA   ALA  25           HA       ALA  25   4.721  -4.772  -2.272
  216   1HB   ALA  25          1HB       ALA  25   2.745  -5.237  -3.439
  217   2HB   ALA  25          2HB       ALA  25   3.817  -4.577  -4.673
  218   3HB   ALA  25          3HB       ALA  25   2.558  -3.564  -3.966
  219    H    SER  26           H        SER  26   4.198  -1.369  -2.729
  220    HA   SER  26           HA       SER  26   6.471  -1.083  -4.519
  221   1HB   SER  26          2HB       SER  26   4.617   0.928  -3.226
  222   2HB   SER  26          1HB       SER  26   5.978   1.385  -4.250
  223    HG   SER  26           HG       SER  26   5.011   0.173  -5.934
  224    H    THR  27           H        THR  27   5.894  -1.249  -1.187
  225    HA   THR  27           HA       THR  27   8.111   0.391  -0.372
  226    HB   THR  27           HB       THR  27   5.855  -0.477   0.897
  227    HG1  THR  27           1HG      THR  27   6.769   1.196   1.817
  228   1HG2  THR  27          1HG2      THR  27   6.624  -1.804   2.842
  229   2HG2  THR  27          2HG2      THR  27   8.118  -2.142   1.968
  230   3HG2  THR  27          3HG2      THR  27   6.576  -2.712   1.330
  231    H    ALA  28           H        ALA  28   7.451  -3.052  -0.780
  232    HA   ALA  28           HA       ALA  28   9.789  -4.091   0.325
  233   1HB   ALA  28          1HB       ALA  28   9.420  -6.034  -1.162
  234   2HB   ALA  28          2HB       ALA  28   8.183  -5.111  -2.016
  235   3HB   ALA  28          3HB       ALA  28   7.956  -5.528  -0.317
  236    H    ASN  29           H        ASN  29   9.188  -2.672  -2.835
  237    HA   ASN  29           HA       ASN  29  11.795  -3.338  -3.860
  238   1HB   ASN  29          2HB       ASN  29  11.045  -1.513  -5.610
  239   2HB   ASN  29          1HB       ASN  29  10.305  -3.111  -5.611
  240   1HD2  ASN  29          1HD2      ASN  29   9.531  -0.107  -6.125
  241   2HD2  ASN  29          2HD2      ASN  29   7.948  -0.027  -5.437
  242    H    ASP  30           H        ASP  30  10.198  -0.342  -2.823
  243    HA   ASP  30           HA       ASP  30  12.408   1.353  -3.088
  244   1HB   ASP  30          2HB       ASP  30  10.320   2.409  -2.773
  245   2HB   ASP  30          1HB       ASP  30   9.955   1.451  -1.341
  246    H    VAL  31           H        VAL  31  11.615  -1.036  -0.739
  247    HA   VAL  31           HA       VAL  31  13.399  -0.093   1.308
  248    HB   VAL  31           HB       VAL  31  11.830  -2.630   0.917
  249   1HG1  VAL  31          1HG1      VAL  31  12.665  -3.036   3.379
  250   2HG1  VAL  31          2HG1      VAL  31  14.063  -2.120   2.817
  251   3HG1  VAL  31          3HG1      VAL  31  13.595  -3.609   1.994
  252   1HG2  VAL  31          1HG2      VAL  31  11.721  -0.733   3.235
  253   2HG2  VAL  31          2HG2      VAL  31  10.498  -1.873   2.675
  254   3HG2  VAL  31          3HG2      VAL  31  10.836  -0.415   1.743
  255    H    PHE  32           H        PHE  32  13.381  -2.966  -0.774
  256    HA   PHE  32           HA       PHE  32  15.845  -3.999  -0.221
  257   1HB   PHE  32          2HB       PHE  32  14.887  -5.408  -1.698
  258   2HB   PHE  32          1HB       PHE  32  13.975  -4.118  -2.469
  259    HD1  PHE  32           1HD      PHE  32  14.912  -2.895  -4.362
  260    HD2  PHE  32           2HD      PHE  32  17.000  -6.139  -2.566
  261    HE1  PHE  32           1HE      PHE  32  16.378  -3.038  -6.333
  262    HE2  PHE  32           2HE      PHE  32  18.470  -6.286  -4.534
  263    HZ   PHE  32           HZ       PHE  32  18.160  -4.734  -6.420
  264    H    ASN  33           H        ASN  33  15.130  -1.066  -1.905
  265    HA   ASN  33           HA       ASN  33  17.835  -0.835  -2.962
  266   1HB   ASN  33          2HB       ASN  33  16.094  -0.090  -4.441
  267   2HB   ASN  33          1HB       ASN  33  15.404   0.945  -3.194
  268   1HD2  ASN  33          1HD2      ASN  33  16.748   1.274  -5.961
  269   2HD2  ASN  33          2HD2      ASN  33  17.811   2.613  -5.714
  270    H    PHE  34           H        PHE  34  15.819   0.488  -0.415
  271    HA   PHE  34           HA       PHE  34  17.414   2.687   0.294
  272   1HB   PHE  34          2HB       PHE  34  15.218   2.584   1.197
  273   2HB   PHE  34          1HB       PHE  34  15.494   0.986   1.881
  274    HD1  PHE  34           1HD      PHE  34  15.355   4.418   2.577
  275    HD2  PHE  34           2HD      PHE  34  17.434   0.863   3.652
  276    HE1  PHE  34           1HE      PHE  34  16.015   5.453   4.709
  277    HE2  PHE  34           2HE      PHE  34  18.098   1.891   5.786
  278    HZ   PHE  34           HZ       PHE  34  17.389   4.189   6.317
  279    H    LEU  35           H        LEU  35  17.609  -0.712   1.147
  280    HA   LEU  35           HA       LEU  35  20.104  -0.133   2.604
  281   1HB   LEU  35          2HB       LEU  35  19.374  -2.595   3.513
  282   2HB   LEU  35          1HB       LEU  35  19.056  -1.082   4.340
  283    HG   LEU  35           HG       LEU  35  16.839  -1.055   3.023
  284   1HD1  LEU  35          1HD1      LEU  35  17.911  -3.740   2.396
  285   2HD1  LEU  35          2HD1      LEU  35  16.853  -2.688   1.455
  286   3HD1  LEU  35          3HD1      LEU  35  16.196  -3.630   2.793
  287   1HD2  LEU  35          1HD2      LEU  35  17.583  -2.737   5.361
  288   2HD2  LEU  35          2HD2      LEU  35  15.952  -2.883   4.704
  289   3HD2  LEU  35          3HD2      LEU  35  16.537  -1.320   5.273
  290    H    LYS  36           H        LYS  36  20.861  -0.288   0.258
  291    HA   LYS  36           HA       LYS  36  21.099  -3.011  -0.726
  292   1HB   LYS  36          2HB       LYS  36  21.697  -0.306  -1.842
  293   2HB   LYS  36          1HB       LYS  36  22.486  -1.713  -2.540
  294   1HG   LYS  36          2HG       LYS  36  20.463  -2.631  -3.264
  295   2HG   LYS  36          1HG       LYS  36  19.511  -1.592  -2.201
  296   1HD   LYS  36          2HD       LYS  36  19.779   0.264  -3.563
  297   2HD   LYS  36          1HD       LYS  36  21.226  -0.387  -4.335
  298   1HE   LYS  36          2HE       LYS  36  19.120  -2.187  -4.871
  299   2HE   LYS  36          1HE       LYS  36  18.498  -0.565  -5.172
  300   1HZ   LYS  36          1HZ       LYS  36  19.494  -0.759  -7.140
  301   2HZ   LYS  36          2HZ       LYS  36  20.423  -2.087  -6.659
  302   3HZ   LYS  36          3HZ       LYS  36  20.954  -0.518  -6.320
  303    HA   PRO  37           HA       PRO  37  25.653  -2.080   0.226
  304   1HB   PRO  37          2HB       PRO  37  26.412   0.264   1.208
  305   2HB   PRO  37          1HB       PRO  37  25.972   0.104  -0.498
  306   1HG   PRO  37          2HG       PRO  37  24.380   1.220   1.774
  307   2HG   PRO  37          1HG       PRO  37  24.522   1.810   0.109
  308   1HD   PRO  37          2HD       PRO  37  22.444   0.240   1.092
  309   2HD   PRO  37          1HD       PRO  37  22.855   0.447  -0.621
  310    H    LYS  38           H        LYS  38  27.136  -1.528   2.253
  311    HA   LYS  38           HA       LYS  38  25.600  -1.935   4.723
  312   1HB   LYS  38          2HB       LYS  38  27.346  -3.595   5.439
  313   2HB   LYS  38          1HB       LYS  38  26.298  -4.139   4.136
  314   1HG   LYS  38          2HG       LYS  38  28.357  -3.036   2.744
  315   2HG   LYS  38          1HG       LYS  38  29.187  -3.672   4.165
  316   1HD   LYS  38          2HD       LYS  38  27.205  -5.399   2.757
  317   2HD   LYS  38          1HD       LYS  38  28.801  -5.170   2.038
  318   1HE   LYS  38          2HE       LYS  38  29.888  -6.190   3.812
  319   2HE   LYS  38          1HE       LYS  38  28.546  -5.916   4.922
  320   1HZ   LYS  38          1HZ       LYS  38  28.829  -7.979   2.836
  321   2HZ   LYS  38          2HZ       LYS  38  27.291  -7.510   3.364
  322   3HZ   LYS  38          3HZ       LYS  38  28.400  -8.159   4.463
  323    H    LYS  39           H        LYS  39  28.626  -0.978   3.205
  324    HA   LYS  39           HA       LYS  39  29.727   0.083   5.650
  325   1HB   LYS  39          2HB       LYS  39  30.634   0.260   2.773
  326   2HB   LYS  39          1HB       LYS  39  31.525   0.946   4.124
  327   1HG   LYS  39          2HG       LYS  39  32.083  -1.138   4.981
  328   2HG   LYS  39          1HG       LYS  39  30.790  -1.953   4.098
  329   1HD   LYS  39          2HD       LYS  39  32.467  -0.703   2.190
  330   2HD   LYS  39          1HD       LYS  39  33.508  -1.557   3.330
  331   1HE   LYS  39          2HE       LYS  39  31.098  -2.956   2.293
  332   2HE   LYS  39          1HE       LYS  39  32.480  -2.765   1.216
  333   1HZ   LYS  39          1HZ       LYS  39  32.589  -3.995   3.918
  334   2HZ   LYS  39          2HZ       LYS  39  33.871  -3.875   2.822
  335   3HZ   LYS  39          3HZ       LYS  39  32.541  -4.855   2.461
  336    H    ARG  40           H        ARG  40  27.284   1.126   3.776
  337    HA   ARG  40           HA       ARG  40  27.481   3.819   4.757
  338   1HB   ARG  40          2HB       ARG  40  28.849   3.871   2.658
  339   2HB   ARG  40          1HB       ARG  40  27.406   3.413   1.764
  340   1HG   ARG  40          2HG       ARG  40  26.394   5.459   2.084
  341   2HG   ARG  40          1HG       ARG  40  27.356   5.828   3.516
  342   1HD   ARG  40          2HD       ARG  40  28.830   5.488   0.976
  343   2HD   ARG  40          1HD       ARG  40  27.815   6.923   1.113
  344    HE   ARG  40           HE       ARG  40  30.242   6.353   2.579
  345   1HH1  ARG  40          1HH1      ARG  40  27.347   8.280   2.370
  346   2HH1  ARG  40          2HH1      ARG  40  27.976   9.561   3.352
  347   1HH2  ARG  40          1HH2      ARG  40  31.078   8.034   3.870
  348   2HH2  ARG  40          2HH2      ARG  40  30.098   9.424   4.201
  349    H    LYS  41           H        LYS  41  25.526   3.503   5.756
  350    HA   LYS  41           HA       LYS  41  23.257   2.390   4.443
  351   1HB   LYS  41          2HB       LYS  41  23.010   4.187   6.824
  352   2HB   LYS  41          1HB       LYS  41  22.112   2.727   6.435
  353   1HG   LYS  41          2HG       LYS  41  24.191   1.419   6.868
  354   2HG   LYS  41          1HG       LYS  41  24.942   2.912   7.436
  355   1HD   LYS  41          2HD       LYS  41  22.320   2.117   8.597
  356   2HD   LYS  41          1HD       LYS  41  23.762   1.236   9.104
  357   1HE   LYS  41          2HE       LYS  41  24.630   3.798   9.284
  358   2HE   LYS  41          1HE       LYS  41  22.924   3.996   9.680
  359   1HZ   LYS  41          1HZ       LYS  41  24.820   3.304  11.443
  360   2HZ   LYS  41          2HZ       LYS  41  24.226   1.782  11.007
  361   3HZ   LYS  41          3HZ       LYS  41  23.175   2.952  11.630
  362    H    ALA  42           H        ALA  42  22.552   3.426   2.662
  363    HA   ALA  42           HA       ALA  42  22.470   6.298   2.492
  364   1HB   ALA  42          1HB       ALA  42  20.975   5.321   0.380
  365   2HB   ALA  42          2HB       ALA  42  22.172   4.059   0.673
  366   3HB   ALA  42          3HB       ALA  42  22.694   5.713   0.353
  Start of MODEL   16
    1   1H    ALA   1          1HT       ALA   1  33.796   2.381   4.635
    2   2H    ALA   1          2HT       ALA   1  32.938   3.687   3.925
    3   3H    ALA   1          3HT       ALA   1  34.149   2.865   3.029
    4    HA   ALA   1           HA       ALA   1  31.786   1.494   4.075
    5   1HB   ALA   1          1HB       ALA   1  30.766   1.818   1.848
    6   2HB   ALA   1          2HB       ALA   1  32.063   2.943   1.447
    7   3HB   ALA   1          3HB       ALA   1  30.939   3.322   2.752
    8    H    LYS   2           H        LYS   2  31.284  -0.332   2.514
    9    HA   LYS   2           HA       LYS   2  33.676  -1.393   1.208
   10   1HB   LYS   2          2HB       LYS   2  33.288  -2.253   3.642
   11   2HB   LYS   2          1HB       LYS   2  32.000  -3.203   2.915
   12   1HG   LYS   2          2HG       LYS   2  34.940  -3.450   2.623
   13   2HG   LYS   2          1HG       LYS   2  33.706  -4.701   2.792
   14   1HD   LYS   2          2HD       LYS   2  32.990  -4.342   0.503
   15   2HD   LYS   2          1HD       LYS   2  34.143  -3.018   0.327
   16   1HE   LYS   2          2HE       LYS   2  35.988  -4.600   0.707
   17   2HE   LYS   2          1HE       LYS   2  34.821  -5.915   0.837
   18   1HZ   LYS   2          1HZ       LYS   2  34.104  -5.029  -1.499
   19   2HZ   LYS   2          2HZ       LYS   2  35.418  -6.082  -1.344
   20   3HZ   LYS   2          3HZ       LYS   2  35.683  -4.423  -1.535
   21    H    ILE   3           H        ILE   3  30.317  -2.316   1.980
   22    HA   ILE   3           HA       ILE   3  29.638  -2.379  -0.831
   23    HB   ILE   3           HB       ILE   3  30.573  -4.603  -0.581
   24   1HG1  ILE   3          2HG1      ILE   3  27.781  -5.437  -0.502
   25   2HG1  ILE   3          1HG1      ILE   3  28.023  -4.005  -1.498
   26   1HG2  ILE   3          1HG2      ILE   3  28.619  -4.925   1.693
   27   2HG2  ILE   3          2HG2      ILE   3  30.376  -4.848   1.823
   28   3HG2  ILE   3          3HG2      ILE   3  29.611  -6.214   1.010
   29   1HD1  ILE   3          1HD1      ILE   3  29.537  -5.133  -2.913
   30   2HD1  ILE   3          2HD1      ILE   3  28.160  -6.211  -2.686
   31   3HD1  ILE   3          3HD1      ILE   3  29.661  -6.501  -1.806
   32    HA   PRO   4           HA       PRO   4  26.152  -1.593   2.198
   33   1HB   PRO   4          2HB       PRO   4  26.112   1.067   2.342
   34   2HB   PRO   4          1HB       PRO   4  27.252   0.121   3.307
   35   1HG   PRO   4          2HG       PRO   4  27.719   1.652   0.785
   36   2HG   PRO   4          1HG       PRO   4  28.758   1.497   2.212
   37   1HD   PRO   4          2HD       PRO   4  29.031   0.044  -0.147
   38   2HD   PRO   4          1HD       PRO   4  29.727  -0.405   1.421
   39    H    ILE   5           H        ILE   5  26.793  -1.221  -0.981
   40    HA   ILE   5           HA       ILE   5  24.801   0.515  -1.920
   41    HB   ILE   5           HB       ILE   5  24.910  -1.155  -3.978
   42   1HG1  ILE   5          2HG1      ILE   5  27.682  -1.639  -3.107
   43   2HG1  ILE   5          1HG1      ILE   5  26.466  -2.567  -2.235
   44   1HG2  ILE   5          1HG2      ILE   5  27.420   0.363  -3.538
   45   2HG2  ILE   5          2HG2      ILE   5  25.896   1.249  -3.495
   46   3HG2  ILE   5          3HG2      ILE   5  26.343   0.333  -4.934
   47   1HD1  ILE   5          1HD1      ILE   5  27.608  -3.213  -4.660
   48   2HD1  ILE   5          2HD1      ILE   5  26.009  -2.605  -5.091
   49   3HD1  ILE   5          3HD1      ILE   5  26.167  -3.941  -3.950
   50    H    LYS   6           H        LYS   6  24.669  -3.014  -2.284
   51    HA   LYS   6           HA       LYS   6  21.950  -3.194  -2.745
   52   1HB   LYS   6          2HB       LYS   6  24.108  -5.012  -2.187
   53   2HB   LYS   6          1HB       LYS   6  22.667  -5.521  -1.318
   54   1HG   LYS   6          2HG       LYS   6  21.814  -6.370  -3.171
   55   2HG   LYS   6          1HG       LYS   6  21.935  -4.805  -3.978
   56   1HD   LYS   6          2HD       LYS   6  24.503  -5.562  -4.102
   57   2HD   LYS   6          1HD       LYS   6  23.736  -7.151  -4.092
   58   1HE   LYS   6          2HE       LYS   6  22.768  -5.000  -5.935
   59   2HE   LYS   6          1HE       LYS   6  24.179  -5.971  -6.355
   60   1HZ   LYS   6          1HZ       LYS   6  22.100  -7.659  -5.479
   61   2HZ   LYS   6          2HZ       LYS   6  22.851  -7.604  -6.994
   62   3HZ   LYS   6          3HZ       LYS   6  21.502  -6.632  -6.684
   63    H    ALA   7           H        ALA   7  23.647  -2.718   0.230
   64    HA   ALA   7           HA       ALA   7  21.509  -3.524   1.954
   65   1HB   ALA   7          1HB       ALA   7  23.320  -3.614   3.260
   66   2HB   ALA   7          2HB       ALA   7  23.075  -1.882   3.480
   67   3HB   ALA   7          3HB       ALA   7  24.211  -2.465   2.262
   68    H    ILE   8           H        ILE   8  22.733  -0.419   0.771
   69    HA   ILE   8           HA       ILE   8  20.874   1.166   2.224
   70    HB   ILE   8           HB       ILE   8  23.062   1.957   1.185
   71   1HG1  ILE   8          2HG1      ILE   8  20.955   3.838   0.286
   72   2HG1  ILE   8          1HG1      ILE   8  20.869   3.313   1.965
   73   1HG2  ILE   8          1HG2      ILE   8  21.852   2.878  -1.251
   74   2HG2  ILE   8          2HG2      ILE   8  21.803   1.118  -1.170
   75   3HG2  ILE   8          3HG2      ILE   8  23.342   1.963  -1.017
   76   1HD1  ILE   8          1HD1      ILE   8  22.992   4.212   2.452
   77   2HD1  ILE   8          2HD1      ILE   8  22.137   5.441   1.519
   78   3HD1  ILE   8          3HD1      ILE   8  23.367   4.442   0.744
   79    H    LYS   9           H        LYS   9  20.781  -0.520  -0.803
   80    HA   LYS   9           HA       LYS   9  18.479   0.839  -1.842
   81   1HB   LYS   9          2HB       LYS   9  20.254  -1.346  -2.678
   82   2HB   LYS   9          1HB       LYS   9  18.582  -1.552  -3.180
   83   1HG   LYS   9          2HG       LYS   9  19.780  -0.445  -4.925
   84   2HG   LYS   9          1HG       LYS   9  18.658   0.706  -4.196
   85   1HD   LYS   9          2HD       LYS   9  20.715   1.322  -2.707
   86   2HD   LYS   9          1HD       LYS   9  21.638   0.580  -4.016
   87   1HE   LYS   9          2HE       LYS   9  19.720   2.276  -5.203
   88   2HE   LYS   9          1HE       LYS   9  20.465   3.182  -3.888
   89   1HZ   LYS   9          1HZ       LYS   9  22.382   3.335  -4.991
   90   2HZ   LYS   9          2HZ       LYS   9  21.499   2.899  -6.366
   91   3HZ   LYS   9          3HZ       LYS   9  22.349   1.721  -5.499
   92    H    THR  10           H        THR  10  19.098  -2.075   0.010
   93    HA   THR  10           HA       THR  10  16.467  -3.136  -0.165
   94    HB   THR  10           HB       THR  10  18.745  -3.619   1.755
   95    HG1  THR  10           1HG      THR  10  19.265  -5.111   0.384
   96   1HG2  THR  10          1HG2      THR  10  17.350  -5.786   2.186
