*HEADER    HYDROLASE INHIBITOR                     06-DEC-07   2RN4              
*TITLE     SOLUTION STRUCTURE OF THE ALKALINE PROTEINASE INHIBITOR               
*TITLE    2 APRIN FROM PSEUDOMONAS AERUGINOSA                                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROTEINASE INHIBITOR;                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: ALKALINE PROTEINASE INHIBITOR, APRIN;                       
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA;                         
*SOURCE   3 GENE: INH, APRI;                                                     
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: PET22B+                                    
*KEYWDS    PROTEIN, METALLOENZYME INHIBITOR, METALLOPROTEASE INHIBITOR,          
*KEYWDS   2 PERIPLASM, HYDROLASE INHIBITOR                                       
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    S.ARUMUGAM, R.D.GRAY, A.N.LANE                                        
*REVDAT   1   18-NOV-08 2RN4    0                                                


set echo=false end
set wrnlev=0 end
! NOE Distance Restraints
!
!S7
!assign (resid    7 and  name HN   )(resid    7 and  name HB#   ) 3.5 1.0 2.0
!A8
!intra
!assign (resid    8 and  name HN   )(resid    8 and  name HA    ) 3.5 1.0 2.0
!assign (resid    8 and  name HN   )(resid    8 and  name HB*   ) 3.5 1.5 1.5
!assign (resid    8 and  name HB*  )(resid    8 and  name HA    ) 3.5 2.2 1.5
!inter
assign (resid    8 and  name HA   )(resid    9 and  name HA    ) 4.0 1.0 1.5
assign (resid    8 and  name HA   )(resid   11 and  name HB1   ) 4.0 1.5 2.5
!assign (resid    8 and  name HA   )(resid   11 and  name HD1*  ) 3.5 1.0 1.5
!assign (resid    8 and  name HA   )(resid   12 and  name HN    ) 3.5 1.0 1.5
!assign (resid    8 and  name HA   )(resid   12 and  name HB*   ) 4.0 1.0 1.5
!assign (resid    8 and  name HB*  )(resid   32 and  name HB1   ) 3.5 1.5 1.5
!assign (resid    8 and  name HB*  )(resid   32 and  name HB2   ) 3.5 1.0 1.5
!assign (resid    8 and  name HB*  )(resid   41 and  name HB1   ) 4.0 1.0 1.5
assign (resid    8 and  name HB*  )(resid   63 and  name HG1   ) 4.0 1.5 1.5
!S9
!intra
!assign (resid    9 and  name HN   )(resid    9 and  name HA    ) 3.5 1.5 1.5
!assign (resid    9 and  name HN   )(resid    9 and  name HB#   ) 3.5 1.0 1.5
!assign (resid    9 and  name HA   )(resid    9 and  name HB2   ) 3.5 2.2 1.5
!assign (resid    9 and  name HA   )(resid    9 and  name HB1   ) 3.5 1.5 1.5
!assign (resid    9 and  name HB1  )(resid    9 and  name HB2   ) 3.5 2.2 1.5
!inter
assign (resid    9 and  name HN   )(resid    8 and  name HA    ) 3.5 1.5 1.0
assign (resid    9 and  name HN   )(resid    8 and  name HB*   ) 3.5 1.0 1.5
assign (resid    9 and  name HN   )(resid   10 and  name HN    ) 3.5 2.2 1.5
!assign (resid    9 and  name HN   )(resid   32 and  name HB#   ) 4.0 2.2 1.5
assign (resid    9 and  name HA   )(resid   11 and  name HN    ) 3.5 1.5 1.5
assign (resid    9 and  name HA   )(resid    8 and  name HB*   ) 4.0 1.0 1.5
!assign (resid    9 and  name HA   )(resid   12 and  name HB*   ) 3.5 1.5 2.5
!assign (resid    9 and  name HA   )(resid   32 and  name HB1   ) 3.5 1.0 1.5
!assign (resid    9 and  name HA   )(resid   32 and  name HB2   ) 3.5 2.2 1.5