   97   2HG2  THR  10          2HG2      THR  10  15.990  -4.732   1.797
   98   3HG2  THR  10          3HG2      THR  10  17.068  -4.325   3.132
   99    H    VAL  11           H        VAL  11  18.116  -0.996   2.087
  100    HA   VAL  11           HA       VAL  11  16.004  -0.904   3.995
  101    HB   VAL  11           HB       VAL  11  18.331   0.952   3.499
  102   1HG1  VAL  11          1HG1      VAL  11  15.986   1.255   5.239
  103   2HG1  VAL  11          2HG1      VAL  11  17.122   2.464   4.641
  104   3HG1  VAL  11          3HG1      VAL  11  17.540   1.479   6.043
  105   1HG2  VAL  11          1HG2      VAL  11  18.338  -1.547   4.533
  106   2HG2  VAL  11          2HG2      VAL  11  18.091  -0.587   5.993
  107   3HG2  VAL  11          3HG2      VAL  11  19.497  -0.291   4.970
  108    H    GLY  12           H        GLY  12  16.957   1.121   1.261
  109   1HA   GLY  12          2HA       GLY  12  15.026   3.148   1.648
  110   2HA   GLY  12          1HA       GLY  12  15.829   2.775   0.128
  111    H    LYS  13           H        LYS  13  14.885  -0.013   0.182
  112    HA   LYS  13           HA       LYS  13  12.328   0.448  -1.076
  113   1HB   LYS  13          2HB       LYS  13  13.948  -2.071  -0.663
  114   2HB   LYS  13          1HB       LYS  13  12.438  -2.001  -1.562
  115   1HG   LYS  13          2HG       LYS  13  13.389  -0.678  -3.259
  116   2HG   LYS  13          1HG       LYS  13  14.813  -0.314  -2.283
  117   1HD   LYS  13          2HD       LYS  13  15.777  -2.351  -2.682
  118   2HD   LYS  13          1HD       LYS  13  14.225  -3.164  -2.897
  119   1HE   LYS  13          2HE       LYS  13  14.385  -1.283  -4.962
  120   2HE   LYS  13          1HE       LYS  13  15.985  -2.018  -4.868
  121   1HZ   LYS  13          1HZ       LYS  13  13.400  -3.440  -5.201
  122   2HZ   LYS  13          2HZ       LYS  13  14.889  -4.209  -4.971
  123   3HZ   LYS  13          3HZ       LYS  13  14.624  -3.278  -6.358
  124    H    ALA  14           H        ALA  14  13.538  -0.820   1.937
  125    HA   ALA  14           HA       ALA  14  11.208  -2.222   2.732
  126   1HB   ALA  14          1HB       ALA  14  12.835  -2.899   4.124
  127   2HB   ALA  14          2HB       ALA  14  12.369  -1.496   5.087
  128   3HB   ALA  14          3HB       ALA  14  13.729  -1.387   3.969
  129    H    VAL  15           H        VAL  15  12.359   1.067   3.348
  130    HA   VAL  15           HA       VAL  15  10.184   1.817   4.996
  131    HB   VAL  15           HB       VAL  15  10.927   4.174   4.395
  132   1HG1  VAL  15          1HG1      VAL  15  11.978   3.857   6.327
  133   2HG1  VAL  15          2HG1      VAL  15  13.388   3.332   5.407
  134   3HG1  VAL  15          3HG1      VAL  15  12.215   2.145   5.976
  135   1HG2  VAL  15          1HG2      VAL  15  13.190   2.698   3.058
  136   2HG2  VAL  15          2HG2      VAL  15  13.044   4.443   3.266
  137   3HG2  VAL  15          3HG2      VAL  15  11.921   3.585   2.213
  138    H    GLY  16           H        GLY  16  10.865   2.189   1.544
  139   1HA   GLY  16          2HA       GLY  16   8.491   3.675   0.988
  140   2HA   GLY  16          1HA       GLY  16   9.521   2.883  -0.196
  141    H    LYS  17           H        LYS  17   9.258   0.272   1.165
  142    HA   LYS  17           HA       LYS  17   6.842  -0.561  -0.162
  143   1HB   LYS  17          2HB       LYS  17   8.539  -2.115  -0.450
  144   2HB   LYS  17          1HB       LYS  17   9.116  -1.947   1.202
  145   1HG   LYS  17          2HG       LYS  17   6.402  -3.042   0.920
  146   2HG   LYS  17          1HG       LYS  17   7.705  -4.053   0.291
  147   1HD   LYS  17          2HD       LYS  17   8.726  -4.247   2.374
  148   2HD   LYS  17          1HD       LYS  17   7.910  -2.819   3.014
  149   1HE   LYS  17          2HE       LYS  17   7.163  -5.290   3.649
  150   2HE   LYS  17          1HE       LYS  17   6.012  -3.961   3.517
  151   1HZ   LYS  17          1HZ       LYS  17   5.664  -6.249   2.275
  152   2HZ   LYS  17          2HZ       LYS  17   6.590  -5.475   1.089
  153   3HZ   LYS  17          3HZ       LYS  17   5.138  -4.783   1.612
  154    H    GLY  18           H        GLY  18   7.963  -0.189   3.154
  155   1HA   GLY  18          2HA       GLY  18   5.810  -1.500   4.425
  156   2HA   GLY  18          1HA       GLY  18   6.840  -0.278   5.158
  157    H    LEU  19           H        LEU  19   6.325   1.943   3.699
  158    HA   LEU  19           HA       LEU  19   3.873   2.828   4.761
  159   1HB   LEU  19          2HB       LEU  19   5.664   4.387   4.366
  160   2HB   LEU  19          1HB       LEU  19   5.674   4.014   2.653
  161    HG   LEU  19           HG       LEU  19   4.601   6.216   3.374
  162   1HD1  LEU  19          1HD1      LEU  19   3.598   6.192   1.391
  163   2HD1  LEU  19          2HD1      LEU  19   2.501   4.895   1.866
  164   3HD1  LEU  19          3HD1      LEU  19   4.117   4.511   1.271
  165   1HD2  LEU  19          1HD2      LEU  19   2.219   6.027   4.030
  166   2HD2  LEU  19          2HD2      LEU  19   3.329   5.431   5.265
  167   3HD2  LEU  19          3HD2      LEU  19   2.449   4.291   4.246
  168    H    ARG  20           H        ARG  20   4.812   1.780   1.520
  169    HA   ARG  20           HA       ARG  20   2.355   2.423   0.282
  170   1HB   ARG  20          2HB       ARG  20   4.816   1.061  -0.449
  171   2HB   ARG  20          1HB       ARG  20   3.412   0.257  -1.131
  172   1HG   ARG  20          2HG       ARG  20   4.717   2.300  -2.311
  173   2HG   ARG  20          1HG       ARG  20   3.023   1.904  -2.603
  174   1HD   ARG  20          2HD       ARG  20   2.262   3.713  -1.460
  175   2HD   ARG  20          1HD       ARG  20   3.593   3.678  -0.306
  176    HE   ARG  20           HE       ARG  20   4.589   5.275  -1.575
  177   1HH1  ARG  20          1HH1      ARG  20   2.529   3.370  -3.638
  178   2HH1  ARG  20          2HH1      ARG  20   2.893   4.282  -5.064
  179   1HH2  ARG  20          1HH2      ARG  20   5.072   6.486  -3.451
  180   2HH2  ARG  20          2HH2      ARG  20   4.336   6.054  -4.957
  181    H    ALA  21           H        ALA  21   3.530  -0.491   1.882
  182    HA   ALA  21           HA       ALA  21   1.446  -2.206   1.211
  183   1HB   ALA  21          1HB       ALA  21   3.310  -2.023   3.533
  184   2HB   ALA  21          2HB       ALA  21   3.120  -3.310   2.341
  185   3HB   ALA  21          3HB       ALA  21   1.937  -3.124   3.636
  186    H    ILE  22           H        ILE  22   1.671   0.291   3.678
  187    HA   ILE  22           HA       ILE  22  -0.895  -0.282   4.819
  188    HB   ILE  22           HB       ILE  22   1.112   1.916   5.128
  189   1HG1  ILE  22          2HG1      ILE  22  -0.320   0.560   7.365
  190   2HG1  ILE  22          1HG1      ILE  22   0.833  -0.385   6.426
  191   1HG2  ILE  22          1HG2      ILE  22  -0.638   2.855   6.847
  192   2HG2  ILE  22          2HG2      ILE  22  -1.798   2.134   5.731
  193   3HG2  ILE  22          3HG2      ILE  22  -0.668   3.362   5.159
  194   1HD1  ILE  22          1HD1      ILE  22   1.383   1.270   8.578
  195   2HD1  ILE  22          2HD1      ILE  22   1.937   2.172   7.167
  196   3HD1  ILE  22          3HD1      ILE  22   2.548   0.545   7.471
  197    H    ASN  23           H        ASN  23   0.277   1.411   2.079
  198    HA   ASN  23           HA       ASN  23  -1.965   3.165   1.772
  199   1HB   ASN  23          2HB       ASN  23  -0.810   4.040   0.035
  200   2HB   ASN  23          1HB       ASN  23   0.519   3.187   0.785
  201   1HD2  ASN  23          1HD2      ASN  23  -2.108   2.592  -1.519
  202   2HD2  ASN  23          2HD2      ASN  23  -1.153   1.691  -2.641
  203    H    ILE  24           H        ILE  24  -0.854   0.300   0.012
  204    HA   ILE  24           HA       ILE  24  -3.182   0.025  -1.549
  205    HB   ILE  24           HB       ILE  24  -2.200  -1.769  -2.480
  206   1HG1  ILE  24          2HG1      ILE  24  -2.914  -3.210  -0.542
  207   2HG1  ILE  24          1HG1      ILE  24  -1.452  -3.749  -1.360
  208   1HG2  ILE  24          1HG2      ILE  24  -0.310  -0.187  -1.998
  209   2HG2  ILE  24          2HG2      ILE  24   0.151  -1.856  -2.334
  210   3HG2  ILE  24          3HG2      ILE  24   0.143  -1.261  -0.674
  211   1HD1  ILE  24          1HD1      ILE  24  -0.306  -2.301   0.530
  212   2HD1  ILE  24          2HD1      ILE  24  -0.790  -3.977   0.792
  213   3HD1  ILE  24          3HD1      ILE  24  -1.816  -2.662   1.365
  214    H    ALA  25           H        ALA  25  -2.455  -0.612   1.711
  215    HA   ALA  25           HA       ALA  25  -4.688  -2.395   2.114
  216   1HB   ALA  25          1HB       ALA  25  -3.858  -1.804   4.615
  217   2HB   ALA  25          2HB       ALA  25  -2.381  -1.492   3.704
  218   3HB   ALA  25          3HB       ALA  25  -3.149  -3.077   3.621
  219    H    SER  26           H        SER  26  -3.879   0.980   2.420
  220    HA   SER  26           HA       SER  26  -6.227   1.564   4.027
  221   1HB   SER  26          2HB       SER  26  -3.826   3.001   3.189
  222   2HB   SER  26          1HB       SER  26  -5.281   3.988   3.058
  223    HG   SER  26           HG       SER  26  -3.926   3.483   5.226
  224    H    THR  27           H        THR  27  -5.314   1.488   0.699
  225    HA   THR  27           HA       THR  27  -7.539   3.070  -0.211
  226    HB   THR  27           HB       THR  27  -5.529   1.342  -1.659
  227    HG1  THR  27           1HG      THR  27  -4.458   3.133  -1.842
  228   1HG2  THR  27          1HG2      THR  27  -6.484   1.673  -3.653
  229   2HG2  THR  27          2HG2      THR  27  -7.071   3.280  -3.222
  230   3HG2  THR  27          3HG2      THR  27  -7.964   1.849  -2.708
  231    H    ALA  28           H        ALA  28  -6.731  -0.346   0.095
  232    HA   ALA  28           HA       ALA  28  -8.946  -1.399  -1.280
  233   1HB   ALA  28          1HB       ALA  28  -7.859  -2.846   1.083
  234   2HB   ALA  28          2HB       ALA  28  -6.782  -2.534  -0.279
  235   3HB   ALA  28          3HB       ALA  28  -8.269  -3.450  -0.523
  236    H    ASN  29           H        ASN  29  -8.532  -0.296   2.039
  237    HA   ASN  29           HA       ASN  29 -11.147  -1.212   2.840
  238   1HB   ASN  29          2HB       ASN  29  -9.032   0.456   4.194
  239   2HB   ASN  29          1HB       ASN  29 -10.616   0.192   4.917
  240   1HD2  ASN  29          1HD2      ASN  29  -8.000  -0.617   5.874
  241   2HD2  ASN  29          2HD2      ASN  29  -8.053  -2.337   6.034
  242    H    ASP  30           H        ASP  30  -9.614   1.916   2.233
  243    HA   ASP  30           HA       ASP  30 -11.886   3.505   2.648
  244   1HB   ASP  30          2HB       ASP  30  -9.338   3.853   1.102
  245   2HB   ASP  30          1HB       ASP  30 -10.619   5.051   0.951
  246    H    VAL  31           H        VAL  31 -10.724   1.715  -0.127
  247    HA   VAL  31           HA       VAL  31 -12.438   2.768  -2.085
  248    HB   VAL  31           HB       VAL  31 -11.001   0.147  -1.801
  249   1HG1  VAL  31          1HG1      VAL  31 -12.975  -0.504  -2.963
  250   2HG1  VAL  31          2HG1      VAL  31 -11.689  -0.349  -4.158
  251   3HG1  VAL  31          3HG1      VAL  31 -12.905   0.919  -4.002
  252   1HG2  VAL  31          1HG2      VAL  31  -9.519   0.991  -3.346
  253   2HG2  VAL  31          2HG2      VAL  31  -9.977   2.443  -2.456
  254   3HG2  VAL  31          3HG2      VAL  31 -10.702   2.107  -4.029
  255    H    PHE  32           H        PHE  32 -12.727  -0.200  -0.168
  256    HA   PHE  32           HA       PHE  32 -15.337  -0.842  -1.032
  257   1HB   PHE  32          2HB       PHE  32 -13.956  -2.558  -0.081
  258   2HB   PHE  32          1HB       PHE  32 -13.781  -1.661   1.423
  259    HD1  PHE  32           1HD      PHE  32 -15.547  -1.632   3.068
  260    HD2  PHE  32           2HD      PHE  32 -15.992  -3.746  -0.597
  261    HE1  PHE  32           1HE      PHE  32 -17.492  -2.825   3.995
  262    HE2  PHE  32           2HE      PHE  32 -17.937  -4.942   0.321
  263    HZ   PHE  32           HZ       PHE  32 -18.689  -4.482   2.621
  264    H    ASN  33           H        ASN  33 -14.205   1.529   1.118
  265    HA   ASN  33           HA       ASN  33 -16.674   1.666   2.647
  266   1HB   ASN  33          2HB       ASN  33 -14.416   2.067   3.687
  267   2HB   ASN  33          1HB       ASN  33 -14.317   3.553   2.748
  268   1HD2  ASN  33          1HD2      ASN  33 -15.627   5.282   3.275
  269   2HD2  ASN  33          2HD2      ASN  33 -16.477   5.378   4.776
  270    H    PHE  34           H        PHE  34 -15.057   3.343   0.030
  271    HA   PHE  34           HA       PHE  34 -16.684   5.657   0.019
  272   1HB   PHE  34          2HB       PHE  34 -14.936   4.347  -2.048
  273   2HB   PHE  34          1HB       PHE  34 -15.900   5.766  -2.441
  274    HD1  PHE  34           1HD      PHE  34 -12.783   5.248  -2.286
  275    HD2  PHE  34           2HD      PHE  34 -15.626   7.181   0.223
  276    HE1  PHE  34           1HE      PHE  34 -11.006   6.696  -1.392
  277    HE2  PHE  34           2HE      PHE  34 -13.854   8.632   1.120
  278    HZ   PHE  34           HZ       PHE  34 -11.541   8.391   0.312
  279    H    LEU  35           H        LEU  35 -16.907   2.566  -1.682
  280    HA   LEU  35           HA       LEU  35 -19.166   3.242  -3.255
  281   1HB   LEU  35          2HB       LEU  35 -17.921   1.418  -4.025
  282   2HB   LEU  35          1HB       LEU  35 -17.871   0.663  -2.444
  283    HG   LEU  35           HG       LEU  35 -20.483   0.471  -2.819
  284   1HD1  LEU  35          1HD1      LEU  35 -20.460   1.723  -4.929
  285   2HD1  LEU  35          2HD1      LEU  35 -21.047   0.074  -5.143
  286   3HD1  LEU  35          3HD1      LEU  35 -19.407   0.497  -5.635
  287   1HD2  LEU  35          1HD2      LEU  35 -18.311  -1.238  -2.981
  288   2HD2  LEU  35          2HD2      LEU  35 -19.209  -1.543  -4.467
  289   3HD2  LEU  35          3HD2      LEU  35 -20.010  -1.704  -2.904
  290    H    LYS  36           H        LYS  36 -19.230   0.653  -0.860
  291    HA   LYS  36           HA       LYS  36 -20.988  -0.101   0.413
  292   1HB   LYS  36          2HB       LYS  36 -19.715   2.003   1.542
  293   2HB   LYS  36          1HB       LYS  36 -21.367   2.606   1.533
  294   1HG   LYS  36          2HG       LYS  36 -21.602   1.524   3.459
  295   2HG   LYS  36          1HG       LYS  36 -21.666   0.054   2.486
  296   1HD   LYS  36          2HD       LYS  36 -20.049  -0.301   4.198
  297   2HD   LYS  36          1HD       LYS  36 -19.169  -0.076   2.686
  298   1HE   LYS  36          2HE       LYS  36 -17.949   1.330   3.978
  299   2HE   LYS  36          1HE       LYS  36 -19.222   2.459   3.518
  300   1HZ   LYS  36          1HZ       LYS  36 -19.888   2.620   5.616
  301   2HZ   LYS  36          2HZ       LYS  36 -18.486   1.789   6.066
  302   3HZ   LYS  36          3HZ       LYS  36 -19.930   0.942   5.827
  303    HA   PRO  37           HA       PRO  37 -24.518   1.373  -2.087
  304   1HB   PRO  37          2HB       PRO  37 -25.796  -1.013  -2.119
  305   2HB   PRO  37          1HB       PRO  37 -24.468  -0.634  -3.222
  306   1HG   PRO  37          2HG       PRO  37 -24.423  -2.203  -0.672
  307   2HG   PRO  37          1HG       PRO  37 -23.636  -2.565  -2.220
  308   1HD   PRO  37          2HD       PRO  37 -22.310  -1.471  -0.123
  309   2HD   PRO  37          1HD       PRO  37 -21.888  -1.120  -1.811
  310    H    LYS  38           H        LYS  38 -26.488   2.068  -1.381
  311    HA   LYS  38           HA       LYS  38 -27.080   1.680   1.441
  312   1HB   LYS  38          2HB       LYS  38 -28.954   3.402   0.764
  313   2HB   LYS  38          1HB       LYS  38 -27.289   3.923   0.987
  314   1HG   LYS  38          2HG       LYS  38 -26.908   3.934  -1.377
  315   2HG   LYS  38          1HG       LYS  38 -28.487   3.208  -1.679
  316   1HD   LYS  38          2HD       LYS  38 -29.463   5.264  -0.524
  317   2HD   LYS  38          1HD       LYS  38 -27.857   5.978  -0.698
  318   1HE   LYS  38          2HE       LYS  38 -28.951   4.747  -3.134
  319   2HE   LYS  38          1HE       LYS  38 -29.833   6.157  -2.550
  320   1HZ   LYS  38          1HZ       LYS  38 -27.919   7.490  -2.719
  321   2HZ   LYS  38          2HZ       LYS  38 -27.971   6.602  -4.157
  322   3HZ   LYS  38          3HZ       LYS  38 -26.896   6.159  -2.929
  323    H    LYS  39           H        LYS  39 -28.758   1.366  -1.669
  324    HA   LYS  39           HA       LYS  39 -30.901  -0.127  -0.358
  325   1HB   LYS  39          2HB       LYS  39 -30.675   0.865  -3.204
  326   2HB   LYS  39          1HB       LYS  39 -32.088   0.091  -2.499
  327   1HG   LYS  39          2HG       LYS  39 -32.743   1.958  -1.432
  328   2HG   LYS  39          1HG       LYS  39 -31.092   2.448  -1.050
  329   1HD   LYS  39          2HD       LYS  39 -30.782   3.205  -3.357
  330   2HD   LYS  39          1HD       LYS  39 -32.430   2.705  -3.744
  331   1HE   LYS  39          2HE       LYS  39 -32.316   4.443  -1.419
  332   2HE   LYS  39          1HE       LYS  39 -31.631   5.203  -2.855
  333   1HZ   LYS  39          1HZ       LYS  39 -33.752   4.405  -3.999
  334   2HZ   LYS  39          2HZ       LYS  39 -33.879   5.723  -2.946
  335   3HZ   LYS  39          3HZ       LYS  39 -34.372   4.187  -2.439
  336    H    ARG  40           H        ARG  40 -27.990  -0.926  -1.423
  337    HA   ARG  40           HA       ARG  40 -27.045  -2.703  -2.562
  338   1HB   ARG  40          2HB       ARG  40 -28.215  -4.894  -1.580
  339   2HB   ARG  40          1HB       ARG  40 -27.139  -3.889  -0.620
  340   1HG   ARG  40          2HG       ARG  40 -28.923  -2.882   0.525
  341   2HG   ARG  40          1HG       ARG  40 -30.109  -3.464  -0.646
  342   1HD   ARG  40          2HD       ARG  40 -28.671  -5.680   0.468
  343   2HD   ARG  40          1HD       ARG  40 -29.318  -4.677   1.766
  344    HE   ARG  40           HE       ARG  40 -31.364  -5.032  -0.069