!D10
!intra
!assign (resid   10 and  name HN   )(resid   10 and  name HA    ) 3.5 1.0 1.5
!assign (resid   10 and  name HA   )(resid   10 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   10 and  name HA   )(resid   10 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   10 and  name HB1  )(resid   10 and  name HN    ) 4.0 1.0 1.5
!assign (resid   10 and  name HB1  )(resid   10 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   10 and  name HB2  )(resid   10 and  name HN    ) 4.0 1.0 1.5
!inter
assign (resid   10 and  name HN   )(resid    9 and  name HB#   ) 3.5 1.0 1.5
assign (resid   10 and  name HN   )(resid    9 and  name HA    ) 4.0 2.2 1.0
assign (resid   10 and  name HN   )(resid   11 and  name HN    ) 3.5 2.2 1.5
assign (resid   10 and  name HA   )(resid   11 and  name HN    ) 3.5 1.0 1.5
!assign (resid   10 and  name HB1  )(resid    9 and  name HB1   ) 4.0 1.0 1.8
assign (resid   10 and  name HB1  )(resid   11 and  name HN    ) 3.5 1.0 1.5
assign (resid   10 and  name HB1  )(resid   11 and  name HG    ) 3.5 2.2 1.5
assign (resid   10 and  name HB2  )(resid   11 and  name HN    ) 4.0 1.2 1.5
!assign (resid   10 and  name HB2  )(resid    9 and  name HB1   ) 4.5 1.0 1.8
assign (resid   10 and  name HB2  )(resid   11 and  name HG    ) 3.5 1.0 1.5
!L11
!intra
!assign (resid   11 and  name HN   )(resid   11 and  name HA    ) 3.5 1.0 1.5
!assign (resid   11 and  name HN   )(resid   11 and  name HD1*  ) 4.0 1.0 1.0
!assign (resid   11 and  name HN   )(resid   11 and  name HD2*  ) 4.0 1.0 1.0
!assign (resid   11 and  name HA   )(resid   11 and  name HG    ) 3.5 2.2 1.0
!assign (resid   11 and  name HA   )(resid   11 and  name HD1*  ) 4.0 1.0 1.5
!assign (resid   11 and  name HA   )(resid   11 and  name HD2*  ) 3.5 2.2 1.0
!assign (resid   11 and  name HB1  )(resid   11 and  name HN    ) 3.5 2.2 1.0
!assign (resid   11 and  name HB1  )(resid   11 and  name HG    ) 3.5 2.2 1.0
!assign (resid   11 and  name HB1  )(resid   11 and  name HB2   ) 3.5 2.2 1.0
!assign (resid   11 and  name HB1  )(resid   11 and  name HD1*  ) 3.5 2.2 1.0
!assign (resid   11 and  name HB1  )(resid   11 and  name HD2*  ) 3.5 1.0 1.5
!assign (resid   11 and  name HB2  )(resid   11 and  name HN    ) 3.5 1.0 1.5
!assign (resid   11 and  name HB2  )(resid   11 and  name HG    ) 3.5 2.2 1.0
!assign (resid   11 and  name HB2  )(resid   11 and  name HD1*  ) 3.5 2.2 1.0
!assign (resid   11 and  name HB2  )(resid   11 and  name HD2*  ) 3.5 2.2 1.0
!assign (resid   11 and  name HG   )(resid   11 and  name HN    ) 3.5 1.0 1.5
!assign (resid   11 and  name HG   )(resid   11 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   11 and  name HG   )(resid   11 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   11 and  name HD1* )(resid   11 and  name HD2*  ) 3.5 2.2 1.5
!inter
assign (resid   11 and  name HN   )(resid    8 and  name HA    ) 4.0 2.2 1.0
assign (resid   11 and  name HN   )(resid    9 and  name HN    ) 4.0 1.3 1.0
assign (resid  11 and  name HA   )(resid   12 and  name HN    ) 3.5 2.2 1.5
assign (resid   11 and  name HA   )(resid   30 and  name HD2*  ) 4.0 1.0 2.5
assign (resid   11 and  name HB1  )(resid   12 and  name HN    ) 3.0 1.0 1.5
!assign (resid   11 and  name HB1  )(resid   30 and  name HD2*  ) 3.5 2.2 1.0
assign (resid   11 and  name HB2  )(resid   12 and  name HN    ) 3.5 1.5 1.5
assign (resid   11 and  name HB2  )(resid   30 and  name HD2*  ) 4.0 1.0 1.5
!assign (resid   11 and  name HD1* )(resid   30 and  name HD2*  ) 4.0 1.0 1.5
assign (resid   11 and  name HD1* )(resid   63 and  name HB#   ) 3.5 1.5 1.5
!assign (resid   11 and  name HD1* )(resid   68 and  name HD1*  ) 4.0 1.0 1.5
!assign (resid   11 and  name HD2* )(resid   30 and  name HD2*  ) 4.0 1.0 1.5
assign (resid   11 and  name HD2* )(resid   68 and  name HD1*  ) 4.0 1.0 2.5
!A12
!intra
!assign (resid   12 and  name HN   )(resid   12 and  name HA    ) 3.5 1.5 1.5
!assign (resid   12 and  name HN   )(resid   12 and  name HB*   ) 3.5 1.5 1.5
!assign (resid   12 and  name HA   )(resid   12 and  name HB*   ) 3.5 2.2 1.5
!inter
assign (resid   12 and  name HN   )(resid   11 and  name HN    ) 3.5 1.5 1.5
!assign (resid   12 and  name HN   )(resid   11 and  name HD1*  ) 4.0 2.2 1.0
assign (resid   12 and  name HA   )(resid   15 and  name HE1   ) 4.0 1.0 2.5
assign (resid   12 and  name HA   )(resid   30 and  name HN    ) 4.0 1.0 1.5
assign (resid   12 and  name HA   )(resid   30 and  name HB1   ) 3.5 2.2 1.5
assign (resid   12 and  name HA   )(resid   30 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   12 and  name HA   )(resid   30 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   12 and  name HA   )(resid   30 and  name HD2*  ) 3.5 1.5 1.5
assign (resid   12 and  name HA   )(resid   31 and  name HN    ) 4.0 1.0 1.8
!assign (resid   12 and  name HA   )(resid   61 and  name HE1   ) 4.0 1.0 1.8
assign (resid   12 and  name HB*  )(resid   30 and  name HB1   ) 4.0 1.0 2.0
assign (resid   12 and  name HB*  )(resid   30 and  name HB2   ) 4.0 1.0 1.5
assign (resid   12 and  name HB*  )(resid   31 and  name HA    ) 4.0 1.0 2.0
!G13
!intra
!assign (resid   13 and  name HN   )(resid   13 and  name HA#   ) 3.5 1.5 1.5
!inter
assign (resid   13 and  name HN   )(resid   12 and  name HA    ) 2.5 0.7 1.0
assign (resid   13 and  name HN   )(resid   12 and  name HB*   ) 3.8 2.2 1.2
assign (resid   13 and  name HN   )(resid   14 and  name HN    ) 4.0 1.0 1.0
assign (resid   13 and  name HN   )(resid   30 and  name HN    ) 3.5 1.5 1.5
!assign (resid   13 and  name HN   )(resid   30 and  name HD1*  ) 4.0 2.2 1.0
!assign (resid   13 and  name HN   )(resid   30 and  name HD2*  ) 4.0 2.2 1.0
!Q14
!intra
!assign (resid   14 and  name HN   )(resid   14 and  name HA    ) 3.5 1.0 1.5
!assign (resid   14 and  name HN   )(resid   14 and  name HG#   ) 3.5 1.5 1.5
!assign (resid   14 and  name HA   )(resid   14 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   14 and  name HA   )(resid   14 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   14 and  name HA   )(resid   14 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   14 and  name HB1  )(resid   14 and  name HN    ) 3.5 2.2 1.5
!assign (resid   14 and  name HB1  )(resid   14 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   14 and  name HB1  )(resid   14 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   14 and  name HB2  )(resid   14 and  name HN    ) 3.5 1.0 1.5
!assign (resid   14 and  name HB2  )(resid   14 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   14 and  name HG1  )(resid   14 and  name HG2   ) 3.5 2.2 1.5