  345   1HH1  ARG  40          1HH1      ARG  40 -29.407  -7.010   2.025
  346   2HH1  ARG  40          2HH1      ARG  40 -30.634  -8.212   2.252
  347   1HH2  ARG  40          1HH2      ARG  40 -32.986  -6.608   0.222
  348   2HH2  ARG  40          2HH2      ARG  40 -32.668  -7.984   1.224
  349    H    LYS  41           H        LYS  41 -28.232  -1.835  -4.559
  350    HA   LYS  41           HA       LYS  41 -30.511  -2.676  -5.686
  351   1HB   LYS  41          2HB       LYS  41 -27.793  -2.579  -7.001
  352   2HB   LYS  41          1HB       LYS  41 -29.298  -2.756  -7.891
  353   1HG   LYS  41          2HG       LYS  41 -28.708  -0.441  -6.065
  354   2HG   LYS  41          1HG       LYS  41 -28.392  -0.433  -7.800
  355   1HD   LYS  41          2HD       LYS  41 -30.864  -1.084  -8.050
  356   2HD   LYS  41          1HD       LYS  41 -31.027  -0.570  -6.369
  357   1HE   LYS  41          2HE       LYS  41 -31.069   1.570  -6.967
  358   2HE   LYS  41          1HE       LYS  41 -29.570   1.394  -7.878
  359   1HZ   LYS  41          1HZ       LYS  41 -30.974   1.939  -9.555
  360   2HZ   LYS  41          2HZ       LYS  41 -32.336   1.270  -8.809
  361   3HZ   LYS  41          3HZ       LYS  41 -31.215   0.264  -9.578
  362    H    ALA  42           H        ALA  42 -31.375  -4.477  -6.652
  363    HA   ALA  42           HA       ALA  42 -30.737  -6.987  -5.692
  364   1HB   ALA  42          1HB       ALA  42 -32.001  -6.684  -8.386
  365   2HB   ALA  42          2HB       ALA  42 -32.845  -6.139  -6.937
  366   3HB   ALA  42          3HB       ALA  42 -32.372  -7.830  -7.098
  Start of MODEL   17
    1   1H    ALA   1          1HT       ALA   1 -31.294  -9.589   7.009
    2   2H    ALA   1          2HT       ALA   1 -30.349  -9.871   5.604
    3   3H    ALA   1          3HT       ALA   1 -32.016  -9.487   5.458
    4    HA   ALA   1           HA       ALA   1 -31.732  -7.332   5.926
    5   1HB   ALA   1          1HB       ALA   1 -29.084  -7.052   6.890
    6   2HB   ALA   1          2HB       ALA   1 -29.858  -8.343   7.809
    7   3HB   ALA   1          3HB       ALA   1 -30.600  -6.745   7.738
    8    H    LYS   2           H        LYS   2 -31.592  -6.644   3.895
    9    HA   LYS   2           HA       LYS   2 -29.180  -7.196   2.333
   10   1HB   LYS   2          2HB       LYS   2 -30.548  -6.327   0.422
   11   2HB   LYS   2          1HB       LYS   2 -31.226  -7.743   1.208
   12   1HG   LYS   2          2HG       LYS   2 -33.064  -6.653   1.874
   13   2HG   LYS   2          1HG       LYS   2 -32.169  -5.192   2.293
   14   1HD   LYS   2          2HD       LYS   2 -32.674  -4.222   0.346
   15   2HD   LYS   2          1HD       LYS   2 -32.205  -5.656  -0.569
   16   1HE   LYS   2          2HE       LYS   2 -34.629  -6.247   0.771
   17   2HE   LYS   2          1HE       LYS   2 -34.818  -4.672   0.002
   18   1HZ   LYS   2          1HZ       LYS   2 -34.031  -7.213  -1.314
   19   2HZ   LYS   2          2HZ       LYS   2 -34.014  -5.706  -2.081
   20   3HZ   LYS   2          3HZ       LYS   2 -35.475  -6.358  -1.531
   21    H    ILE   3           H        ILE   3 -29.220  -5.077   0.567
   22    HA   ILE   3           HA       ILE   3 -28.596  -2.916   0.247
   23    HB   ILE   3           HB       ILE   3 -29.628  -2.504   3.048
   24   1HG1  ILE   3          2HG1      ILE   3 -30.884  -2.048   0.337
   25   2HG1  ILE   3          1HG1      ILE   3 -31.391  -3.218   1.551
   26   1HG2  ILE   3          1HG2      ILE   3 -28.461  -0.588   2.886
   27   2HG2  ILE   3          2HG2      ILE   3 -29.799  -0.082   1.854
   28   3HG2  ILE   3          3HG2      ILE   3 -28.315  -0.705   1.133
   29   1HD1  ILE   3          1HD1      ILE   3 -31.785  -1.183   3.056
   30   2HD1  ILE   3          2HD1      ILE   3 -32.927  -1.489   1.747
   31   3HD1  ILE   3          3HD1      ILE   3 -31.691  -0.243   1.567
   32    HA   PRO   4           HA       PRO   4 -24.892  -3.740   3.068
   33   1HB   PRO   4          2HB       PRO   4 -23.484  -5.566   1.737
   34   2HB   PRO   4          1HB       PRO   4 -24.848  -6.044   2.756
   35   1HG   PRO   4          2HG       PRO   4 -24.728  -5.728  -0.220
   36   2HG   PRO   4          1HG       PRO   4 -25.492  -7.009   0.738
   37   1HD   PRO   4          2HD       PRO   4 -26.836  -4.854  -0.342
   38   2HD   PRO   4          1HD       PRO   4 -27.395  -5.792   1.057
   39    H    ILE   5           H        ILE   5 -25.522  -2.749  -0.080
   40    HA   ILE   5           HA       ILE   5 -23.171  -2.344  -1.369
   41    HB   ILE   5           HB       ILE   5 -25.401  -1.622  -2.195
   42   1HG1  ILE   5          2HG1      ILE   5 -23.025  -0.800  -3.009
   43   2HG1  ILE   5          1HG1      ILE   5 -24.498  -0.116  -3.688
   44   1HG2  ILE   5          1HG2      ILE   5 -26.305  -0.457  -0.345
   45   2HG2  ILE   5          2HG2      ILE   5 -26.069   0.742  -1.617
   46   3HG2  ILE   5          3HG2      ILE   5 -24.929   0.644  -0.275
   47   1HD1  ILE   5          1HD1      ILE   5 -22.608   1.468  -3.004
   48   2HD1  ILE   5          2HD1      ILE   5 -23.141   1.163  -1.351
   49   3HD1  ILE   5          3HD1      ILE   5 -24.254   1.874  -2.520
   50    H    LYS   6           H        LYS   6 -24.361  -0.520   1.398
   51    HA   LYS   6           HA       LYS   6 -22.372   1.499   1.319
   52   1HB   LYS   6          2HB       LYS   6 -24.667   1.214   2.694
   53   2HB   LYS   6          1HB       LYS   6 -23.525   0.731   3.941
   54   1HG   LYS   6          2HG       LYS   6 -23.488   2.926   4.392
   55   2HG   LYS   6          1HG       LYS   6 -22.340   2.983   3.053
   56   1HD   LYS   6          2HD       LYS   6 -23.711   4.391   2.010
   57   2HD   LYS   6          1HD       LYS   6 -24.895   3.088   1.893
   58   1HE   LYS   6          2HE       LYS   6 -26.240   4.138   3.314
   59   2HE   LYS   6          1HE       LYS   6 -24.965   4.177   4.531
   60   1HZ   LYS   6          1HZ       LYS   6 -25.746   6.234   2.590
   61   2HZ   LYS   6          2HZ       LYS   6 -24.132   6.167   3.089
   62   3HZ   LYS   6          3HZ       LYS   6 -25.360   6.393   4.229
   63    H    ALA   7           H        ALA   7 -22.397  -1.758   2.469
   64    HA   ALA   7           HA       ALA   7 -20.157  -1.480   4.237
   65   1HB   ALA   7          1HB       ALA   7 -20.185  -4.086   3.899
   66   2HB   ALA   7          2HB       ALA   7 -21.766  -3.756   3.192
   67   3HB   ALA   7          3HB       ALA   7 -21.429  -3.282   4.857
   68    H    ILE   8           H        ILE   8 -20.640  -2.541   0.908
   69    HA   ILE   8           HA       ILE   8 -17.990  -3.422   0.459
   70    HB   ILE   8           HB       ILE   8 -19.674  -4.166  -1.053
   71   1HG1  ILE   8          2HG1      ILE   8 -18.109  -2.162  -2.671
   72   2HG1  ILE   8          1HG1      ILE   8 -17.336  -3.560  -1.932
   73   1HG2  ILE   8          1HG2      ILE   8 -20.840  -2.557  -2.576
   74   2HG2  ILE   8          2HG2      ILE   8 -20.192  -1.249  -1.586
   75   3HG2  ILE   8          3HG2      ILE   8 -21.294  -2.429  -0.877
   76   1HD1  ILE   8          1HD1      ILE   8 -18.075  -4.924  -3.520
   77   2HD1  ILE   8          2HD1      ILE   8 -18.481  -3.465  -4.423
   78   3HD1  ILE   8          3HD1      ILE   8 -19.709  -4.267  -3.444
   79    H    LYS   9           H        LYS   9 -19.586  -0.304   0.123
   80    HA   LYS   9           HA       LYS   9 -17.495   1.013  -1.244
   81   1HB   LYS   9          2HB       LYS   9 -19.486   2.284   0.634
   82   2HB   LYS   9          1HB       LYS   9 -18.639   3.051  -0.703
   83   1HG   LYS   9          2HG       LYS   9 -20.333   0.718  -1.362
   84   2HG   LYS   9          1HG       LYS   9 -21.157   2.201  -0.875
   85   1HD   LYS   9          2HD       LYS   9 -19.182   1.875  -3.131
   86   2HD   LYS   9          1HD       LYS   9 -20.912   2.195  -3.270
   87   1HE   LYS   9          2HE       LYS   9 -19.839   4.186  -1.588
   88   2HE   LYS   9          1HE       LYS   9 -18.752   4.044  -2.969
   89   1HZ   LYS   9          1HZ       LYS   9 -21.647   4.664  -2.987
   90   2HZ   LYS   9          2HZ       LYS   9 -20.818   4.190  -4.383
   91   3HZ   LYS   9          3HZ       LYS   9 -20.373   5.609  -3.577
   92    H    THR  10           H        THR  10 -18.276   0.651   2.182
   93    HA   THR  10           HA       THR  10 -16.305   2.350   3.218
   94    HB   THR  10           HB       THR  10 -17.604  -0.116   4.382
   95    HG1  THR  10           1HG      THR  10 -19.154   1.247   4.660
   96   1HG2  THR  10          1HG2      THR  10 -16.000  -0.059   5.935
   97   2HG2  THR  10          2HG2      THR  10 -16.874   1.350   6.534
   98   3HG2  THR  10          3HG2      THR  10 -15.474   1.562   5.482
   99    H    VAL  11           H        VAL  11 -16.216  -1.060   2.339
  100    HA   VAL  11           HA       VAL  11 -13.613  -1.584   3.311
  101    HB   VAL  11           HB       VAL  11 -15.166  -2.966   1.119
  102   1HG1  VAL  11          1HG1      VAL  11 -12.748  -3.388   0.960
  103   2HG1  VAL  11          2HG1      VAL  11 -13.644  -4.834   1.423
  104   3HG1  VAL  11          3HG1      VAL  11 -12.744  -3.928   2.639
  105   1HG2  VAL  11          1HG2      VAL  11 -16.442  -3.339   2.984
  106   2HG2  VAL  11          2HG2      VAL  11 -15.067  -3.226   4.082
  107   3HG2  VAL  11          3HG2      VAL  11 -15.303  -4.679   3.112
  108    H    GLY  12           H        GLY  12 -14.858  -0.419   0.233
  109   1HA   GLY  12          2HA       GLY  12 -12.480  -0.623  -1.261
  110   2HA   GLY  12          1HA       GLY  12 -13.798   0.495  -1.590
  111    H    LYS  13           H        LYS  13 -13.571   1.688   1.102
  112    HA   LYS  13           HA       LYS  13 -11.554   3.643   0.448
  113   1HB   LYS  13          2HB       LYS  13 -13.070   3.603   3.035
  114   2HB   LYS  13          1HB       LYS  13 -12.500   4.984   2.108
  115   1HG   LYS  13          2HG       LYS  13 -14.286   3.684   0.418
  116   2HG   LYS  13          1HG       LYS  13 -15.038   3.626   2.013
  117   1HD   LYS  13          2HD       LYS  13 -15.752   5.639   0.942
  118   2HD   LYS  13          1HD       LYS  13 -14.611   6.082   2.213
  119   1HE   LYS  13          2HE       LYS  13 -13.618   7.297   0.609
  120   2HE   LYS  13          1HE       LYS  13 -12.950   5.753   0.082
  121   1HZ   LYS  13          1HZ       LYS  13 -14.184   5.773  -1.761
  122   2HZ   LYS  13          2HZ       LYS  13 -14.416   7.419  -1.454
  123   3HZ   LYS  13          3HZ       LYS  13 -15.579   6.296  -0.958
  124    H    ALA  14           H        ALA  14 -12.030   1.089   2.821
  125    HA   ALA  14           HA       ALA  14  -9.724   1.740   4.374
  126   1HB   ALA  14          1HB       ALA  14 -11.784   0.336   5.055
  127   2HB   ALA  14          2HB       ALA  14 -10.194  -0.159   5.637
  128   3HB   ALA  14          3HB       ALA  14 -10.935  -0.999   4.274
  129    H    VAL  15           H        VAL  15 -10.422  -0.833   2.030
  130    HA   VAL  15           HA       VAL  15  -7.744  -1.773   1.912
  131    HB   VAL  15           HB       VAL  15  -9.997  -2.104  -0.079
  132   1HG1  VAL  15          1HG1      VAL  15  -8.269  -4.250  -0.332
  133   2HG1  VAL  15          2HG1      VAL  15  -7.198  -2.857  -0.183
  134   3HG1  VAL  15          3HG1      VAL  15  -8.425  -2.893  -1.449
  135   1HG2  VAL  15          1HG2      VAL  15 -10.269  -3.010   2.292
  136   2HG2  VAL  15          2HG2      VAL  15  -8.985  -4.147   1.878
  137   3HG2  VAL  15          3HG2      VAL  15 -10.494  -4.150   0.964
  138    H    GLY  16           H        GLY  16  -9.477   0.814   0.428
  139   1HA   GLY  16          2HA       GLY  16  -7.785   1.195  -1.832
  140   2HA   GLY  16          1HA       GLY  16  -8.897   2.378  -1.156
  141    H    LYS  17           H        LYS  17  -7.705   2.291   1.503
  142    HA   LYS  17           HA       LYS  17  -5.658   4.240   1.079
  143   1HB   LYS  17          2HB       LYS  17  -6.361   2.888   3.685
  144   2HB   LYS  17          1HB       LYS  17  -5.581   4.448   3.469
  145   1HG   LYS  17          2HG       LYS  17  -8.095   4.459   2.114
  146   2HG   LYS  17          1HG       LYS  17  -8.320   3.904   3.774
  147   1HD   LYS  17          2HD       LYS  17  -6.912   6.438   2.932
  148   2HD   LYS  17          1HD       LYS  17  -8.539   6.336   3.606
  149   1HE   LYS  17          2HE       LYS  17  -6.168   5.237   5.079
  150   2HE   LYS  17          1HE       LYS  17  -6.595   6.945   5.179
  151   1HZ   LYS  17          1HZ       LYS  17  -8.172   6.467   6.638
  152   2HZ   LYS  17          2HZ       LYS  17  -7.664   4.854   6.645
  153   3HZ   LYS  17          3HZ       LYS  17  -8.889   5.349   5.590
  154    H    GLY  18           H        GLY  18  -5.684   1.000   2.539
  155   1HA   GLY  18          2HA       GLY  18  -2.888   0.827   2.902
  156   2HA   GLY  18          1HA       GLY  18  -3.997  -0.538   2.828
  157    H    LEU  19           H        LEU  19  -4.983   0.179   0.188
  158    HA   LEU  19           HA       LEU  19  -3.140  -1.274  -1.390
  159   1HB   LEU  19          2HB       LEU  19  -5.366  -1.470  -2.060
  160   2HB   LEU  19          1HB       LEU  19  -5.651   0.256  -1.951
  161    HG   LEU  19           HG       LEU  19  -3.696  -0.078  -3.951
  162   1HD1  LEU  19          1HD1      LEU  19  -4.558  -2.493  -3.860
  163   2HD1  LEU  19          2HD1      LEU  19  -4.493  -1.688  -5.428
  164   3HD1  LEU  19          3HD1      LEU  19  -6.032  -1.844  -4.580
  165   1HD2  LEU  19          1HD2      LEU  19  -5.129   1.674  -4.275
  166   2HD2  LEU  19          2HD2      LEU  19  -6.548   0.751  -3.780
  167   3HD2  LEU  19          3HD2      LEU  19  -5.841   0.493  -5.375
  168    H    ARG  20           H        ARG  20  -4.038   2.156  -1.293
  169    HA   ARG  20           HA       ARG  20  -2.324   3.009  -3.340
  170   1HB   ARG  20          2HB       ARG  20  -4.116   4.427  -2.492
  171   2HB   ARG  20          1HB       ARG  20  -3.328   4.524  -0.923
  172   1HG   ARG  20          2HG       ARG  20  -3.086   6.499  -2.537
  173   2HG   ARG  20          1HG       ARG  20  -1.640   5.909  -1.714
  174   1HD   ARG  20          2HD       ARG  20  -0.950   6.182  -3.925
  175   2HD   ARG  20          1HD       ARG  20  -1.286   4.459  -3.801
  176    HE   ARG  20           HE       ARG  20  -3.082   4.720  -5.228
  177   1HH1  ARG  20          1HH1      ARG  20  -1.805   7.825  -4.307
  178   2HH1  ARG  20          2HH1      ARG  20  -2.701   8.695  -5.507
  179   1HH2  ARG  20          1HH2      ARG  20  -4.267   5.853  -6.812
  180   2HH2  ARG  20          2HH2      ARG  20  -4.102   7.573  -6.933
  181    H    ALA  21           H        ALA  21  -1.765   2.228  -0.006
  182    HA   ALA  21           HA       ALA  21   0.827   3.474   0.128
  183   1HB   ALA  21          1HB       ALA  21  -0.152   3.342   2.223
  184   2HB   ALA  21          2HB       ALA  21   0.956   1.970   2.249
  185   3HB   ALA  21          3HB       ALA  21  -0.762   1.709   1.950
  186    H    ILE  22           H        ILE  22  -0.468   0.498  -0.977
  187    HA   ILE  22           HA       ILE  22   1.943  -1.038  -0.747
  188    HB   ILE  22           HB       ILE  22  -0.630  -1.462  -2.260
  189   1HG1  ILE  22          2HG1      ILE  22  -0.706  -1.835   0.155
  190   2HG1  ILE  22          1HG1      ILE  22  -0.866  -3.362  -0.707
  191   1HG2  ILE  22          1HG2      ILE  22   1.913  -3.043  -2.395
  192   2HG2  ILE  22          2HG2      ILE  22   0.886  -2.479  -3.712
  193   3HG2  ILE  22          3HG2      ILE  22   0.345  -3.799  -2.676
  194   1HD1  ILE  22          1HD1      ILE  22   0.881  -4.197   0.358
  195   2HD1  ILE  22          2HD1      ILE  22   0.930  -2.730   1.334
  196   3HD1  ILE  22          3HD1      ILE  22   1.894  -2.842  -0.139
  197    H    ASN  23           H        ASN  23   0.560   1.189  -3.004
  198    HA   ASN  23           HA       ASN  23   2.212   0.462  -5.229
  199   1HB   ASN  23          2HB       ASN  23   0.704   1.737  -6.274
  200   2HB   ASN  23          1HB       ASN  23   0.020   2.206  -4.737
  201   1HD2  ASN  23          1HD2      ASN  23   0.527   4.202  -3.878
  202   2HD2  ASN  23          2HD2      ASN  23   1.322   5.434  -4.789
  203    H    ILE  24           H        ILE  24   2.105   3.321  -3.178
  204    HA   ILE  24           HA       ILE  24   4.552   4.416  -3.948
  205    HB   ILE  24           HB       ILE  24   3.949   6.059  -2.559
  206   1HG1  ILE  24          2HG1      ILE  24   5.485   5.013  -0.914
  207   2HG1  ILE  24          1HG1      ILE  24   4.176   5.909  -0.149
  208   1HG2  ILE  24          1HG2      ILE  24   1.946   5.847  -1.083
  209   2HG2  ILE  24          2HG2      ILE  24   1.861   4.149  -1.550
  210   3HG2  ILE  24          3HG2      ILE  24   1.683   5.411  -2.770
  211   1HD1  ILE  24          1HD1      ILE  24   4.943   3.229   0.260
  212   2HD1  ILE  24          2HD1      ILE  24   3.348   3.214  -0.491
  213   3HD1  ILE  24          3HD1      ILE  24   3.610   4.114   1.002
  214    H    ALA  25           H        ALA  25   3.716   1.765  -1.942
  215    HA   ALA  25           HA       ALA  25   6.316   1.533  -0.742
  216   1HB   ALA  25          1HB       ALA  25   5.383  -0.665   0.099
  217   2HB   ALA  25          2HB       ALA  25   3.865  -0.205  -0.673
  218   3HB   ALA  25          3HB       ALA  25   4.532   0.789   0.622
  219    H    SER  26           H        SER  26   4.624   0.394  -3.531
  220    HA   SER  26           HA       SER  26   6.411  -1.788  -4.098
  221   1HB   SER  26          2HB       SER  26   4.027  -0.580  -5.342
  222   2HB   SER  26          1HB       SER  26   5.194  -1.243  -6.486
  223    HG   SER  26           HG       SER  26   3.743  -2.549  -4.462
  224    H    THR  27           H        THR  27   6.168   1.599  -4.899
  225    HA   THR  27           HA       THR  27   8.073   1.595  -7.012
  226    HB   THR  27           HB       THR  27   6.846   3.725  -5.287
  227    HG1  THR  27           1HG      THR  27   5.546   3.653  -6.915
  228   1HG2  THR  27          1HG2      THR  27   8.137   5.100  -7.288
  229   2HG2  THR  27          2HG2      THR  27   9.358   3.967  -6.709
  230   3HG2  THR  27          3HG2      THR  27   8.580   5.077  -5.581
  231    H    ALA  28           H        ALA  28   8.243   2.373  -3.560
  232    HA   ALA  28           HA       ALA  28  11.011   3.002  -3.556
  233   1HB   ALA  28          1HB       ALA  28   9.525   3.787  -1.796
  234   2HB   ALA  28          2HB       ALA  28  10.838   2.828  -1.113
  235   3HB   ALA  28          3HB       ALA  28   9.229   2.126  -1.282
  236    H    ASN  29           H        ASN  29   9.204   0.040  -3.341
  237    HA   ASN  29           HA       ASN  29  10.984  -1.685  -2.139
  238   1HB   ASN  29          2HB       ASN  29   8.720  -1.921  -3.938
  239   2HB   ASN  29          1HB       ASN  29   9.932  -3.156  -4.267
  240   1HD2  ASN  29          1HD2      ASN  29   8.456  -1.600  -1.436
  241   2HD2  ASN  29          2HD2      ASN  29   8.185  -3.066  -0.562
  242    H    ASP  30           H        ASP  30  10.719  -1.120  -5.640
  243    HA   ASP  30           HA       ASP  30  12.961  -2.536  -6.434
  244   1HB   ASP  30          2HB       ASP  30  11.182  -0.581  -7.600
  245   2HB   ASP  30          1HB       ASP  30  12.838  -0.283  -8.121
  246    H    VAL  31           H        VAL  31  12.672   0.759  -5.251
  247    HA   VAL  31           HA       VAL  31  15.250   1.682  -5.759
  248    HB   VAL  31           HB       VAL  31  13.593   2.349  -3.326
  249   1HG1  VAL  31          1HG1      VAL  31  16.061   3.401  -4.483
  250   2HG1  VAL  31          2HG1      VAL  31  15.406   3.570  -2.854
  251   3HG1  VAL  31          3HG1      VAL  31  14.847   4.634  -4.144
  252   1HG2  VAL  31          1HG2      VAL  31  12.115   2.711  -5.102
  253   2HG2  VAL  31          2HG2      VAL  31  13.393   3.298  -6.166
  254   3HG2  VAL  31          3HG2      VAL  31  12.840   4.293  -4.819
  255    H    PHE  32           H        PHE  32  13.962  -0.129  -3.018
  256    HA   PHE  32           HA       PHE  32  16.262  -0.107  -1.417
  257   1HB   PHE  32          2HB       PHE  32  13.700  -1.134  -1.210
  258   2HB   PHE  32          1HB       PHE  32  14.712  -2.573  -1.232
  259    HD1  PHE  32           1HD      PHE  32  14.582  -3.323   0.968
  260    HD2  PHE  32           2HD      PHE  32  15.517   0.754   0.187
  261    HE1  PHE  32           1HE      PHE  32  15.106  -2.992   3.350
  262    HE2  PHE  32           2HE      PHE  32  16.043   1.094   2.568
  263    HZ   PHE  32           HZ       PHE  32  15.838  -0.781   4.152
  264    H    ASN  33           H        ASN  33  15.159  -2.381  -3.885
  265    HA   ASN  33           HA       ASN  33  17.283  -4.227  -3.572
  266   1HB   ASN  33          2HB       ASN  33  15.079  -4.675  -4.718
  267   2HB   ASN  33          1HB       ASN  33  15.679  -3.743  -6.087
  268   1HD2  ASN  33          1HD2      ASN  33  15.786  -6.722  -4.397
  269   2HD2  ASN  33          2HD2      ASN  33  16.831  -7.560  -5.489
  270    H    PHE  34           H        PHE  34  17.041  -1.173  -5.111
  271    HA   PHE  34           HA       PHE  34  19.147  -1.513  -7.000
  272   1HB   PHE  34          2HB       PHE  34  17.284   0.538  -6.280
  273   2HB   PHE  34          1HB       PHE  34  18.903   1.229  -6.317
  274    HD1  PHE  34           1HD      PHE  34  18.944   2.500  -8.256
  275    HD2  PHE  34           2HD      PHE  34  17.470  -1.489  -8.403
  276    HE1  PHE  34           1HE      PHE  34  18.832   2.636 -10.710
  277    HE2  PHE  34           2HE      PHE  34  17.354  -1.361 -10.857
  278    HZ   PHE  34           HZ       PHE  34  18.036   0.703 -12.014
  279    H    LEU  35           H        LEU  35  18.947  -0.226  -3.722
  280    HA   LEU  35           HA       LEU  35  21.852   0.179  -3.707
  281   1HB   LEU  35          2HB       LEU  35  19.831   0.995  -1.620
  282   2HB   LEU  35          1HB       LEU  35  21.516   1.473  -1.690
  283    HG   LEU  35           HG       LEU  35  19.724   2.170  -3.977
  284   1HD1  LEU  35          1HD1      LEU  35  18.408   2.899  -2.122
  285   2HD1  LEU  35          2HD1      LEU  35  19.206   4.312  -2.812
  286   3HD1  LEU  35          3HD1      LEU  35  19.819   3.591  -1.324
  287   1HD2  LEU  35          1HD2      LEU  35  21.640   3.106  -4.605
  288   2HD2  LEU  35          2HD2      LEU  35  22.375   2.826  -3.026
  289   3HD2  LEU  35          3HD2      LEU  35  21.405   4.273  -3.304
  290    H    LYS  36           H        LYS  36  19.308  -1.752  -2.321
  291    HA   LYS  36           HA       LYS  36  19.322  -3.334  -0.639
  292   1HB   LYS  36          2HB       LYS  36  21.779  -4.266  -2.118
  293   2HB   LYS  36          1HB       LYS  36  20.587  -5.249  -1.279
  294   1HG   LYS  36          2HG       LYS  36  19.114  -3.863  -3.173
  295   2HG   LYS  36          1HG       LYS  36  20.609  -4.299  -4.005
  296   1HD   LYS  36          2HD       LYS  36  19.558  -6.473  -2.388
  297   2HD   LYS  36          1HD       LYS  36  18.412  -5.931  -3.616
  298   1HE   LYS  36          2HE       LYS  36  21.251  -6.344  -4.405
  299   2HE   LYS  36          1HE       LYS  36  20.240  -7.765  -4.141
  300   1HZ   LYS  36          1HZ       LYS  36  19.380  -5.547  -5.899
  301   2HZ   LYS  36          2HZ       LYS  36  18.792  -7.131  -5.842
  302   3HZ   LYS  36          3HZ       LYS  36  20.329  -6.823  -6.477
  303    HA   PRO  37           HA       PRO  37  22.909  -1.277   1.675
  304   1HB   PRO  37          2HB       PRO  37  20.716  -0.546   3.513
  305   2HB   PRO  37          1HB       PRO  37  22.019   0.454   2.863
  306   1HG   PRO  37          2HG       PRO  37  19.492   0.738   2.021
  307   2HG   PRO  37          1HG       PRO  37  20.866   0.925   0.915
  308   1HD   PRO  37          2HD       PRO  37  19.006  -1.397   1.254
  309   2HD   PRO  37          1HD       PRO  37  19.678  -0.698  -0.233
  310    H    LYS  38           H        LYS  38  23.774  -3.207   2.362
  311    HA   LYS  38           HA       LYS  38  22.482  -5.203   3.811
  312   1HB   LYS  38          2HB       LYS  38  25.400  -4.411   3.854
  313   2HB   LYS  38          1HB       LYS  38  24.762  -5.911   4.513
  314   1HG   LYS  38          2HG       LYS  38  24.053  -6.623   2.322
  315   2HG   LYS  38          1HG       LYS  38  24.557  -5.081   1.626
  316   1HD   LYS  38          2HD       LYS  38  26.791  -6.041   3.004
  317   2HD   LYS  38          1HD       LYS  38  26.116  -7.443   2.174
  318   1HE   LYS  38          2HE       LYS  38  26.682  -4.804   0.834
  319   2HE   LYS  38          1HE       LYS  38  27.812  -6.157   0.857
  320   1HZ   LYS  38          1HZ       LYS  38  26.313  -5.929  -1.157
  321   2HZ   LYS  38          2HZ       LYS  38  25.053  -6.459  -0.161
  322   3HZ   LYS  38          3HZ       LYS  38  26.390  -7.457  -0.435
  323    H    LYS  39           H        LYS  39  24.089  -2.273   4.887
  324    HA   LYS  39           HA       LYS  39  22.857  -2.608   7.515
  325   1HB   LYS  39          2HB       LYS  39  24.855  -2.183   8.729
  326   2HB   LYS  39          1HB       LYS  39  25.233  -3.462   7.583
  327   1HG   LYS  39          2HG       LYS  39  25.839  -1.105   6.237
  328   2HG   LYS  39          1HG       LYS  39  26.416  -0.852   7.886
  329   1HD   LYS  39          2HD       LYS  39  28.057  -2.375   7.673
  330   2HD   LYS  39          1HD       LYS  39  27.033  -3.495   6.773
  331   1HE   LYS  39          2HE       LYS  39  27.299  -1.969   4.789
  332   2HE   LYS  39          1HE       LYS  39  28.519  -1.098   5.718
  333   1HZ   LYS  39          1HZ       LYS  39  29.299  -3.684   5.936
  334   2HZ   LYS  39          2HZ       LYS  39  29.939  -2.558   4.848
  335   3HZ   LYS  39          3HZ       LYS  39  28.716  -3.614   4.349
  336    H    ARG  40           H        ARG  40  22.378  -0.909   5.164
  337    HA   ARG  40           HA       ARG  40  21.863   1.248   4.661
  338   1HB   ARG  40          2HB       ARG  40  21.986   1.510   7.670
  339   2HB   ARG  40          1HB       ARG  40  21.348   2.744   6.591
  340   1HG   ARG  40          2HG       ARG  40  20.213   0.017   6.368
  341   2HG   ARG  40          1HG       ARG  40  19.797   0.966   7.796
  342   1HD   ARG  40          2HD       ARG  40  19.349   2.839   5.995
  343   2HD   ARG  40          1HD       ARG  40  19.148   1.449   4.930
  344    HE   ARG  40           HE       ARG  40  17.551   0.770   6.941
  345   1HH1  ARG  40          1HH1      ARG  40  17.917   3.810   5.284
  346   2HH1  ARG  40          2HH1      ARG  40  16.269   4.288   5.522
  347   1HH2  ARG  40          1HH2      ARG  40  15.376   1.388   7.258
  348   2HH2  ARG  40          2HH2      ARG  40  14.825   2.912   6.646
  349    H    LYS  41           H        LYS  41  22.616   3.633   5.069
  350    HA   LYS  41           HA       LYS  41  24.288   5.169   4.906
  351   1HB   LYS  41          2HB       LYS  41  26.077   3.333   6.477
  352   2HB   LYS  41          1HB       LYS  41  26.067   5.091   6.445
  353   1HG   LYS  41          2HG       LYS  41  23.610   3.776   7.421
  354   2HG   LYS  41          1HG       LYS  41  25.041   3.654   8.446
  355   1HD   LYS  41          2HD       LYS  41  24.858   6.330   7.523
  356   2HD   LYS  41          1HD       LYS  41  23.266   5.854   8.119
  357   1HE   LYS  41          2HE       LYS  41  23.957   6.021  10.223
  358   2HE   LYS  41          1HE       LYS  41  25.287   4.906   9.912
  359   1HZ   LYS  41          1HZ       LYS  41  25.933   7.385   8.784
  360   2HZ   LYS  41          2HZ       LYS  41  26.687   6.594  10.075
  361   3HZ   LYS  41          3HZ       LYS  41  25.409   7.663  10.368
  362    H    ALA  42           H        ALA  42  26.094   5.647   3.624
  363    HA   ALA  42           HA       ALA  42  27.351   5.365   1.734
  364   1HB   ALA  42          1HB       ALA  42  29.229   4.062   2.055
  365   2HB   ALA  42          2HB       ALA  42  28.331   2.784   2.874
  366   3HB   ALA  42          3HB       ALA  42  28.671   4.299   3.711
  Start of MODEL   18
    1   1H    ALA   1          1HT       ALA   1  32.879  -6.552   1.071
    2   2H    ALA   1          2HT       ALA   1  31.628  -7.721   1.187
    3   3H    ALA   1          3HT       ALA   1  33.035  -7.869   2.158
    4    HA   ALA   1           HA       ALA   1  32.336  -6.459   3.654
    5   1HB   ALA   1          1HB       ALA   1  32.535  -4.659   1.834
    6   2HB   ALA   1          2HB       ALA   1  31.493  -4.328   3.217
    7   3HB   ALA   1          3HB       ALA   1  30.785  -4.820   1.679
    8    H    LYS   2           H        LYS   2  30.060  -5.516   4.451
    9    HA   LYS   2           HA       LYS   2  28.329  -7.783   4.566
   10   1HB   LYS   2          2HB       LYS   2  27.802  -4.982   5.573
   11   2HB   LYS   2          1HB       LYS   2  27.001  -6.459   6.094
   12   1HG   LYS   2          2HG       LYS   2  29.009  -7.261   7.120
   13   2HG   LYS   2          1HG       LYS   2  29.937  -5.914   6.457
   14   1HD   LYS   2          2HD       LYS   2  27.737  -4.827   7.875
   15   2HD   LYS   2          1HD       LYS   2  28.486  -6.049   8.905
   16   1HE   LYS   2          2HE       LYS   2  29.616  -3.511   7.831
   17   2HE   LYS   2          1HE       LYS   2  29.721  -4.190   9.454
   18   1HZ   LYS   2          1HZ       LYS   2  31.799  -4.673   8.781
   19   2HZ   LYS   2          2HZ       LYS   2  31.407  -4.660   7.136
   20   3HZ   LYS   2          3HZ       LYS   2  31.059  -6.022   8.076
   21    H    ILE   3           H        ILE   3  25.875  -6.002   4.697
   22    HA   ILE   3           HA       ILE   3  25.495  -5.596   1.809
   23    HB   ILE   3           HB       ILE   3  23.238  -6.593   3.497
   24   1HG1  ILE   3          2HG1      ILE   3  25.266  -8.109   3.765
   25   2HG1  ILE   3          1HG1      ILE   3  23.807  -8.871   3.140
   26   1HG2  ILE   3          1HG2      ILE   3  23.902  -7.024   0.589
   27   2HG2  ILE   3          2HG2      ILE   3  22.891  -5.713   1.197
   28   3HG2  ILE   3          3HG2      ILE   3  22.380  -7.388   1.404
   29   1HD1  ILE   3          1HD1      ILE   3  25.659  -9.681   1.893
   30   2HD1  ILE   3          2HD1      ILE   3  26.244  -8.045   1.590
   31   3HD1  ILE   3          3HD1      ILE   3  24.742  -8.596   0.847
   32    HA   PRO   4           HA       PRO   4  24.230  -1.975   4.762
   33   1HB   PRO   4          2HB       PRO   4  25.944  -0.646   2.711
   34   2HB   PRO   4          1HB       PRO   4  25.785  -0.302   4.438
   35   1HG   PRO   4          2HG       PRO   4  27.908  -1.609   3.501
   36   2HG   PRO   4          1HG       PRO   4  27.171  -2.054   5.050
   37   1HD   PRO   4          2HD       PRO   4  27.034  -3.441   2.419
   38   2HD   PRO   4          1HD       PRO   4  27.021  -4.115   4.060
   39    H    ILE   5           H        ILE   5  24.394  -2.632   1.322
   40    HA   ILE   5           HA       ILE   5  22.741  -0.570   0.395
   41    HB   ILE   5           HB       ILE   5  22.628  -1.700  -1.634
   42   1HG1  ILE   5          2HG1      ILE   5  23.296  -4.270  -1.597
   43   2HG1  ILE   5          1HG1      ILE   5  22.682  -4.164   0.050
   44   1HG2  ILE   5          1HG2      ILE   5  24.816  -1.910  -2.090
   45   2HG2  ILE   5          2HG2      ILE   5  25.064  -3.131  -0.842
   46   3HG2  ILE   5          3HG2      ILE   5  25.020  -1.423  -0.407
   47   1HD1  ILE   5          1HD1      ILE   5  21.244  -3.941  -2.533
   48   2HD1  ILE   5          2HD1      ILE   5  20.637  -3.025  -1.154
   49   3HD1  ILE   5          3HD1      ILE   5  20.790  -4.778  -1.049
   50    H    LYS   6           H        LYS   6  22.006  -3.724   1.755
   51    HA   LYS   6           HA       LYS   6  19.224  -3.646   1.114
   52   1HB   LYS   6          2HB       LYS   6  19.832  -5.819   1.473
   53   2HB   LYS   6          1HB       LYS   6  21.028  -5.398   2.688
   54   1HG   LYS   6          2HG       LYS   6  18.267  -4.923   3.530
   55   2HG   LYS   6          1HG       LYS   6  18.639  -6.611   3.175
   56   1HD   LYS   6          2HD       LYS   6  20.228  -6.752   4.844
   57   2HD   LYS   6          1HD       LYS   6  20.527  -5.013   4.848
   58   1HE   LYS   6          2HE       LYS   6  17.846  -5.288   5.557
   59   2HE   LYS   6          1HE       LYS   6  18.680  -6.572   6.431
   60   1HZ   LYS   6          1HZ       LYS   6  18.637  -3.810   6.980
   61   2HZ   LYS   6          2HZ       LYS   6  20.232  -4.278   6.665
   62   3HZ   LYS   6          3HZ       LYS   6  19.347  -5.056   7.879
   63    H    ALA   7           H        ALA   7  21.204  -2.377   3.644
   64    HA   ALA   7           HA       ALA   7  19.154  -2.021   5.586
   65   1HB   ALA   7          1HB       ALA   7  20.904  -1.532   6.860
   66   2HB   ALA   7          2HB       ALA   7  21.210  -0.076   5.913
   67   3HB   ALA   7          3HB       ALA   7  21.947  -1.608   5.440
   68    H    ILE   8           H        ILE   8  20.493  -0.004   3.022
   69    HA   ILE   8           HA       ILE   8  18.987   2.319   3.736
   70    HB   ILE   8           HB       ILE   8  21.142   2.217   2.322
   71   1HG1  ILE   8          2HG1      ILE   8  19.522   4.012   0.773
   72   2HG1  ILE   8          1HG1      ILE   8  18.993   4.050   2.453
   73   1HG2  ILE   8          1HG2      ILE   8  21.078   1.663   0.120
   74   2HG2  ILE   8          2HG2      ILE   8  19.396   2.156  -0.069
   75   3HG2  ILE   8          3HG2      ILE   8  19.782   0.615   0.692
   76   1HD1  ILE   8          1HD1      ILE   8  20.601   5.610   2.610
   77   2HD1  ILE   8          2HD1      ILE   8  21.500   4.981   1.229
   78   3HD1  ILE   8          3HD1      ILE   8  21.646   4.203   2.806
   79    H    LYS   9           H        LYS   9  18.509  -0.409   1.586
   80    HA   LYS   9           HA       LYS   9  16.247   0.656   0.234
   81   1HB   LYS   9          2HB       LYS   9  16.914  -2.263   0.610
   82   2HB   LYS   9          1HB       LYS   9  15.967  -1.538  -0.683
   83   1HG   LYS   9          2HG       LYS   9  18.636  -0.415  -0.514
   84   2HG   LYS   9          1HG       LYS   9  18.650  -2.161  -0.769
   85   1HD   LYS   9          2HD       LYS   9  17.199  -0.109  -2.438
   86   2HD   LYS   9          1HD       LYS   9  18.641  -1.015  -2.903
   87   1HE   LYS   9          2HE       LYS   9  17.069  -3.069  -2.313
   88   2HE   LYS   9          1HE       LYS   9  15.813  -1.897  -2.712
   89   1HZ   LYS   9          1HZ       LYS   9  17.971  -2.930  -4.449
   90   2HZ   LYS   9          2HZ       LYS   9  17.134  -1.508  -4.825
   91   3HZ   LYS   9          3HZ       LYS   9  16.299  -2.975  -4.709
   92    H    THR  10           H        THR  10  16.711  -1.250   3.150
   93    HA   THR  10           HA       THR  10  13.982  -1.919   3.539
   94    HB   THR  10           HB       THR  10  16.291  -1.724   5.480
   95    HG1  THR  10           1HG      THR  10  15.365  -3.632   3.754
   96   1HG2  THR  10          1HG2      THR  10  15.016  -2.271   7.207
   97   2HG2  THR  10          2HG2      THR  10  14.126  -3.472   6.270
   98   3HG2  THR  10          3HG2      THR  10  13.640  -1.777   6.222
   99    H    VAL  11           H        VAL  11  16.030   0.698   4.751
  100    HA   VAL  11           HA       VAL  11  13.988   1.935   6.290
  101    HB   VAL  11           HB       VAL  11  15.529   3.898   6.290
  102   1HG1  VAL  11          1HG1      VAL  11  15.951   2.610   8.117
  103   2HG1  VAL  11          2HG1      VAL  11  17.500   2.435   7.294
  104   3HG1  VAL  11          3HG1      VAL  11  16.281   1.167   7.158
  105   1HG2  VAL  11          1HG2      VAL  11  17.762   3.632   5.317
  106   2HG2  VAL  11          2HG2      VAL  11  16.506   3.598   4.079
  107   3HG2  VAL  11          3HG2      VAL  11  17.264   2.096   4.608