assign (resid   14 and  name HG#  )(resid   14 and  name HE2#  ) 3.5 2.2 1.5
!inter
assign (resid   14 and  name HN   )(resid   13 and  name HA#   ) 3.5 1.5 1.5
assign (resid   14 and  name HN   )(resid  104 and  name HB*   ) 4.0 2.2 1.0
assign (resid   14 and  name HA   )(resid   29 and  name HB1   ) 4.0 1.0 1.8
assign (resid   14 and  name HA   )(resid   29 and  name HB2   ) 4.0 1.0 1.8
assign (resid   14 and  name HA   )(resid   30 and  name HN    ) 3.5 1.0 1.5
assign (resid   14 and  name HA   )(resid  104 and  name HB*   ) 4.0 1.0 1.5
assign (resid   14 and  name HB1  )(resid   15 and  name HN    ) 4.0 1.0 1.5
assign (resid   14 and  name HB1  )(resid  104 and  name HB*   ) 3.5 2.2 1.5
assign (resid   14 and  name HB2  )(resid   15 and  name HN    ) 3.5 1.0 1.5
!assign (resid   14 and  name HB2  )(resid   30 and  name HN    ) 4.0 1.0 1.8
assign (resid   14 and  name HB2  )(resid  104 and  name HB*   ) 3.5 2.2 1.5
!assign (resid   14 and  name HG1  )(resid   28 and  name HN    ) 4.0 1.0 1.5
!assign (resid   14 and  name HG1  )(resid   29 and  name HN    ) 4.0 1.0 1.5
!assign (resid   14 and  name HG1  )(resid   30 and  name HN    ) 4.0 1.0 1.5
!assign (resid   14 and  name HG2  )(resid   28 and  name HN    ) 4.0 1.0 1.5
!assign (resid   14 and  name HG2  )(resid   29 and  name HN    ) 4.0 1.0 1.5
!assign (resid   14 and  name HG2  )(resid   30 and  name HN    ) 4.0 1.0 1.5
!W15
!intra
!assign (resid   15 and  name HN   )(resid   15 and  name HA    ) 3.5 1.0 1.5
!assign (resid   15 and  name HA   )(resid   15 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   15 and  name HA   )(resid   15 and  name HB2   ) 3.5 1.5 1.5
!assign (resid   15 and  name HB1  )(resid   15 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   15 and  name HB2  )(resid   15 and  name HN    ) 3.5 1.0 1.5
!inter
assign (resid   15 and  name HN   )(resid   30 and  name HN    ) 4.0 1.0 1.0
assign (resid   15 and  name HN   )(resid  104 and  name HN    ) 4.0 1.0 1.0
assign (resid   15 and  name HN   )(resid   14 and  name HA    ) 2.5 0.7 2.0
assign (resid   15 and  name HN   )(resid   28 and  name HB#   ) 4.0 1.0 1.0
!assign (resid   15 and  name HN   )(resid   30 and  name HD2#  ) 4.0 1.0 1.0
assign (resid   15 and  name HA   )(resid   14 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   15 and  name HA   )(resid  101 and  name HD1*  ) 4.0 1.0 1.5
!assign (resid   15 and  name HA   )(resid  101 and  name HD2*  ) 3.5 1.0 1.5
assign (resid   15 and  name HA   )(resid  103 and  name HA    ) 3.5 2.2 1.5
assign (resid   15 and  name HA   )(resid  104 and  name HB#   ) 3.5 2.2 1.5
assign (resid   15 and  name HB1  )(resid   16 and  name HN    ) 3.5 1.5 1.5
assign (resid   15 and  name HB1  )(resid   28 and  name HB1   ) 4.0 1.2 2.0
assign (resid   15 and  name HB1  )(resid   28 and  name HB2   ) 4.0 1.2 1.5
assign (resid   15 and  name HB1  )(resid  101 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   15 and  name HB1  )(resid  101 and  name HD2*  ) 3.5 2.2 1.5
assign (resid   15 and  name HB2  )(resid   16 and  name HN    ) 3.5 1.5 1.5
assign (resid   15 and  name HB2  )(resid   28 and  name HB1   ) 4.0 1.0 1.5