  108    H    GLY  12           H        GLY  12  15.348   2.495   3.076
  109   1HA   GLY  12          2HA       GLY  12  13.743   4.747   2.450
  110   2HA   GLY  12          1HA       GLY  12  14.586   3.727   1.290
  111    H    LYS  13           H        LYS  13  13.193   1.321   2.372
  112    HA   LYS  13           HA       LYS  13  10.837   1.536   0.701
  113   1HB   LYS  13          2HB       LYS  13  12.286  -0.708   2.056
  114   2HB   LYS  13          1HB       LYS  13  10.624  -0.949   1.537
  115   1HG   LYS  13          2HG       LYS  13  13.041  -0.376  -0.141
  116   2HG   LYS  13          1HG       LYS  13  11.931  -1.746  -0.228
  117   1HD   LYS  13          2HD       LYS  13  10.150   0.066  -0.772
  118   2HD   LYS  13          1HD       LYS  13  11.546   1.068  -1.173
  119   1HE   LYS  13          2HE       LYS  13  12.241  -1.079  -2.548
  120   2HE   LYS  13          1HE       LYS  13  10.503  -1.374  -2.515
  121   1HZ   LYS  13          1HZ       LYS  13  11.701   1.182  -3.424
  122   2HZ   LYS  13          2HZ       LYS  13  10.096   0.679  -3.596
  123   3HZ   LYS  13          3HZ       LYS  13  11.322  -0.090  -4.473
  124    H    ALA  14           H        ALA  14  11.647   1.743   4.024
  125    HA   ALA  14           HA       ALA  14   9.135   0.938   5.102
  126   1HB   ALA  14          1HB       ALA  14  11.653   1.922   6.110
  127   2HB   ALA  14          2HB       ALA  14  10.431   0.935   6.912
  128   3HB   ALA  14          3HB       ALA  14  10.294   2.693   6.928
  129    H    VAL  15           H        VAL  15  10.583   4.077   4.340
  130    HA   VAL  15           HA       VAL  15   8.293   5.581   5.141
  131    HB   VAL  15           HB       VAL  15  10.453   6.468   3.224
  132   1HG1  VAL  15          1HG1      VAL  15   9.782   8.637   3.631
  133   2HG1  VAL  15          2HG1      VAL  15   9.010   8.224   5.162
  134   3HG1  VAL  15          3HG1      VAL  15   8.241   7.779   3.638
  135   1HG2  VAL  15          1HG2      VAL  15  10.736   7.325   5.992
  136   2HG2  VAL  15          2HG2      VAL  15  11.938   6.667   4.881
  137   3HG2  VAL  15          3HG2      VAL  15  10.891   5.579   5.794
  138    H    GLY  16           H        GLY  16   9.550   4.382   2.072
  139   1HA   GLY  16          2HA       GLY  16   7.520   5.559   0.458
  140   2HA   GLY  16          1HA       GLY  16   8.608   4.265  -0.025
  141    H    LYS  17           H        LYS  17   7.794   2.549   2.228
  142    HA   LYS  17           HA       LYS  17   5.610   1.246   0.939
  143   1HB   LYS  17          2HB       LYS  17   7.117  -0.193   2.029
  144   2HB   LYS  17          1HB       LYS  17   7.116   0.773   3.498
  145   1HG   LYS  17          2HG       LYS  17   4.477  -0.242   2.860
  146   2HG   LYS  17          1HG       LYS  17   5.668  -1.531   3.044
  147   1HD   LYS  17          2HD       LYS  17   6.068  -1.032   5.251
  148   2HD   LYS  17          1HD       LYS  17   5.608   0.661   5.062
  149   1HE   LYS  17          2HE       LYS  17   3.911  -0.378   6.358
  150   2HE   LYS  17          1HE       LYS  17   3.243  -0.123   4.746
  151   1HZ   LYS  17          1HZ       LYS  17   4.541  -2.678   5.135
  152   2HZ   LYS  17          2HZ       LYS  17   3.069  -2.314   4.385
  153   3HZ   LYS  17          3HZ       LYS  17   3.149  -2.448   6.069
  154    H    GLY  18           H        GLY  18   5.950   3.354   3.727
  155   1HA   GLY  18          2HA       GLY  18   3.392   2.970   4.842
  156   2HA   GLY  18          1HA       GLY  18   4.385   4.408   5.039
  157    H    LEU  19           H        LEU  19   4.554   5.521   2.646
  158    HA   LEU  19           HA       LEU  19   1.941   6.591   2.231
  159   1HB   LEU  19          2HB       LEU  19   2.945   8.159   0.864
  160   2HB   LEU  19          1HB       LEU  19   4.252   7.731   1.951
  161    HG   LEU  19           HG       LEU  19   4.849   6.011   0.040
  162   1HD1  LEU  19          1HD1      LEU  19   3.927   8.126  -1.788
  163   2HD1  LEU  19          2HD1      LEU  19   2.672   7.072  -1.137
  164   3HD1  LEU  19          3HD1      LEU  19   4.031   6.381  -2.024
  165   1HD2  LEU  19          1HD2      LEU  19   6.401   7.660   0.735
  166   2HD2  LEU  19          2HD2      LEU  19   5.426   8.964   0.058
  167   3HD2  LEU  19          3HD2      LEU  19   6.246   7.827  -1.013
  168    H    ARG  20           H        ARG  20   4.032   4.355   0.487
  169    HA   ARG  20           HA       ARG  20   2.503   4.136  -1.858
  170   1HB   ARG  20          2HB       ARG  20   4.815   3.285  -1.627
  171   2HB   ARG  20          1HB       ARG  20   4.229   2.022  -0.552
  172   1HG   ARG  20          2HG       ARG  20   4.649   1.533  -3.078
  173   2HG   ARG  20          1HG       ARG  20   3.253   0.837  -2.253
  174   1HD   ARG  20          2HD       ARG  20   2.476   1.691  -4.327
  175   2HD   ARG  20          1HD       ARG  20   1.918   2.798  -3.075
  176    HE   ARG  20           HE       ARG  20   4.156   4.002  -3.814
  177   1HH1  ARG  20          1HH1      ARG  20   1.663   2.550  -5.770
  178   2HH1  ARG  20          2HH1      ARG  20   1.901   3.631  -7.102
  179   1HH2  ARG  20          1HH2      ARG  20   4.468   5.434  -5.560
  180   2HH2  ARG  20          2HH2      ARG  20   3.491   5.272  -6.981
  181    H    ALA  21           H        ALA  21   2.293   2.526   1.261
  182    HA   ALA  21           HA       ALA  21   0.372   0.589   0.521
  183   1HB   ALA  21          1HB       ALA  21   1.477   1.635   3.049
  184   2HB   ALA  21          2HB       ALA  21   1.226  -0.029   2.522
  185   3HB   ALA  21          3HB       ALA  21  -0.128   0.911   3.149
  186    H    ILE  22           H        ILE  22   0.136   3.893   1.719
  187    HA   ILE  22           HA       ILE  22  -2.689   3.896   2.033
  188    HB   ILE  22           HB       ILE  22  -0.697   6.135   1.665
  189   1HG1  ILE  22          2HG1      ILE  22  -2.377   5.468   4.079
  190   2HG1  ILE  22          1HG1      ILE  22  -0.794   4.747   3.809
  191   1HG2  ILE  22          1HG2      ILE  22  -2.828   7.432   2.612
  192   2HG2  ILE  22          2HG2      ILE  22  -3.653   6.194   1.665
  193   3HG2  ILE  22          3HG2      ILE  22  -2.495   7.273   0.887
  194   1HD1  ILE  22          1HD1      ILE  22  -1.471   7.623   4.312
  195   2HD1  ILE  22          2HD1      ILE  22   0.091   7.119   3.665
  196   3HD1  ILE  22          3HD1      ILE  22  -0.431   6.553   5.252
  197    H    ASN  23           H        ASN  23  -0.596   3.953  -0.629
  198    HA   ASN  23           HA       ASN  23  -2.301   5.318  -2.463
  199   1HB   ASN  23          2HB       ASN  23  -0.409   5.346  -3.646
  200   2HB   ASN  23          1HB       ASN  23   0.357   4.366  -2.419
  201   1HD2  ASN  23          1HD2      ASN  23  -0.841   4.514  -5.603
  202   2HD2  ASN  23          2HD2      ASN  23  -0.475   2.890  -6.064
  203    H    ILE  24           H        ILE  24  -1.226   1.956  -2.348
  204    HA   ILE  24           HA       ILE  24  -3.029   0.878  -4.126
  205    HB   ILE  24           HB       ILE  24  -2.787  -1.251  -2.781
  206   1HG1  ILE  24          2HG1      ILE  24  -0.820  -1.053  -1.093
  207   2HG1  ILE  24          1HG1      ILE  24  -1.264   0.649  -1.027
  208   1HG2  ILE  24          1HG2      ILE  24  -0.024  -0.340  -3.137
  209   2HG2  ILE  24          2HG2      ILE  24  -1.083  -0.057  -4.519
  210   3HG2  ILE  24          3HG2      ILE  24  -0.881  -1.690  -3.882
  211   1HD1  ILE  24          1HD1      ILE  24  -2.255  -1.158   0.635
  212   2HD1  ILE  24          2HD1      ILE  24  -3.433  -1.323  -0.667
  213   3HD1  ILE  24          3HD1      ILE  24  -3.180   0.243   0.100
  214    H    ALA  25           H        ALA  25  -3.419   2.044  -0.916
  215    HA   ALA  25           HA       ALA  25  -5.990   0.811  -0.543
  216   1HB   ALA  25          1HB       ALA  25  -5.496   1.125   1.601
  217   2HB   ALA  25          2HB       ALA  25  -5.572   2.870   1.357
  218   3HB   ALA  25          3HB       ALA  25  -4.045   2.015   1.143
  219    H    SER  26           H        SER  26  -4.634   3.817  -1.621
  220    HA   SER  26           HA       SER  26  -7.104   5.292  -1.474
  221   1HB   SER  26          2HB       SER  26  -4.351   5.831  -2.519
  222   2HB   SER  26          1HB       SER  26  -5.682   6.851  -3.066
  223    HG   SER  26           HG       SER  26  -5.669   6.432  -0.361
  224    H    THR  27           H        THR  27  -5.584   3.157  -3.691
  225    HA   THR  27           HA       THR  27  -7.023   4.046  -6.017
  226    HB   THR  27           HB       THR  27  -5.405   1.547  -5.491
  227    HG1  THR  27           1HG      THR  27  -3.869   2.633  -6.765
  228   1HG2  THR  27          1HG2      THR  27  -5.290   1.596  -8.076
  229   2HG2  THR  27          2HG2      THR  27  -6.812   2.480  -7.949
  230   3HG2  THR  27          3HG2      THR  27  -6.677   0.854  -7.277
  231    H    ALA  28           H        ALA  28  -7.219   1.284  -3.797
  232    HA   ALA  28           HA       ALA  28  -9.513   0.144  -5.050
  233   1HB   ALA  28          1HB       ALA  28  -8.930  -1.564  -3.755
  234   2HB   ALA  28          2HB       ALA  28  -9.392  -0.643  -2.324
  235   3HB   ALA  28          3HB       ALA  28  -7.742  -0.548  -2.939
  236    H    ASN  29           H        ASN  29  -9.026   2.719  -2.838
  237    HA   ASN  29           HA       ASN  29 -11.616   2.684  -1.633
  238   1HB   ASN  29          2HB       ASN  29  -9.309   4.574  -1.688
  239   2HB   ASN  29          1HB       ASN  29 -10.880   5.192  -1.188
  240   1HD2  ASN  29          1HD2      ASN  29  -8.528   4.989   0.407
  241   2HD2  ASN  29          2HD2      ASN  29  -8.887   3.927   1.721
  242    H    ASP  30           H        ASP  30 -10.203   5.199  -3.695
  243    HA   ASP  30           HA       ASP  30 -12.424   6.540  -4.450
  244   1HB   ASP  30          2HB       ASP  30  -9.941   5.840  -5.982
  245   2HB   ASP  30          1HB       ASP  30 -11.224   6.767  -6.754
  246    H    VAL  31           H        VAL  31 -11.338   3.439  -5.675
  247    HA   VAL  31           HA       VAL  31 -13.259   3.209  -7.756
  248    HB   VAL  31           HB       VAL  31 -11.539   1.196  -6.321
  249   1HG1  VAL  31          1HG1      VAL  31 -13.902   0.699  -7.924
  250   2HG1  VAL  31          2HG1      VAL  31 -12.939  -0.414  -6.953
  251   3HG1  VAL  31          3HG1      VAL  31 -12.461  -0.049  -8.610
  252   1HG2  VAL  31          1HG2      VAL  31 -10.937   1.135  -8.990
  253   2HG2  VAL  31          2HG2      VAL  31 -10.068   2.061  -7.766
  254   3HG2  VAL  31          3HG2      VAL  31 -11.329   2.834  -8.728
  255    H    PHE  32           H        PHE  32 -13.028   1.619  -4.587
  256    HA   PHE  32           HA       PHE  32 -15.475   0.339  -4.584
  257   1HB   PHE  32          2HB       PHE  32 -14.595  -0.350  -2.643
  258   2HB   PHE  32          1HB       PHE  32 -13.436   0.970  -2.661
  259    HD1  PHE  32           1HD      PHE  32 -14.132   3.187  -1.659
  260    HD2  PHE  32           2HD      PHE  32 -16.351  -0.401  -1.103
  261    HE1  PHE  32           1HE      PHE  32 -15.235   4.177   0.306
  262    HE2  PHE  32           2HE      PHE  32 -17.459   0.583   0.862
  263    HZ   PHE  32           HZ       PHE  32 -16.902   2.875   1.568
  264    H    ASN  33           H        ASN  33 -14.721   3.696  -4.009
  265    HA   ASN  33           HA       ASN  33 -17.342   4.364  -3.021
  266   1HB   ASN  33          2HB       ASN  33 -14.788   5.720  -3.378
  267   2HB   ASN  33          1HB       ASN  33 -16.147   6.730  -3.861
  268   1HD2  ASN  33          1HD2      ASN  33 -14.216   6.610  -1.495
  269   2HD2  ASN  33          2HD2      ASN  33 -15.252   6.769  -0.122
  270    H    PHE  34           H        PHE  34 -15.730   4.224  -6.094
  271    HA   PHE  34           HA       PHE  34 -17.648   5.826  -7.504
  272   1HB   PHE  34          2HB       PHE  34 -15.529   3.901  -8.486
  273   2HB   PHE  34          1HB       PHE  34 -16.515   4.911  -9.540
  274    HD1  PHE  34           1HD      PHE  34 -16.435   7.241  -7.380
  275    HD2  PHE  34           2HD      PHE  34 -13.502   4.914  -9.405
  276    HE1  PHE  34           1HE      PHE  34 -14.815   9.077  -7.136
  277    HE2  PHE  34           2HE      PHE  34 -11.877   6.746  -9.164
  278    HZ   PHE  34           HZ       PHE  34 -12.533   8.830  -8.028
  279    H    LEU  35           H        LEU  35 -17.305   2.478  -6.652
  280    HA   LEU  35           HA       LEU  35 -19.680   1.810  -8.255
  281   1HB   LEU  35          2HB       LEU  35 -18.010  -0.309  -7.006
  282   2HB   LEU  35          1HB       LEU  35 -18.911  -0.339  -8.509
  283    HG   LEU  35           HG       LEU  35 -16.366   1.237  -8.150
  284   1HD1  LEU  35          1HD1      LEU  35 -15.715  -1.006  -7.818
  285   2HD1  LEU  35          2HD1      LEU  35 -15.359  -0.640  -9.506
  286   3HD1  LEU  35          3HD1      LEU  35 -16.789  -1.585  -9.092
  287   1HD2  LEU  35          1HD2      LEU  35 -18.181   1.639 -10.017
  288   2HD2  LEU  35          2HD2      LEU  35 -17.404   0.236 -10.750
  289   3HD2  LEU  35          3HD2      LEU  35 -16.458   1.680 -10.390
  290    H    LYS  36           H        LYS  36 -18.165   0.641  -5.260
  291    HA   LYS  36           HA       LYS  36 -19.003   0.198  -3.192
  292   1HB   LYS  36          2HB       LYS  36 -20.262   2.557  -3.991
  293   2HB   LYS  36          1HB       LYS  36 -21.567   1.534  -3.407
  294   1HG   LYS  36          2HG       LYS  36 -21.045   2.165  -1.353
  295   2HG   LYS  36          1HG       LYS  36 -19.533   1.270  -1.518
  296   1HD   LYS  36          2HD       LYS  36 -18.308   3.143  -1.771
  297   2HD   LYS  36          1HD       LYS  36 -19.538   3.932  -2.762
  298   1HE   LYS  36          2HE       LYS  36 -20.562   3.674  -0.127
  299   2HE   LYS  36          1HE       LYS  36 -18.934   4.341  -0.013
  300   1HZ   LYS  36          1HZ       LYS  36 -20.914   5.929  -0.324
  301   2HZ   LYS  36          2HZ       LYS  36 -20.862   5.451  -1.946
  302   3HZ   LYS  36          3HZ       LYS  36 -19.515   6.191  -1.240
  303    HA   PRO  37           HA       PRO  37 -21.505  -3.249  -4.872
  304   1HB   PRO  37          2HB       PRO  37 -20.325  -4.575  -2.510
  305   2HB   PRO  37          1HB       PRO  37 -20.325  -5.084  -4.201
  306   1HG   PRO  37          2HG       PRO  37 -18.103  -4.165  -3.021
  307   2HG   PRO  37          1HG       PRO  37 -18.463  -3.819  -4.722
  308   1HD   PRO  37          2HD       PRO  37 -18.763  -2.056  -2.322
  309   2HD   PRO  37          1HD       PRO  37 -18.198  -1.651  -3.957
  310    H    LYS  38           H        LYS  38 -23.215  -4.537  -3.881
  311    HA   LYS  38           HA       LYS  38 -24.869  -3.012  -2.188
  312   1HB   LYS  38          2HB       LYS  38 -26.153  -5.263  -2.029
  313   2HB   LYS  38          1HB       LYS  38 -26.041  -4.449  -3.583
  314   1HG   LYS  38          2HG       LYS  38 -24.457  -5.969  -4.394
  315   2HG   LYS  38          1HG       LYS  38 -24.093  -6.582  -2.779
  316   1HD   LYS  38          2HD       LYS  38 -25.868  -7.982  -2.769
  317   2HD   LYS  38          1HD       LYS  38 -26.897  -6.849  -3.648
  318   1HE   LYS  38          2HE       LYS  38 -24.866  -8.773  -4.734
  319   2HE   LYS  38          1HE       LYS  38 -26.582  -8.652  -5.118
  320   1HZ   LYS  38          1HZ       LYS  38 -24.338  -7.156  -6.180
  321   2HZ   LYS  38          2HZ       LYS  38 -25.722  -6.239  -5.856
  322   3HZ   LYS  38          3HZ       LYS  38 -25.812  -7.562  -6.906
  323    H    LYS  39           H        LYS  39 -23.197  -2.665  -0.483
  324    HA   LYS  39           HA       LYS  39 -22.109  -3.215   1.482
  325   1HB   LYS  39          2HB       LYS  39 -25.037  -3.637   1.771
  326   2HB   LYS  39          1HB       LYS  39 -24.016  -4.163   3.102
  327   1HG   LYS  39          2HG       LYS  39 -24.556  -2.008   3.709
  328   2HG   LYS  39          1HG       LYS  39 -22.986  -1.797   2.931
  329   1HD   LYS  39          2HD       LYS  39 -23.965  -0.260   1.641
  330   2HD   LYS  39          1HD       LYS  39 -24.806  -1.594   0.848
  331   1HE   LYS  39          2HE       LYS  39 -26.300  -1.174   3.121
  332   2HE   LYS  39          1HE       LYS  39 -25.826   0.457   2.651
  333   1HZ   LYS  39          1HZ       LYS  39 -27.220   0.417   0.936
  334   2HZ   LYS  39          2HZ       LYS  39 -27.894  -0.982   1.607
  335   3HZ   LYS  39          3HZ       LYS  39 -26.695  -1.108   0.421
  336    H    ARG  40           H        ARG  40 -20.664  -4.844   1.005
  337    HA   ARG  40           HA       ARG  40 -21.610  -7.596   1.457
  338   1HB   ARG  40          2HB       ARG  40 -19.422  -6.475  -0.267
  339   2HB   ARG  40          1HB       ARG  40 -19.366  -8.149   0.267
  340   1HG   ARG  40          2HG       ARG  40 -21.940  -7.830  -0.716
  341   2HG   ARG  40          1HG       ARG  40 -20.920  -6.930  -1.841
  342   1HD   ARG  40          2HD       ARG  40 -19.603  -8.834  -2.319
  343   2HD   ARG  40          1HD       ARG  40 -20.272  -9.730  -0.956
  344    HE   ARG  40           HE       ARG  40 -22.096 -10.280  -2.244
  345   1HH1  ARG  40          1HH1      ARG  40 -20.235  -7.804  -3.837
  346   2HH1  ARG  40          2HH1      ARG  40 -21.098  -7.935  -5.333
  347   1HH2  ARG  40          1HH2      ARG  40 -23.242 -10.461  -4.208
  348   2HH2  ARG  40          2HH2      ARG  40 -22.812  -9.444  -5.543
  349    H    LYS  41           H        LYS  41 -21.401  -7.533   3.708
  350    HA   LYS  41           HA       LYS  41 -18.619  -7.628   4.648
  351   1HB   LYS  41          2HB       LYS  41 -20.906  -6.320   6.132
  352   2HB   LYS  41          1HB       LYS  41 -19.258  -6.491   6.720
  353   1HG   LYS  41          2HG       LYS  41 -18.519  -4.740   5.534
  354   2HG   LYS  41          1HG       LYS  41 -19.500  -5.148   4.124
  355   1HD   LYS  41          2HD       LYS  41 -20.942  -3.549   4.674
  356   2HD   LYS  41          1HD       LYS  41 -21.261  -4.368   6.205
  357   1HE   LYS  41          2HE       LYS  41 -18.870  -2.592   5.847
  358   2HE   LYS  41          1HE       LYS  41 -20.448  -1.929   6.270
  359   1HZ   LYS  41          1HZ       LYS  41 -18.609  -3.515   7.872
  360   2HZ   LYS  41          2HZ       LYS  41 -20.252  -3.864   8.068
  361   3HZ   LYS  41          3HZ       LYS  41 -19.683  -2.295   8.344
  362    H    ALA  42           H        ALA  42 -21.834  -8.052   6.123
  363    HA   ALA  42           HA       ALA  42 -21.153 -10.159   7.790
  364   1HB   ALA  42          1HB       ALA  42 -23.230  -8.836   7.958
  365   2HB   ALA  42          2HB       ALA  42 -23.521 -10.574   8.022
  366   3HB   ALA  42          3HB       ALA  42 -23.854  -9.679   6.540
  Start of MODEL   19
    1   1H    ALA   1          1HT       ALA   1 -27.878   5.171   0.477
    2   2H    ALA   1          2HT       ALA   1 -27.868   3.886   1.615
    3   3H    ALA   1          3HT       ALA   1 -29.284   4.218   0.705
    4    HA   ALA   1           HA       ALA   1 -28.155   3.643  -1.303
    5   1HB   ALA   1          1HB       ALA   1 -25.915   4.192  -0.876
    6   2HB   ALA   1          2HB       ALA   1 -25.934   2.433  -1.000
    7   3HB   ALA   1          3HB       ALA   1 -25.861   3.204   0.584
    8    H    LYS   2           H        LYS   2 -29.661   2.100  -1.568
    9    HA   LYS   2           HA       LYS   2 -29.391  -0.349   0.047
   10   1HB   LYS   2          2HB       LYS   2 -31.742  -0.682  -0.039
   11   2HB   LYS   2          1HB       LYS   2 -31.493   0.997   0.421
   12   1HG   LYS   2          2HG       LYS   2 -32.008   0.169  -2.417
   13   2HG   LYS   2          1HG       LYS   2 -33.307   0.530  -1.280
   14   1HD   LYS   2          2HD       LYS   2 -31.400   2.627  -1.121
   15   2HD   LYS   2          1HD       LYS   2 -31.746   2.337  -2.827
   16   1HE   LYS   2          2HE       LYS   2 -33.952   2.924  -2.621
   17   2HE   LYS   2          1HE       LYS   2 -34.027   2.464  -0.920
   18   1HZ   LYS   2          1HZ       LYS   2 -34.133   4.891  -1.317
   19   2HZ   LYS   2          2HZ       LYS   2 -32.559   4.837  -1.934
   20   3HZ   LYS   2          3HZ       LYS   2 -32.847   4.432  -0.318
   21    H    ILE   3           H        ILE   3 -29.473   1.027  -3.098
   22    HA   ILE   3           HA       ILE   3 -29.829  -1.578  -4.379
   23    HB   ILE   3           HB       ILE   3 -29.341   0.983  -5.869
   24   1HG1  ILE   3          2HG1      ILE   3 -32.149   0.188  -5.517
   25   2HG1  ILE   3          1HG1      ILE   3 -31.380   0.776  -4.047
   26   1HG2  ILE   3          1HG2      ILE   3 -29.791  -1.683  -6.600
   27   2HG2  ILE   3          2HG2      ILE   3 -29.734  -0.271  -7.654
   28   3HG2  ILE   3          3HG2      ILE   3 -31.275  -0.813  -6.987
   29   1HD1  ILE   3          1HD1      ILE   3 -31.489   2.877  -4.738
   30   2HD1  ILE   3          2HD1      ILE   3 -32.527   2.301  -6.043
   31   3HD1  ILE   3          3HD1      ILE   3 -30.791   2.474  -6.306
   32    HA   PRO   4           HA       PRO   4 -25.395  -0.472  -5.701
   33   1HB   PRO   4          2HB       PRO   4 -24.275   1.840  -4.996
   34   2HB   PRO   4          1HB       PRO   4 -25.475   1.772  -6.292
   35   1HG   PRO   4          2HG       PRO   4 -25.768   2.720  -3.484
   36   2HG   PRO   4          1HG       PRO   4 -26.542   3.319  -4.960
   37   1HD   PRO   4          2HD       PRO   4 -27.669   1.559  -3.070
   38   2HD   PRO   4          1HD       PRO   4 -28.310   1.931  -4.680
   39    H    ILE   5           H        ILE   5 -26.406  -1.186  -2.883
   40    HA   ILE   5           HA       ILE   5 -24.617  -0.592  -0.898
   41    HB   ILE   5           HB       ILE   5 -25.238  -2.679   0.161
   42   1HG1  ILE   5          2HG1      ILE   5 -26.312  -3.399  -2.568
   43   2HG1  ILE   5          1HG1      ILE   5 -25.050  -4.230  -1.665
   44   1HG2  ILE   5          1HG2      ILE   5 -27.761  -2.475  -0.095
   45   2HG2  ILE   5          2HG2      ILE   5 -27.423  -1.216  -1.283
   46   3HG2  ILE   5          3HG2      ILE   5 -26.884  -1.022   0.385
   47   1HD1  ILE   5          1HD1      ILE   5 -27.935  -4.512  -1.534
   48   2HD1  ILE   5          2HD1      ILE   5 -27.186  -4.320   0.051
   49   3HD1  ILE   5          3HD1      ILE   5 -26.660  -5.617  -1.022
   50    H    LYS   6           H        LYS   6 -24.377  -3.235  -3.256
   51    HA   LYS   6           HA       LYS   6 -21.967  -4.316  -2.324
   52   1HB   LYS   6          2HB       LYS   6 -23.491  -4.432  -4.877
   53   2HB   LYS   6          1HB       LYS   6 -21.811  -4.950  -4.916
   54   1HG   LYS   6          2HG       LYS   6 -24.060  -6.094  -3.288
   55   2HG   LYS   6          1HG       LYS   6 -23.109  -6.885  -4.547
   56   1HD   LYS   6          2HD       LYS   6 -21.234  -6.018  -2.680
   57   2HD   LYS   6          1HD       LYS   6 -22.578  -6.632  -1.714
   58   1HE   LYS   6          2HE       LYS   6 -22.339  -8.772  -2.491
   59   2HE   LYS   6          1HE       LYS   6 -21.652  -8.251  -4.029
   60   1HZ   LYS   6          1HZ       LYS   6 -19.715  -8.859  -3.147
   61   2HZ   LYS   6          2HZ       LYS   6 -20.330  -8.927  -1.574
   62   3HZ   LYS   6          3HZ       LYS   6 -19.805  -7.451  -2.212
   63    H    ALA   7           H        ALA   7 -22.630  -1.467  -4.144
   64    HA   ALA   7           HA       ALA   7 -20.031  -1.162  -5.291
   65   1HB   ALA   7          1HB       ALA   7 -20.800   0.822  -6.181
   66   2HB   ALA   7          2HB       ALA   7 -21.853   1.153  -4.806
   67   3HB   ALA   7          3HB       ALA   7 -22.302  -0.081  -5.983
   68    H    ILE   8           H        ILE   8 -21.650   0.045  -2.397
   69    HA   ILE   8           HA       ILE   8 -19.613   1.802  -1.570
   70    HB   ILE   8           HB       ILE   8 -20.811   2.118   0.361
   71   1HG1  ILE   8          2HG1      ILE   8 -22.414   0.198   1.189
   72   2HG1  ILE   8          1HG1      ILE   8 -21.339  -0.828   0.246
   73   1HG2  ILE   8          1HG2      ILE   8 -23.047   2.288  -0.219
   74   2HG2  ILE   8          2HG2      ILE   8 -23.029   0.778  -1.129
   75   3HG2  ILE   8          3HG2      ILE   8 -22.238   2.212  -1.785
   76   1HD1  ILE   8          1HD1      ILE   8 -19.849  -0.831   1.877
   77   2HD1  ILE   8          2HD1      ILE   8 -20.991   0.076   2.869
   78   3HD1  ILE   8          3HD1      ILE   8 -19.798   0.932   1.892
   79    H    LYS   9           H        LYS   9 -20.173  -1.623  -0.973
   80    HA   LYS   9           HA       LYS   9 -18.121  -1.942   0.956
   81   1HB   LYS   9          2HB       LYS   9 -19.169  -4.063  -0.921
   82   2HB   LYS   9          1HB       LYS   9 -18.420  -4.305   0.652
   83   1HG   LYS   9          2HG       LYS   9 -20.755  -2.596   0.810
   84   2HG   LYS   9          1HG       LYS   9 -21.123  -4.177   0.117
   85   1HD   LYS   9          2HD       LYS   9 -20.855  -5.211   2.081
   86   2HD   LYS   9          1HD       LYS   9 -19.362  -4.338   2.429
   87   1HE   LYS   9          2HE       LYS   9 -20.419  -2.737   3.628
   88   2HE   LYS   9          1HE       LYS   9 -21.854  -2.769   2.604
   89   1HZ   LYS   9          1HZ       LYS   9 -21.660  -5.211   3.977
   90   2HZ   LYS   9          2HZ       LYS   9 -22.863  -4.028   4.099
   91   3HZ   LYS   9          3HZ       LYS   9 -21.502  -3.956   5.101
   92    H    THR  10           H        THR  10 -18.245  -2.183  -2.548
   93    HA   THR  10           HA       THR  10 -15.743  -3.315  -3.015
   94    HB   THR  10           HB       THR  10 -17.199  -1.273  -4.704
   95    HG1  THR  10           1HG      THR  10 -17.250  -4.081  -4.991
   96   1HG2  THR  10          1HG2      THR  10 -14.981  -1.495  -5.547
   97   2HG2  THR  10          2HG2      THR  10 -16.066  -2.405  -6.598
   98   3HG2  THR  10          3HG2      THR  10 -15.057  -3.253  -5.427
   99    H    VAL  11           H        VAL  11 -16.670   0.057  -2.515
  100    HA   VAL  11           HA       VAL  11 -14.154   1.188  -3.086
  101    HB   VAL  11           HB       VAL  11 -16.392   2.182  -1.324
  102   1HG1  VAL  11          1HG1      VAL  11 -14.307   3.187  -0.591
  103   2HG1  VAL  11          2HG1      VAL  11 -15.293   4.379  -1.439
  104   3HG1  VAL  11          3HG1      VAL  11 -13.916   3.635  -2.251
  105   1HG2  VAL  11          1HG2      VAL  11 -16.985   3.565  -3.180
  106   2HG2  VAL  11          2HG2      VAL  11 -16.818   1.912  -3.773
  107   3HG2  VAL  11          3HG2      VAL  11 -15.537   3.088  -4.067
  108    H    GLY  12           H        GLY  12 -15.637   0.207  -0.016
  109   1HA   GLY  12          2HA       GLY  12 -13.535   0.944   1.675
  110   2HA   GLY  12          1HA       GLY  12 -14.698  -0.331   2.011
  111    H    LYS  13           H        LYS  13 -13.851  -1.740  -0.499
  112    HA   LYS  13           HA       LYS  13 -11.710  -3.257   0.711
  113   1HB   LYS  13          2HB       LYS  13 -12.720  -3.793  -2.052
  114   2HB   LYS  13          1HB       LYS  13 -12.190  -4.929  -0.820
  115   1HG   LYS  13          2HG       LYS  13 -14.402  -3.738   0.315
  116   2HG   LYS  13          1HG       LYS  13 -14.838  -3.899  -1.387
  117   1HD   LYS  13          2HD       LYS  13 -14.154  -6.292  -1.266
  118   2HD   LYS  13          1HD       LYS  13 -13.916  -6.088   0.471
  119   1HE   LYS  13          2HE       LYS  13 -16.057  -6.894   0.449
  120   2HE   LYS  13          1HE       LYS  13 -16.376  -5.162   0.364
  121   1HZ   LYS  13          1HZ       LYS  13 -16.016  -6.267  -2.230
  122   2HZ   LYS  13          2HZ       LYS  13 -17.334  -5.410  -1.606
  123   3HZ   LYS  13          3HZ       LYS  13 -17.241  -7.086  -1.398
  124    H    ALA  14           H        ALA  14 -12.151  -1.060  -1.996
  125    HA   ALA  14           HA       ALA  14  -9.577  -1.524  -3.146
  126   1HB   ALA  14          1HB       ALA  14 -10.879  -0.607  -4.752
  127   2HB   ALA  14          2HB       ALA  14 -10.223   0.898  -4.110
  128   3HB   ALA  14          3HB       ALA  14 -11.818   0.344  -3.602
  129    H    VAL  15           H        VAL  15 -10.868   0.652  -0.731
  130    HA   VAL  15           HA       VAL  15  -8.522   2.308  -0.611
  131    HB   VAL  15           HB       VAL  15 -10.784   2.057   1.379
  132   1HG1  VAL  15          1HG1      VAL  15  -8.893   4.368   1.010
  133   2HG1  VAL  15          2HG1      VAL  15  -8.613   3.075   2.176
  134   3HG1  VAL  15          3HG1      VAL  15 -10.043   4.097   2.320
  135   1HG2  VAL  15          1HG2      VAL  15 -10.961   4.469  -0.039
  136   2HG2  VAL  15          2HG2      VAL  15 -12.048   3.084  -0.132
  137   3HG2  VAL  15          3HG2      VAL  15 -10.688   3.213  -1.247
  138    H    GLY  16           H        GLY  16  -9.735  -0.529   1.040
  139   1HA   GLY  16          2HA       GLY  16  -7.784  -0.442   3.150
  140   2HA   GLY  16          1HA       GLY  16  -8.865  -1.778   2.781
  141    H    LYS  17           H        LYS  17  -8.022  -1.930  -0.012
  142    HA   LYS  17           HA       LYS  17  -5.639  -3.529   0.413
  143   1HB   LYS  17          2HB       LYS  17  -7.219  -4.635  -0.922
  144   2HB   LYS  17          1HB       LYS  17  -7.572  -3.193  -1.862
  145   1HG   LYS  17          2HG       LYS  17  -4.883  -4.509  -1.966
  146   2HG   LYS  17          1HG       LYS  17  -6.224  -5.051  -2.976
  147   1HD   LYS  17          2HD       LYS  17  -6.272  -2.343  -3.357
  148   2HD   LYS  17          1HD       LYS  17  -4.544  -2.664  -3.196
  149   1HE   LYS  17          2HE       LYS  17  -4.480  -3.460  -5.267
  150   2HE   LYS  17          1HE       LYS  17  -5.686  -4.677  -4.853
  151   1HZ   LYS  17          1HZ       LYS  17  -7.057  -3.629  -6.220
  152   2HZ   LYS  17          2HZ       LYS  17  -5.973  -2.351  -6.445
  153   3HZ   LYS  17          3HZ       LYS  17  -7.071  -2.311  -5.159
  154    H    GLY  18           H        GLY  18  -6.598  -0.568  -1.207
  155   1HA   GLY  18          2HA       GLY  18  -4.185  -0.217  -2.680
  156   2HA   GLY  18          1HA       GLY  18  -5.367   1.034  -2.317
  157    H    LEU  19           H        LEU  19  -5.328   0.992   0.445
  158    HA   LEU  19           HA       LEU  19  -2.996   2.527   0.984
  159   1HB   LEU  19          2HB       LEU  19  -4.769   3.273   2.233
  160   2HB   LEU  19          1HB       LEU  19  -5.394   1.659   2.509
  161    HG   LEU  19           HG       LEU  19  -3.748   1.246   4.220
  162   1HD1  LEU  19          1HD1      LEU  19  -2.550   3.776   4.592
  163   2HD1  LEU  19          2HD1      LEU  19  -2.330   3.332   2.899
  164   3HD1  LEU  19          3HD1      LEU  19  -1.774   2.248   4.175
  165   1HD2  LEU  19          1HD2      LEU  19  -5.842   2.932   4.477
  166   2HD2  LEU  19          2HD2      LEU  19  -4.525   3.966   5.031
  167   3HD2  LEU  19          3HD2      LEU  19  -4.821   2.415   5.818
  168    H    ARG  20           H        ARG  20  -4.077  -0.721   1.853
  169    HA   ARG  20           HA       ARG  20  -2.054  -1.387   3.644
  170   1HB   ARG  20          2HB       ARG  20  -4.064  -2.775   3.224
  171   2HB   ARG  20          1HB       ARG  20  -3.404  -3.225   1.658
  172   1HG   ARG  20          2HG       ARG  20  -3.130  -4.823   3.679
  173   2HG   ARG  20          1HG       ARG  20  -1.775  -4.569   2.576
  174   1HD   ARG  20          2HD       ARG  20  -0.901  -4.440   4.779
  175   2HD   ARG  20          1HD       ARG  20  -0.959  -2.792   4.156
  176    HE   ARG  20           HE       ARG  20  -3.326  -3.107   5.481
  177   1HH1  ARG  20          1HH1      ARG  20   0.035  -3.456   6.325
  178   2HH1  ARG  20          2HH1      ARG  20  -0.203  -3.022   7.985
  179   1HH2  ARG  20          1HH2      ARG  20  -3.651  -2.533   7.663
  180   2HH2  ARG  20          2HH2      ARG  20  -2.300  -2.497   8.746
  181    H    ALA  21           H        ALA  21  -2.112  -1.435   0.128
  182    HA   ALA  21           HA       ALA  21   0.350  -2.765  -0.242
  183   1HB   ALA  21          1HB       ALA  21  -0.347  -0.774  -2.279
  184   2HB   ALA  21          2HB       ALA  21  -1.635  -1.921  -1.909
  185   3HB   ALA  21          3HB       ALA  21  -0.058  -2.506  -2.441
  186    H    ILE  22           H        ILE  22  -0.517   0.644   0.025
  187    HA   ILE  22           HA       ILE  22   2.104   1.644  -0.393
  188    HB   ILE  22           HB       ILE  22  -0.396   2.797   0.811
  189   1HG1  ILE  22          2HG1      ILE  22  -0.527   4.052  -1.129
  190   2HG1  ILE  22          1HG1      ILE  22   1.213   4.023  -1.391
  191   1HG2  ILE  22          1HG2      ILE  22   1.041   4.993   0.802
  192   2HG2  ILE  22          2HG2      ILE  22   2.374   3.865   1.054
  193   3HG2  ILE  22          3HG2      ILE  22   1.037   3.921   2.203
  194   1HD1  ILE  22          1HD1      ILE  22   0.987   1.598  -1.971
  195   2HD1  ILE  22          2HD1      ILE  22   0.213   2.718  -3.092
  196   3HD1  ILE  22          3HD1      ILE  22  -0.762   1.824  -1.924
  197    H    ASN  23           H        ASN  23   0.708  -0.119   2.101
  198    HA   ASN  23           HA       ASN  23   2.144   0.987   4.302
  199   1HB   ASN  23          2HB       ASN  23   0.728  -0.273   5.467
  200   2HB   ASN  23          1HB       ASN  23   0.038  -0.811   3.956
  201   1HD2  ASN  23          1HD2      ASN  23   2.216  -1.569   6.557
  202   2HD2  ASN  23          2HD2      ASN  23   2.338  -3.261   6.233
  203    H    ILE  24           H        ILE  24   2.388  -2.191   2.726
  204    HA   ILE  24           HA       ILE  24   4.869  -2.852   3.854
  205    HB   ILE  24           HB       ILE  24   5.096  -4.509   2.072
  206   1HG1  ILE  24          2HG1      ILE  24   3.767  -2.739   0.485
  207   2HG1  ILE  24          1HG1      ILE  24   4.033  -4.431   0.084
  208   1HG2  ILE  24          1HG2      ILE  24   3.268  -5.875   2.669
  209   2HG2  ILE  24          2HG2      ILE  24   2.238  -4.480   2.984
  210   3HG2  ILE  24          3HG2      ILE  24   3.588  -4.840   4.060
  211   1HD1  ILE  24          1HD1      ILE  24   1.814  -4.906   1.180
  212   2HD1  ILE  24          2HD1      ILE  24   1.761  -3.991  -0.327
  213   3HD1  ILE  24          3HD1      ILE  24   1.563  -3.161   1.217
  214    H    ALA  25           H        ALA  25   3.921  -0.808   1.277
  215    HA   ALA  25           HA       ALA  25   6.548  -0.626   0.117
  216   1HB   ALA  25          1HB       ALA  25   3.883   0.553  -0.469
  217   2HB   ALA  25          2HB       ALA  25   5.017  -0.261  -1.546
  218   3HB   ALA  25          3HB       ALA  25   5.315   1.404  -1.048
  219    H    SER  26           H        SER  26   4.676   0.870   2.582
  220    HA   SER  26           HA       SER  26   6.114   3.349   2.673
  221   1HB   SER  26          2HB       SER  26   3.942   2.070   4.171
  222   2HB   SER  26          1HB       SER  26   5.017   3.033   5.184
  223    HG   SER  26           HG       SER  26   4.334   4.802   4.242
  224    H    THR  27           H        THR  27   6.331   0.248   4.338
  225    HA   THR  27           HA       THR  27   8.396   1.104   6.134
  226    HB   THR  27           HB       THR  27   7.605  -1.718   5.393
  227    HG1  THR  27           1HG      THR  27   6.605  -0.036   7.445
  228   1HG2  THR  27          1HG2      THR  27   8.617  -2.465   7.318
  229   2HG2  THR  27          2HG2      THR  27   8.630  -0.864   8.058
  230   3HG2  THR  27          3HG2      THR  27   9.753  -1.240   6.751
  231    H    ALA  28           H        ALA  28   8.251  -0.484   3.013
  232    HA   ALA  28           HA       ALA  28  11.063  -1.112   2.959
  233   1HB   ALA  28          1HB       ALA  28   8.743  -1.534   1.196
  234   2HB   ALA  28          2HB       ALA  28  10.086  -2.609   1.587
  235   3HB   ALA  28          3HB       ALA  28  10.293  -1.343   0.377
  236    H    ASN  29           H        ASN  29   9.127   1.614   2.283