assign (resid   15 and  name HB2  )(resid   28 and  name HB2   ) 4.0 1.0 1.5
assign (resid   15 and  name HB2  )(resid  101 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   15 and  name HD1  )(resid   13 and  name HA2   ) 3.5 2.2 1.5
assign (resid   15 and  name HD1  )(resid   14 and  name HA    ) 3.5 2.2 1.5
!assign (resid   15 and  name HD1  )(resid   28 and  name HB1   ) 3.5 2.2 1.5
assign (resid   15 and  name HD1  )(resid   30 and  name HN    ) 3.5 2.2 1.5
assign (resid   15 and  name HD1  )(resid   30 and  name HB1   ) 3.5 2.2 1.5
assign (resid   15 and  name HD1  )(resid   30 and  name HB2   ) 3.5 2.2 1.5
assign (resid   15 and  name HD1  )(resid   30 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   15 and  name HD1  )(resid   30 and  name HD2*  ) 3.5 2.2 1.5
assign (resid   15 and  name HZ2  )(resid   11 and  name HA    ) 3.5 2.2 1.5
assign (resid   15 and  name HZ2  )(resid   11 and  name HB#   ) 3.5 2.2 2.0
assign (resid   15 and  name HZ2  )(resid   11 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   15 and  name HZ2  )(resid   30 and  name HD1*  ) 3.5 1.5 2.5
assign (resid   15 and  name HZ2  )(resid   68 and  name HD1*  ) 3.5 1.5 2.5
!assign (resid   15 and  name HZ2  )(resid   87 and  name HA1   ) 3.5 2.2 1.5
!assign (resid   15 and  name HZ2  )(resid  103 and  name HD#   ) 3.5 2.2 1.5
!assign (resid   15 and  name HH2  )(resid   11 and  name HB2   ) 3.5 2.2 1.5
assign (resid   15 and  name HH2  )(resid   11 and  name HD2*  ) 3.5 2.2 1.5
assign (resid   15 and  name HH2  )(resid   68 and  name HD1*  ) 3.5 2.2 2.5
assign (resid   15 and  name HH2  )(resid   87 and  name HA2   ) 3.5 2.2 1.5
assign (resid   15 and  name HH2  )(resid  103 and  name HD#   ) 3.5 2.2 1.5
assign (resid   15 and  name HZ3  )(resid   87 and  name HA1   ) 3.5 2.2 1.5
assign (resid   15 and  name HZ3  )(resid   88 and  name HA    ) 3.5 2.2 1.5
!assign (resid   15 and  name HZ3  )(resid  101 and  name HB2   ) 3.5 2.2 1.5
assign (resid   15 and  name HZ3  )(resid  101 and  name HG    ) 3.5 2.2 1.5
assign (resid   15 and  name HZ3  )(resid  101 and  name HD2*  ) 3.5 2.2 2.5
assign (resid   15 and  name HZ3  )(resid  102 and  name HA    ) 3.5 2.2 1.5
assign (resid   15 and  name HZ3  )(resid  103 and  name HN    ) 3.5 2.2 1.5
assign (resid   15 and  name HE3  )(resid   15 and  name HB2   ) 3.5 2.2 1.5
assign (resid   15 and  name HE3  )(resid   16 and  name HN    ) 3.5 2.2 1.5
assign (resid   15 and  name HE3  )(resid  101 and  name HB1   ) 3.5 2.2 1.5
assign (resid   15 and  name HE3  )(resid  101 and  name HB2   ) 3.5 2.2 1.5
assign (resid   15 and  name HE3  )(resid  101 and  name HG    ) 3.5 2.2 1.5
assign (resid   15 and  name HE3  )(resid  101 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   15 and  name HE3  )(resid  101 and  name HD2*  ) 3.5 2.2 1.5
assign (resid   15 and  name HE3  )(resid  102 and  name HN    ) 3.5 2.2 1.5
assign (resid   15 and  name HE3  )(resid  102 and  name HA    ) 3.5 2.2 1.5
assign (resid   15 and  name HE3  )(resid  103 and  name HN    ) 3.5 2.2 1.5
assign (resid   15 and  name HE3  )(resid  103 and  name HA    ) 3.5 2.2 1.5
!T16
!intra
!assign (resid   16 and  name HN   )(resid   16 and  name HA    ) 3.5 1.0 1.5
!assign (resid   16 and  name HN   )(resid   16 and  name HB    ) 3.5 1.0 1.5