  237    HA   ASN  29           HA       ASN  29  10.754   2.836   0.303
  238   1HB   ASN  29          2HB       ASN  29   8.852   4.029   0.215
  239   2HB   ASN  29          1HB       ASN  29   8.361   3.483   1.812
  240   1HD2  ASN  29          1HD2      ASN  29   7.717   5.254   2.812
  241   2HD2  ASN  29          2HD2      ASN  29   8.637   6.705   2.986
  242    H    ASP  30           H        ASP  30  10.289   3.793   3.700
  243    HA   ASP  30           HA       ASP  30  12.395   5.536   3.940
  244   1HB   ASP  30          2HB       ASP  30  10.871   5.364   5.758
  245   2HB   ASP  30          1HB       ASP  30  11.190   3.644   5.958
  246    H    VAL  31           H        VAL  31  12.429   2.027   4.243
  247    HA   VAL  31           HA       VAL  31  15.105   1.728   5.061
  248    HB   VAL  31           HB       VAL  31  13.273  -0.133   3.552
  249   1HG1  VAL  31          1HG1      VAL  31  15.141  -1.759   4.655
  250   2HG1  VAL  31          2HG1      VAL  31  16.128  -0.377   4.182
  251   3HG1  VAL  31          3HG1      VAL  31  15.154  -1.216   2.976
  252   1HG2  VAL  31          1HG2      VAL  31  12.483  -0.756   5.537
  253   2HG2  VAL  31          2HG2      VAL  31  13.286   0.668   6.198
  254   3HG2  VAL  31          3HG2      VAL  31  14.103  -0.894   6.222
  255    H    PHE  32           H        PHE  32  13.611   1.554   1.861
  256    HA   PHE  32           HA       PHE  32  15.932   1.062   0.382
  257   1HB   PHE  32          2HB       PHE  32  13.927   0.705  -0.768
  258   2HB   PHE  32          1HB       PHE  32  13.264   2.264  -0.290
  259    HD1  PHE  32           1HD      PHE  32  15.641   0.578  -2.537
  260    HD2  PHE  32           2HD      PHE  32  13.663   4.220  -1.573
  261    HE1  PHE  32           1HE      PHE  32  16.372   1.537  -4.681
  262    HE2  PHE  32           2HE      PHE  32  14.389   5.186  -3.716
  263    HZ   PHE  32           HZ       PHE  32  15.746   3.844  -5.274
  264    H    ASN  33           H        ASN  33  15.007   3.854   2.062
  265    HA   ASN  33           HA       ASN  33  16.881   5.490   0.482
  266   1HB   ASN  33          2HB       ASN  33  14.484   6.267   0.548
  267   2HB   ASN  33          1HB       ASN  33  14.685   6.529   2.278
  268   1HD2  ASN  33          1HD2      ASN  33  14.397   8.718   2.200
  269   2HD2  ASN  33          2HD2      ASN  33  15.531   9.797   1.469
  270    H    PHE  34           H        PHE  34  16.646   3.794   3.296
  271    HA   PHE  34           HA       PHE  34  18.199   5.703   4.879
  272   1HB   PHE  34          2HB       PHE  34  16.303   4.610   5.994
  273   2HB   PHE  34          1HB       PHE  34  17.019   3.034   5.670
  274    HD1  PHE  34           1HD      PHE  34  16.651   5.560   8.054
  275    HD2  PHE  34           2HD      PHE  34  19.494   2.766   6.563
  276    HE1  PHE  34           1HE      PHE  34  17.892   5.696  10.175
  277    HE2  PHE  34           2HE      PHE  34  20.739   2.896   8.680
  278    HZ   PHE  34           HZ       PHE  34  19.939   4.362  10.490
  279    H    LEU  35           H        LEU  35  18.355   2.296   3.886
  280    HA   LEU  35           HA       LEU  35  21.263   2.377   4.304
  281   1HB   LEU  35          2HB       LEU  35  20.900  -0.205   4.001
  282   2HB   LEU  35          1HB       LEU  35  20.585   0.578   5.538
  283    HG   LEU  35           HG       LEU  35  18.284   0.398   3.691
  284   1HD1  LEU  35          1HD1      LEU  35  18.059  -2.014   4.864
  285   2HD1  LEU  35          2HD1      LEU  35  19.801  -1.958   4.595
  286   3HD1  LEU  35          3HD1      LEU  35  18.693  -1.770   3.236
  287   1HD2  LEU  35          1HD2      LEU  35  18.470   1.247   6.163
  288   2HD2  LEU  35          2HD2      LEU  35  18.335  -0.470   6.543
  289   3HD2  LEU  35          3HD2      LEU  35  17.058   0.335   5.632
  290    H    LYS  36           H        LYS  36  18.751   1.671   1.964
  291    HA   LYS  36           HA       LYS  36  18.896   0.899  -0.219
  292   1HB   LYS  36          2HB       LYS  36  20.133   2.661  -1.599
  293   2HB   LYS  36          1HB       LYS  36  18.806   3.217  -0.590
  294   1HG   LYS  36          2HG       LYS  36  21.361   3.297   0.790
  295   2HG   LYS  36          1HG       LYS  36  21.345   4.273  -0.679
  296   1HD   LYS  36          2HD       LYS  36  19.054   4.459   1.226
  297   2HD   LYS  36          1HD       LYS  36  20.564   5.290   1.608
  298   1HE   LYS  36          2HE       LYS  36  20.164   5.962  -1.018
  299   2HE   LYS  36          1HE       LYS  36  18.520   5.920  -0.385
  300   1HZ   LYS  36          1HZ       LYS  36  19.839   8.095  -0.233
  301   2HZ   LYS  36          2HZ       LYS  36  20.648   7.363   1.060
  302   3HZ   LYS  36          3HZ       LYS  36  18.973   7.590   1.131
  303    HA   PRO  37           HA       PRO  37  23.020  -1.124  -0.089
  304   1HB   PRO  37          2HB       PRO  37  22.215  -3.665   0.145
  305   2HB   PRO  37          1HB       PRO  37  22.277  -2.585   1.541
  306   1HG   PRO  37          2HG       PRO  37  19.925  -3.497  -0.042
  307   2HG   PRO  37          1HG       PRO  37  20.056  -3.174   1.694
  308   1HD   PRO  37          2HD       PRO  37  18.995  -1.439  -0.232
  309   2HD   PRO  37          1HD       PRO  37  19.470  -1.001   1.419
  310    H    LYS  38           H        LYS  38  21.182  -3.746  -1.388
  311    HA   LYS  38           HA       LYS  38  21.054  -4.670  -3.456
  312   1HB   LYS  38          2HB       LYS  38  20.591  -1.830  -3.854
  313   2HB   LYS  38          1HB       LYS  38  21.322  -2.573  -5.270
  314   1HG   LYS  38          2HG       LYS  38  19.059  -2.799  -5.676
  315   2HG   LYS  38          1HG       LYS  38  19.491  -4.368  -4.993
  316   1HD   LYS  38          2HD       LYS  38  18.123  -4.080  -3.256
  317   2HD   LYS  38          1HD       LYS  38  18.773  -2.472  -2.928
  318   1HE   LYS  38          2HE       LYS  38  16.383  -2.376  -3.411
  319   2HE   LYS  38          1HE       LYS  38  17.317  -1.526  -4.642
  320   1HZ   LYS  38          1HZ       LYS  38  16.962  -3.218  -6.182
  321   2HZ   LYS  38          2HZ       LYS  38  15.462  -3.061  -5.417
  322   3HZ   LYS  38          3HZ       LYS  38  16.491  -4.340  -5.006
  323    H    LYS  39           H        LYS  39  23.188  -1.903  -4.059
  324    HA   LYS  39           HA       LYS  39  25.202  -3.763  -5.107
  325   1HB   LYS  39          2HB       LYS  39  25.281  -0.776  -5.441
  326   2HB   LYS  39          1HB       LYS  39  26.039  -2.013  -6.434
  327   1HG   LYS  39          2HG       LYS  39  24.339  -1.745  -7.836
  328   2HG   LYS  39          1HG       LYS  39  23.347  -2.582  -6.640
  329   1HD   LYS  39          2HD       LYS  39  22.159  -0.737  -6.284
  330   2HD   LYS  39          1HD       LYS  39  23.623   0.164  -5.886
  331   1HE   LYS  39          2HE       LYS  39  22.467  -0.273  -8.637
  332   2HE   LYS  39          1HE       LYS  39  22.463   1.235  -7.722
  333   1HZ   LYS  39          1HZ       LYS  39  24.809  -0.177  -8.860
  334   2HZ   LYS  39          2HZ       LYS  39  24.943   1.110  -7.770
  335   3HZ   LYS  39          3HZ       LYS  39  24.222   1.353  -9.280
  336    H    ARG  40           H        ARG  40  24.466  -1.937  -2.386
  337    HA   ARG  40           HA       ARG  40  25.660  -1.757  -0.425
  338   1HB   ARG  40          2HB       ARG  40  27.189  -3.577  -1.735
  339   2HB   ARG  40          1HB       ARG  40  28.320  -2.236  -1.614
  340   1HG   ARG  40          2HG       ARG  40  27.067  -2.555   0.911
  341   2HG   ARG  40          1HG       ARG  40  27.613  -4.139   0.359
  342   1HD   ARG  40          2HD       ARG  40  29.429  -1.771   0.170
  343   2HD   ARG  40          1HD       ARG  40  29.233  -2.615   1.706
  344    HE   ARG  40           HE       ARG  40  29.769  -4.587  -0.111
  345   1HH1  ARG  40          1HH1      ARG  40  31.357  -1.662   0.912
  346   2HH1  ARG  40          2HH1      ARG  40  32.951  -2.261   0.594
  347   1HH2  ARG  40          1HH2      ARG  40  31.863  -5.389  -0.531
  348   2HH2  ARG  40          2HH2      ARG  40  33.238  -4.381  -0.228
  349    H    LYS  41           H        LYS  41  25.063   0.483  -0.831
  350    HA   LYS  41           HA       LYS  41  25.474   2.705  -1.262
  351   1HB   LYS  41          2HB       LYS  41  27.678   1.656   0.446
  352   2HB   LYS  41          1HB       LYS  41  27.819   3.302  -0.155
  353   1HG   LYS  41          2HG       LYS  41  25.488   2.231   1.421
  354   2HG   LYS  41          1HG       LYS  41  26.816   3.187   2.082
  355   1HD   LYS  41          2HD       LYS  41  26.063   5.121   1.159
  356   2HD   LYS  41          1HD       LYS  41  25.398   4.311  -0.261
  357   1HE   LYS  41          2HE       LYS  41  23.400   4.650   0.679
  358   2HE   LYS  41          1HE       LYS  41  23.836   3.346   1.782
  359   1HZ   LYS  41          1HZ       LYS  41  24.631   6.120   2.377
  360   2HZ   LYS  41          2HZ       LYS  41  24.404   4.825   3.441
  361   3HZ   LYS  41          3HZ       LYS  41  23.067   5.588   2.742
  362    H    ALA  42           H        ALA  42  25.896   1.488  -3.595
  363    HA   ALA  42           HA       ALA  42  26.924   1.683  -5.615
  364   1HB   ALA  42          1HB       ALA  42  26.692   4.025  -5.394
  365   2HB   ALA  42          2HB       ALA  42  28.348   3.746  -5.933
  366   3HB   ALA  42          3HB       ALA  42  28.023   4.122  -4.241
  Start of MODEL   20
    1   1H    ALA   1          1HT       ALA   1 -30.735   3.579  -1.142
    2   2H    ALA   1          2HT       ALA   1 -30.495   1.968  -1.684
    3   3H    ALA   1          3HT       ALA   1 -29.863   2.470  -0.169
    4    HA   ALA   1           HA       ALA   1 -31.762   2.248   0.875
    5   1HB   ALA   1          1HB       ALA   1 -33.515   2.727  -1.481
    6   2HB   ALA   1          2HB       ALA   1 -32.636   4.091  -0.789
    7   3HB   ALA   1          3HB       ALA   1 -33.752   3.161   0.211
    8    H    LYS   2           H        LYS   2 -31.552   0.095   1.218
    9    HA   LYS   2           HA       LYS   2 -32.289  -2.080   1.130
   10   1HB   LYS   2          2HB       LYS   2 -33.507  -1.627  -1.575
   11   2HB   LYS   2          1HB       LYS   2 -33.993  -2.758  -0.319
   12   1HG   LYS   2          2HG       LYS   2 -34.589   0.140  -0.597
   13   2HG   LYS   2          1HG       LYS   2 -35.653  -1.198  -0.157
   14   1HD   LYS   2          2HD       LYS   2 -34.081  -1.305   1.956
   15   2HD   LYS   2          1HD       LYS   2 -33.777   0.381   1.534
   16   1HE   LYS   2          2HE       LYS   2 -36.349   0.575   1.419
   17   2HE   LYS   2          1HE       LYS   2 -36.350  -0.933   2.332
   18   1HZ   LYS   2          1HZ       LYS   2 -34.642   0.478   3.776
   19   2HZ   LYS   2          2HZ       LYS   2 -36.310   0.499   4.057
   20   3HZ   LYS   2          3HZ       LYS   2 -35.587   1.746   3.173
   21    H    ILE   3           H        ILE   3 -29.885  -0.812  -0.217
   22    HA   ILE   3           HA       ILE   3 -28.957  -3.253  -1.471
   23    HB   ILE   3           HB       ILE   3 -28.312  -0.884  -3.105
   24   1HG1  ILE   3          2HG1      ILE   3 -31.061  -2.149  -3.170
   25   2HG1  ILE   3          1HG1      ILE   3 -30.695  -0.489  -2.710
   26   1HG2  ILE   3          1HG2      ILE   3 -27.552  -2.560  -4.345
   27   2HG2  ILE   3          2HG2      ILE   3 -29.223  -3.035  -4.652
   28   3HG2  ILE   3          3HG2      ILE   3 -28.338  -3.747  -3.304
   29   1HD1  ILE   3          1HD1      ILE   3 -31.142   0.020  -4.823
   30   2HD1  ILE   3          2HD1      ILE   3 -31.046  -1.664  -5.339
   31   3HD1  ILE   3          3HD1      ILE   3 -29.577  -0.696  -5.206
   32    HA   PRO   4           HA       PRO   4 -25.877  -0.826   1.118
   33   1HB   PRO   4          2HB       PRO   4 -25.450  -3.511   2.267
   34   2HB   PRO   4          1HB       PRO   4 -25.711  -1.968   3.085
   35   1HG   PRO   4          2HG       PRO   4 -27.605  -3.869   3.032
   36   2HG   PRO   4          1HG       PRO   4 -28.011  -2.144   2.973
   37   1HD   PRO   4          2HD       PRO   4 -27.938  -4.154   0.758
   38   2HD   PRO   4          1HD       PRO   4 -29.095  -2.839   1.051
   39    H    ILE   5           H        ILE   5 -25.892  -3.745  -0.761
   40    HA   ILE   5           HA       ILE   5 -23.317  -4.581  -0.876
   41    HB   ILE   5           HB       ILE   5 -24.988  -4.152  -3.350
   42   1HG1  ILE   5          2HG1      ILE   5 -25.179  -6.811  -2.323
   43   2HG1  ILE   5          1HG1      ILE   5 -25.591  -5.687  -1.033
   44   1HG2  ILE   5          1HG2      ILE   5 -22.423  -5.221  -2.982
   45   2HG2  ILE   5          2HG2      ILE   5 -23.419  -5.279  -4.436
   46   3HG2  ILE   5          3HG2      ILE   5 -23.492  -6.594  -3.264
   47   1HD1  ILE   5          1HD1      ILE   5 -27.529  -5.121  -1.988
   48   2HD1  ILE   5          2HD1      ILE   5 -27.320  -6.613  -2.904
   49   3HD1  ILE   5          3HD1      ILE   5 -26.833  -5.071  -3.607
   50    H    LYS   6           H        LYS   6 -24.485  -2.368  -3.390
   51    HA   LYS   6           HA       LYS   6 -22.119  -1.540  -4.415
   52   1HB   LYS   6          2HB       LYS   6 -24.693  -0.043  -4.006
   53   2HB   LYS   6          1HB       LYS   6 -23.319   0.722  -4.794
   54   1HG   LYS   6          2HG       LYS   6 -24.059  -0.144  -6.695
   55   2HG   LYS   6          1HG       LYS   6 -23.571  -1.723  -6.078
   56   1HD   LYS   6          2HD       LYS   6 -25.864  -1.787  -4.945
   57   2HD   LYS   6          1HD       LYS   6 -26.285  -0.434  -5.998
   58   1HE   LYS   6          2HE       LYS   6 -26.179  -1.713  -7.909
   59   2HE   LYS   6          1HE       LYS   6 -25.073  -2.883  -7.192
   60   1HZ   LYS   6          1HZ       LYS   6 -27.323  -3.770  -7.514
   61   2HZ   LYS   6          2HZ       LYS   6 -27.937  -2.596  -6.463
   62   3HZ   LYS   6          3HZ       LYS   6 -26.868  -3.772  -5.884
   63    H    ALA   7           H        ALA   7 -23.450  -0.678  -1.328
   64    HA   ALA   7           HA       ALA   7 -21.690   1.548  -0.888
   65   1HB   ALA   7          1HB       ALA   7 -23.984   1.147   0.184
   66   2HB   ALA   7          2HB       ALA   7 -22.690   1.766   1.211
   67   3HB   ALA   7          3HB       ALA   7 -23.131   0.059   1.279
   68    H    ILE   8           H        ILE   8 -21.811  -1.833   0.139
   69    HA   ILE   8           HA       ILE   8 -19.431  -1.662   1.716
   70    HB   ILE   8           HB       ILE   8 -21.263  -3.370   2.035
   71   1HG1  ILE   8          2HG1      ILE   8 -18.535  -4.606   1.673
   72   2HG1  ILE   8          1HG1      ILE   8 -18.908  -3.488   2.982
   73   1HG2  ILE   8          1HG2      ILE   8 -21.827  -4.749   0.396
   74   2HG2  ILE   8          2HG2      ILE   8 -20.178  -5.369   0.315
   75   3HG2  ILE   8          3HG2      ILE   8 -20.641  -3.968  -0.649
   76   1HD1  ILE   8          1HD1      ILE   8 -19.570  -5.232   4.170
   77   2HD1  ILE   8          2HD1      ILE   8 -19.433  -6.301   2.774
   78   3HD1  ILE   8          3HD1      ILE   8 -20.927  -5.408   3.058
   79    H    LYS   9           H        LYS   9 -20.172  -2.348  -1.611
   80    HA   LYS   9           HA       LYS   9 -17.612  -3.487  -2.235
   81   1HB   LYS   9          2HB       LYS   9 -19.477  -2.299  -4.270
   82   2HB   LYS   9          1HB       LYS   9 -18.379  -3.662  -4.444
   83   1HG   LYS   9          2HG       LYS   9 -20.065  -4.524  -2.471
   84   2HG   LYS   9          1HG       LYS   9 -21.138  -3.581  -3.506
   85   1HD   LYS   9          2HD       LYS   9 -21.133  -5.870  -4.255
   86   2HD   LYS   9          1HD       LYS   9 -20.314  -4.871  -5.456
   87   1HE   LYS   9          2HE       LYS   9 -18.171  -5.614  -4.724
   88   2HE   LYS   9          1HE       LYS   9 -18.865  -6.410  -3.311
   89   1HZ   LYS   9          1HZ       LYS   9 -19.937  -7.310  -5.835
   90   2HZ   LYS   9          2HZ       LYS   9 -19.414  -8.207  -4.500
   91   3HZ   LYS   9          3HZ       LYS   9 -18.290  -7.638  -5.629
   92    H    THR  10           H        THR  10 -19.080  -0.296  -2.370
   93    HA   THR  10           HA       THR  10 -16.980   0.920  -3.873
   94    HB   THR  10           HB       THR  10 -19.353   1.800  -3.592
   95    HG1  THR  10           1HG      THR  10 -18.439   4.054  -3.294
   96   1HG2  THR  10          1HG2      THR  10 -19.348   3.555  -1.647
   97   2HG2  THR  10          2HG2      THR  10 -18.283   2.376  -0.883
   98   3HG2  THR  10          3HG2      THR  10 -19.906   1.903  -1.386
   99    H    VAL  11           H        VAL  11 -17.552   0.281  -0.497
  100    HA   VAL  11           HA       VAL  11 -15.450   2.011   0.436
  101    HB   VAL  11           HB       VAL  11 -17.142  -0.088   1.779
  102   1HG1  VAL  11          1HG1      VAL  11 -15.847   1.194   3.825
  103   2HG1  VAL  11          2HG1      VAL  11 -14.561   0.970   2.639
  104   3HG1  VAL  11          3HG1      VAL  11 -15.470  -0.422   3.228
  105   1HG2  VAL  11          1HG2      VAL  11 -17.253   2.365   3.112
  106   2HG2  VAL  11          2HG2      VAL  11 -18.485   1.659   2.065
  107   3HG2  VAL  11          3HG2      VAL  11 -17.281   2.760   1.393
  108    H    GLY  12           H        GLY  12 -15.824  -1.344  -0.466
  109   1HA   GLY  12          2HA       GLY  12 -13.389  -2.291   0.641
  110   2HA   GLY  12          1HA       GLY  12 -14.310  -3.066  -0.642
  111    H    LYS  13           H        LYS  13 -14.218  -0.684  -2.361
  112    HA   LYS  13           HA       LYS  13 -11.590  -1.192  -3.493
  113   1HB   LYS  13          2HB       LYS  13 -12.399   0.253  -5.369
  114   2HB   LYS  13          1HB       LYS  13 -13.395  -1.164  -5.069
  115   1HG   LYS  13          2HG       LYS  13 -15.083   0.297  -5.201
  116   2HG   LYS  13          1HG       LYS  13 -14.653   0.670  -3.533
  117   1HD   LYS  13          2HD       LYS  13 -14.838   2.741  -4.694
  118   2HD   LYS  13          1HD       LYS  13 -13.119   2.444  -4.425
  119   1HE   LYS  13          2HE       LYS  13 -12.716   1.980  -6.651
  120   2HE   LYS  13          1HE       LYS  13 -14.392   1.537  -6.968
  121   1HZ   LYS  13          1HZ       LYS  13 -14.066   4.274  -6.156
  122   2HZ   LYS  13          2HZ       LYS  13 -14.916   3.632  -7.470
  123   3HZ   LYS  13          3HZ       LYS  13 -13.252   3.909  -7.594
  124    H    ALA  14           H        ALA  14 -13.200   1.222  -1.640
  125    HA   ALA  14           HA       ALA  14 -11.465   3.397  -2.264
  126   1HB   ALA  14          1HB       ALA  14 -12.480   4.510  -0.353
  127   2HB   ALA  14          2HB       ALA  14 -13.204   2.989   0.168
  128   3HB   ALA  14          3HB       ALA  14 -13.718   3.738  -1.344
  129    H    VAL  15           H        VAL  15 -11.654   1.077   0.403
  130    HA   VAL  15           HA       VAL  15  -9.384   2.050   1.790
  131    HB   VAL  15           HB       VAL  15 -10.706  -0.665   1.826
  132   1HG1  VAL  15          1HG1      VAL  15  -9.170  -0.163   4.173
  133   2HG1  VAL  15          2HG1      VAL  15  -8.132   0.032   2.761
  134   3HG1  VAL  15          3HG1      VAL  15  -9.012  -1.476   3.006
  135   1HG2  VAL  15          1HG2      VAL  15 -12.235   0.471   2.994
  136   2HG2  VAL  15          2HG2      VAL  15 -11.183   1.875   3.174
  137   3HG2  VAL  15          3HG2      VAL  15 -11.034   0.513   4.285
  138    H    GLY  16           H        GLY  16  -9.877  -0.496  -0.608
  139   1HA   GLY  16          2HA       GLY  16  -7.278  -1.549  -0.631
  140   2HA   GLY  16          1HA       GLY  16  -8.407  -1.603  -1.979
  141    H    LYS  17           H        LYS  17  -8.596   1.352  -2.042
  142    HA   LYS  17           HA       LYS  17  -6.390   1.809  -3.819
  143   1HB   LYS  17          2HB       LYS  17  -8.280   2.872  -4.601
  144   2HB   LYS  17          1HB       LYS  17  -8.830   3.307  -2.990
  145   1HG   LYS  17          2HG       LYS  17  -6.351   4.599  -3.964
  146   2HG   LYS  17          1HG       LYS  17  -7.873   5.088  -4.712
  147   1HD   LYS  17          2HD       LYS  17  -8.419   5.017  -1.985
  148   2HD   LYS  17          1HD       LYS  17  -6.809   5.731  -2.098
  149   1HE   LYS  17          2HE       LYS  17  -8.600   6.807  -4.101
  150   2HE   LYS  17          1HE       LYS  17  -9.242   7.023  -2.473
  151   1HZ   LYS  17          1HZ       LYS  17  -7.749   8.839  -3.351
  152   2HZ   LYS  17          2HZ       LYS  17  -6.463   7.754  -3.182
  153   3HZ   LYS  17          3HZ       LYS  17  -7.354   8.226  -1.824
  154    H    GLY  18           H        GLY  18  -7.506   3.405  -0.841
  155   1HA   GLY  18          2HA       GLY  18  -5.254   5.058  -0.517
  156   2HA   GLY  18          1HA       GLY  18  -6.357   4.582   0.766
  157    H    LEU  19           H        LEU  19  -5.823   1.721   0.325
  158    HA   LEU  19           HA       LEU  19  -3.570   1.490   2.076
  159   1HB   LEU  19          2HB       LEU  19  -5.133  -0.126   2.551
  160   2HB   LEU  19          1HB       LEU  19  -5.544  -0.378   0.865
  161    HG   LEU  19           HG       LEU  19  -3.308  -1.525   0.597
  162   1HD1  LEU  19          1HD1      LEU  19  -2.940  -0.541   3.212
  163   2HD1  LEU  19          2HD1      LEU  19  -1.844  -1.543   2.260
  164   3HD1  LEU  19          3HD1      LEU  19  -3.026  -2.298   3.330
  165   1HD2  LEU  19          1HD2      LEU  19  -5.728  -2.502   1.311
  166   2HD2  LEU  19          2HD2      LEU  19  -4.725  -3.109   2.628
  167   3HD2  LEU  19          3HD2      LEU  19  -4.319  -3.502   0.957
  168    H    ARG  20           H        ARG  20  -4.229   0.625  -1.298
  169    HA   ARG  20           HA       ARG  20  -1.716  -0.548  -1.781
  170   1HB   ARG  20          2HB       ARG  20  -3.991  -0.459  -3.196
  171   2HB   ARG  20          1HB       ARG  20  -3.106   0.811  -4.029
  172   1HG   ARG  20          2HG       ARG  20  -2.974  -1.614  -4.907
  173   2HG   ARG  20          1HG       ARG  20  -1.503  -0.643  -4.830
  174   1HD   ARG  20          2HD       ARG  20  -0.589  -1.915  -3.198
  175   2HD   ARG  20          1HD       ARG  20  -2.140  -2.208  -2.413
  176    HE   ARG  20           HE       ARG  20  -2.219  -4.194  -3.507
  177   1HH1  ARG  20          1HH1      ARG  20  -0.226  -2.018  -5.355
  178   2HH1  ARG  20          2HH1      ARG  20   0.202  -3.208  -6.538
  179   1HH2  ARG  20          1HH2      ARG  20  -1.665  -5.769  -5.061
  180   2HH2  ARG  20          2HH2      ARG  20  -0.616  -5.341  -6.371
  181    H    ALA  21           H        ALA  21  -2.868   2.763  -2.007
  182    HA   ALA  21           HA       ALA  21  -0.577   3.806  -3.301
  183   1HB   ALA  21          1HB       ALA  21  -2.900   4.912  -2.873
  184   2HB   ALA  21          2HB       ALA  21  -1.452   5.919  -2.879
  185   3HB   ALA  21          3HB       ALA  21  -2.174   5.423  -1.349
  186    H    ILE  22           H        ILE  22  -1.434   3.185   0.033
  187    HA   ILE  22           HA       ILE  22   0.847   4.417   1.201
  188    HB   ILE  22           HB       ILE  22  -1.025   2.274   2.213
  189   1HG1  ILE  22          2HG1      ILE  22  -1.765   4.724   1.871
  190   2HG1  ILE  22          1HG1      ILE  22  -2.094   3.971   3.429
  191   1HG2  ILE  22          1HG2      ILE  22   1.198   3.671   3.693
  192   2HG2  ILE  22          2HG2      ILE  22   1.146   1.964   3.250
  193   3HG2  ILE  22          3HG2      ILE  22  -0.008   2.608   4.419
  194   1HD1  ILE  22          1HD1      ILE  22  -1.258   6.274   3.623
  195   2HD1  ILE  22          2HD1      ILE  22   0.246   5.770   2.851
  196   3HD1  ILE  22          3HD1      ILE  22  -0.211   5.097   4.416
  197    H    ASN  23           H        ASN  23   0.304   1.552  -0.556
  198    HA   ASN  23           HA       ASN  23   2.356  -0.065   0.546
  199   1HB   ASN  23          2HB       ASN  23   1.365  -1.584  -0.731
  200   2HB   ASN  23          1HB       ASN  23   0.304  -0.339  -1.339
  201   1HD2  ASN  23          1HD2      ASN  23   0.205  -0.243  -3.454
  202   2HD2  ASN  23          2HD2      ASN  23   1.458  -0.687  -4.558
  203    H    ILE  24           H        ILE  24   2.215   1.498  -2.654
  204    HA   ILE  24           HA       ILE  24   4.963   1.199  -3.154
  205    HB   ILE  24           HB       ILE  24   4.709   2.888  -4.895
  206   1HG1  ILE  24          2HG1      ILE  24   2.922   4.123  -3.341
  207   2HG1  ILE  24          1HG1      ILE  24   2.979   4.358  -5.083
  208   1HG2  ILE  24          1HG2      ILE  24   2.638   0.748  -4.673
  209   2HG2  ILE  24          2HG2      ILE  24   4.120   0.769  -5.628
  210   3HG2  ILE  24          3HG2      ILE  24   2.747   1.766  -6.109
  211   1HD1  ILE  24          1HD1      ILE  24   0.730   4.037  -4.599
  212   2HD1  ILE  24          2HD1      ILE  24   1.062   2.719  -3.476
  213   3HD1  ILE  24          3HD1      ILE  24   1.263   2.472  -5.210
  214    H    ALA  25           H        ALA  25   3.189   3.259  -1.134
  215    HA   ALA  25           HA       ALA  25   5.234   5.287  -0.956
  216   1HB   ALA  25          1HB       ALA  25   3.042   6.134  -0.688
  217   2HB   ALA  25          2HB       ALA  25   3.747   6.134   0.929
  218   3HB   ALA  25          3HB       ALA  25   2.613   4.866   0.461
  219    H    SER  26           H        SER  26   4.307   2.316   0.526
  220    HA   SER  26           HA       SER  26   5.827   2.743   2.950
  221   1HB   SER  26          2HB       SER  26   4.300   0.436   1.776
  222   2HB   SER  26          1HB       SER  26   5.416   0.159   3.114
  223    HG   SER  26           HG       SER  26   3.204   1.940   3.087
  224    H    THR  27           H        THR  27   6.224   1.047  -0.114
  225    HA   THR  27           HA       THR  27   8.683  -0.202   0.498
  226    HB   THR  27           HB       THR  27   7.011  -0.517  -1.520
  227    HG1  THR  27           1HG      THR  27   8.846  -1.809  -1.154
  228   1HG2  THR  27          1HG2      THR  27   8.982   1.455  -2.635
  229   2HG2  THR  27          2HG2      THR  27   7.224   1.588  -2.607
  230   3HG2  THR  27          3HG2      THR  27   8.000   0.369  -3.617
  231    H    ALA  28           H        ALA  28   7.834   2.886  -0.974
  232    HA   ALA  28           HA       ALA  28  10.309   3.811  -1.752
  233   1HB   ALA  28          1HB       ALA  28   9.201   6.099  -0.851
  234   2HB   ALA  28          2HB       ALA  28   7.774   5.067  -0.943
  235   3HB   ALA  28          3HB       ALA  28   8.766   5.329  -2.377
  236    H    ASN  29           H        ASN  29   8.865   3.851   1.474
  237    HA   ASN  29           HA       ASN  29  10.958   5.334   2.694
  238   1HB   ASN  29          2HB       ASN  29   8.640   3.728   3.649
  239   2HB   ASN  29          1HB       ASN  29   9.937   4.048   4.798
  240   1HD2  ASN  29          1HD2      ASN  29   7.973   5.744   2.379
  241   2HD2  ASN  29          2HD2      ASN  29   7.750   7.178   3.316
  242    H    ASP  30           H        ASP  30  10.127   1.894   3.058
  243    HA   ASP  30           HA       ASP  30  12.424   1.075   4.349
  244   1HB   ASP  30          2HB       ASP  30  10.229  -0.192   2.998
  245   2HB   ASP  30          1HB       ASP  30  11.725  -1.012   2.563
  246    H    VAL  31           H        VAL  31  11.845   1.592   0.929
  247    HA   VAL  31           HA       VAL  31  14.186   0.453  -0.099
  248    HB   VAL  31           HB       VAL  31  12.515   2.753  -1.110
  249   1HG1  VAL  31          1HG1      VAL  31  15.093   1.752  -2.037
  250   2HG1  VAL  31          2HG1      VAL  31  14.251   3.252  -2.426
  251   3HG1  VAL  31          3HG1      VAL  31  13.851   1.766  -3.288
  252   1HG2  VAL  31          1HG2      VAL  31  11.835   0.161  -0.962
  253   2HG2  VAL  31          2HG2      VAL  31  12.657   0.165  -2.522
  254   3HG2  VAL  31          3HG2      VAL  31  11.283   1.236  -2.246
  255    H    PHE  32           H        PHE  32  13.485   3.819   0.768
  256    HA   PHE  32           HA       PHE  32  15.972   4.920   0.229
  257   1HB   PHE  32          2HB       PHE  32  13.904   6.193   0.823
  258   2HB   PHE  32          1HB       PHE  32  14.148   5.721   2.503
  259    HD1  PHE  32           1HD      PHE  32  14.990   7.396   3.811
  260    HD2  PHE  32           2HD      PHE  32  16.283   7.099  -0.231
  261    HE1  PHE  32           1HE      PHE  32  16.461   9.341   4.143
  262    HE2  PHE  32           2HE      PHE  32  17.757   9.042   0.092
  263    HZ   PHE  32           HZ       PHE  32  17.848  10.166   2.281
  264    H    ASN  33           H        ASN  33  15.001   2.854   2.819
  265    HA   ASN  33           HA       ASN  33  17.563   3.332   4.186
  266   1HB   ASN  33          2HB       ASN  33  14.873   2.443   5.149
  267   2HB   ASN  33          1HB       ASN  33  16.312   1.949   6.036
  268   1HD2  ASN  33          1HD2      ASN  33  14.609   4.764   4.770
  269   2HD2  ASN  33          2HD2      ASN  33  15.149   5.863   5.989
  270    H    PHE  34           H        PHE  34  16.457   1.406   1.893
  271    HA   PHE  34           HA       PHE  34  17.543  -1.085   2.995
  272   1HB   PHE  34          2HB       PHE  34  15.569  -0.427   0.896
  273   2HB   PHE  34          1HB       PHE  34  16.625  -1.791   0.545
  274    HD1  PHE  34           1HD      PHE  34  14.869  -3.423   0.603
  275    HD2  PHE  34           2HD      PHE  34  15.617  -0.917   3.959
  276    HE1  PHE  34           1HE      PHE  34  13.456  -4.876   1.998
  277    HE2  PHE  34           2HE      PHE  34  14.207  -2.366   5.361
  278    HZ   PHE  34           HZ       PHE  34  13.124  -4.349   4.381
  279    H    LEU  35           H        LEU  35  18.200   1.426   0.713
  280    HA   LEU  35           HA       LEU  35  20.339  -0.136  -0.535
  281   1HB   LEU  35          2HB       LEU  35  20.138   2.582  -1.480
  282   2HB   LEU  35          1HB       LEU  35  19.982   1.078  -2.368
  283    HG   LEU  35           HG       LEU  35  17.754   2.401  -0.823
  284   1HD1  LEU  35          1HD1      LEU  35  17.742   2.181  -3.779
  285   2HD1  LEU  35          2HD1      LEU  35  18.752   3.429  -3.048
  286   3HD1  LEU  35          3HD1      LEU  35  17.018   3.398  -2.727
  287   1HD2  LEU  35          1HD2      LEU  35  16.735   0.634  -2.714
  288   2HD2  LEU  35          2HD2      LEU  35  16.776   0.410  -0.965
  289   3HD2  LEU  35          3HD2      LEU  35  18.080  -0.228  -1.966
  290    H    LYS  36           H        LYS  36  20.924   0.328   2.053
  291    HA   LYS  36           HA       LYS  36  23.097   2.282   1.852
  292   1HB   LYS  36          2HB       LYS  36  20.837   2.322   3.721
  293   2HB   LYS  36          1HB       LYS  36  22.407   2.440   4.505
  294   1HG   LYS  36          2HG       LYS  36  22.199   4.626   4.115
  295   2HG   LYS  36          1HG       LYS  36  22.693   4.216   2.472
  296   1HD   LYS  36          2HD       LYS  36  19.972   3.731   2.479
  297   2HD   LYS  36          1HD       LYS  36  20.138   5.186   3.464
  298   1HE   LYS  36          2HE       LYS  36  21.129   4.765   0.648
  299   2HE   LYS  36          1HE       LYS  36  19.828   5.833   1.171
  300   1HZ   LYS  36          1HZ       LYS  36  22.163   6.801   0.721
  301   2HZ   LYS  36          2HZ       LYS  36  22.542   6.192   2.253
  302   3HZ   LYS  36          3HZ       LYS  36  21.302   7.330   2.079
  303    HA   PRO  37           HA       PRO  37  24.207  -1.879   3.842
  304   1HB   PRO  37          2HB       PRO  37  25.269  -3.195   1.750
  305   2HB   PRO  37          1HB       PRO  37  23.536  -3.236   2.096
  306   1HG   PRO  37          2HG       PRO  37  25.028  -1.600   0.083
  307   2HG   PRO  37          1HG       PRO  37  23.484  -2.454  -0.091
  308   1HD   PRO  37          2HD       PRO  37  23.693   0.237   0.378
  309   2HD   PRO  37          1HD       PRO  37  22.294  -0.743   0.858
  310    H    LYS  38           H        LYS  38  25.996  -1.428   4.969
  311    HA   LYS  38           HA       LYS  38  28.163   0.082   3.853
  312   1HB   LYS  38          2HB       LYS  38  27.941  -1.332   6.514
  313   2HB   LYS  38          1HB       LYS  38  29.201  -0.190   6.070
  314   1HG   LYS  38          2HG       LYS  38  27.819   1.621   6.243
  315   2HG   LYS  38          1HG       LYS  38  26.367   0.685   5.880
  316   1HD   LYS  38          2HD       LYS  38  26.214  -0.150   8.049
  317   2HD   LYS  38          1HD       LYS  38  27.903   0.211   8.409
  318   1HE   LYS  38          2HE       LYS  38  26.552   2.632   7.724
  319   2HE   LYS  38          1HE       LYS  38  25.621   1.784   8.957
  320   1HZ   LYS  38          1HZ       LYS  38  28.233   3.033   9.140
  321   2HZ   LYS  38          2HZ       LYS  38  28.084   1.549   9.939
  322   3HZ   LYS  38          3HZ       LYS  38  27.045   2.826  10.327
  323    H    LYS  39           H        LYS  39  27.737  -3.262   4.943
  324    HA   LYS  39           HA       LYS  39  30.211  -3.954   3.498
  325   1HB   LYS  39          2HB       LYS  39  30.231  -5.963   5.105
  326   2HB   LYS  39          1HB       LYS  39  30.705  -4.394   5.743
  327   1HG   LYS  39          2HG       LYS  39  28.436  -4.112   6.660
  328   2HG   LYS  39          1HG       LYS  39  28.026  -5.727   6.079
  329   1HD   LYS  39          2HD       LYS  39  29.158  -6.748   7.738
  330   2HD   LYS  39          1HD       LYS  39  30.473  -5.571   7.700
  331   1HE   LYS  39          2HE       LYS  39  29.543  -4.293   9.304
  332   2HE   LYS  39          1HE       LYS  39  27.910  -4.530   8.684
  333   1HZ   LYS  39          1HZ       LYS  39  29.452  -6.443  10.352
  334   2HZ   LYS  39          2HZ       LYS  39  27.923  -6.750   9.696
  335   3HZ   LYS  39          3HZ       LYS  39  28.119  -5.525  10.847
  336    H    ARG  40           H        ARG  40  27.412  -3.844   2.526
  337    HA   ARG  40           HA       ARG  40  27.374  -6.497   1.343
  338   1HB   ARG  40          2HB       ARG  40  25.858  -6.294   3.499
  339   2HB   ARG  40          1HB       ARG  40  24.754  -5.508   2.378
  340   1HG   ARG  40          2HG       ARG  40  24.391  -7.424   1.173
  341   2HG   ARG  40          1HG       ARG  40  25.941  -8.134   1.629
  342   1HD   ARG  40          2HD       ARG  40  24.800  -9.346   3.111
  343   2HD   ARG  40          1HD       ARG  40  24.623  -7.856   4.037
  344    HE   ARG  40           HE       ARG  40  22.589  -9.201   2.490
  345   1HH1  ARG  40          1HH1      ARG  40  23.592  -6.231   4.003
  346   2HH1  ARG  40          2HH1      ARG  40  21.984  -5.602   4.134
  347   1HH2  ARG  40          1HH2      ARG  40  20.467  -8.383   2.652
  348   2HH2  ARG  40          2HH2      ARG  40  20.206  -6.827   3.367
  349    H    LYS  41           H        LYS  41  28.085  -4.135   0.139
  350    HA   LYS  41           HA       LYS  41  26.160  -2.603  -1.090
  351   1HB   LYS  41          2HB       LYS  41  27.784  -2.015  -2.701
  352   2HB   LYS  41          1HB       LYS  41  28.690  -2.379  -1.240
  353   1HG   LYS  41          2HG       LYS  41  28.561  -4.805  -2.560
  354   2HG   LYS  41          1HG       LYS  41  28.802  -3.624  -3.849
  355   1HD   LYS  41          2HD       LYS  41  30.924  -3.272  -3.248
  356   2HD   LYS  41          1HD       LYS  41  30.485  -3.081  -1.550
  357   1HE   LYS  41          2HE       LYS  41  30.388  -5.546  -1.344
  358   2HE   LYS  41          1HE       LYS  41  30.941  -5.679  -3.013
  359   1HZ   LYS  41          1HZ       LYS  41  32.434  -4.483  -0.743
  360   2HZ   LYS  41          2HZ       LYS  41  32.958  -4.454  -2.351
  361   3HZ   LYS  41          3HZ       LYS  41  32.795  -5.930  -1.542
  362    H    ALA  42           H        ALA  42  25.074  -2.703  -3.090
  363    HA   ALA  42           HA       ALA  42  25.010  -5.289  -4.453
  364   1HB   ALA  42          1HB       ALA  42  22.807  -5.750  -4.096
  365   2HB   ALA  42          2HB       ALA  42  22.371  -4.054  -3.886
  366   3HB   ALA  42          3HB       ALA  42  23.171  -4.926  -2.579