!assign (resid   16 and  name HA   )(resid   16 and  name HB    ) 3.5 2.2 1.5
!assign (resid   16 and  name HA   )(resid   16 and  name HG2*  ) 3.5 1.5 1.5
!assign (resid   16 and  name HB   )(resid   16 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid   16 and  name HG2* )(resid   16 and  name HN    ) 3.5 1.5 1.5
!inter
assign (resid   16 and  name HN   )(resid   15 and  name HN    ) 4.0 1.0 1.0
assign (resid   16 and  name HN   )(resid  102 and  name HN    ) 3.0 1.0 1.5
assign (resid   16 and  name HN   )(resid   17 and  name HN    ) 4.0 1.0 1.0
assign (resid   16 and  name HN   )(resid  104 and  name HN    ) 3.5 1.0 1.5 ! Strong
assign (resid   16 and  name HN   )(resid  101 and  name HA    ) 4.0 1.0 1.0
assign (resid   16 and  name HN   )(resid   15 and  name HA    ) 3.0 1.0 1.0
assign (resid   16 and  name HN   )(resid  104 and  name HA    ) 4.0 1.0 1.0
assign (resid   16 and  name HN   )(resid  101 and  name HG    ) 3.5 1.0 1.5
assign (resid   16 and  name HN   )(resid  101 and  name HD1*  ) 3.5 1.0 2.0
assign (resid   16 and  name HA   )(resid   15 and  name HB2   ) 4.0 1.0 1.5
assign (resid   16 and  name HA   )(resid   17 and  name HB1   ) 4.0 1.0 1.5
assign (resid   16 and  name HA   )(resid   28 and  name HN    ) 3.0 1.0 1.5
assign (resid   16 and  name HA   )(resid   28 and  name HB1   ) 3.0 1.0 1.5
assign (resid   16 and  name HA   )(resid   28 and  name HG    ) 4.0 1.0 1.5
assign (resid   16 and  name HB   )(resid   17 and  name HB1   ) 4.0 1.0 2.0
assign (resid   16 and  name HB   )(resid   27 and  name HA    ) 4.0 1.0 2.0
assign (resid   16 and  name HB   )(resid   28 and  name HN    ) 4.0 1.0 2.0
assign (resid   16 and  name HB   )(resid   28 and  name HB1   ) 4.0 1.0 3.0
assign (resid   16 and  name HG2* )(resid   17 and  name HN    ) 4.0 1.0 1.5
!assign (resid   16 and  name HG2* )(resid   27 and  name HE1   ) 4.0 1.0 1.5
assign (resid   16 and  name HG2* )(resid   28 and  name HN    ) 4.0 1.0 1.5
assign (resid   16 and  name HG2* )(resid  104 and  name HA    ) 4.0 1.0 1.5
assign (resid   16 and  name HG2* )(resid  104 and  name HB*   ) 3.5 1.0 1.5
!L17
!intra
!assign (resid   17 and  name HN   )(resid   17 and  name HA    ) 3.0 1.0 1.0
!assign (resid   17 and  name HN   )(resid   17 and  name HD1*  ) 4.0 1.0 1.0
!assign (resid   17 and  name HA   )(resid   17 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   17 and  name HA   )(resid   17 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   17 and  name HA   )(resid   17 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   17 and  name HB1  )(resid   17 and  name HN    ) 3.5 1.0 1.5
!assign (resid   17 and  name HB1  )(resid   17 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   17 and  name HB1  )(resid   17 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   17 and  name HB2  )(resid   17 and  name HN    ) 3.5 1.5 1.5
!assign (resid   17 and  name HB2  )(resid   17 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   17 and  name HG   )(resid   17 and  name HN    ) 4.0 1.0 1.8
!assign (resid   17 and  name HG   )(resid   17 and  name HA    ) 3.5 1.0 1.5
!assign (resid   17 and  name HG   )(resid   17 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   17 and  name HG   )(resid   17 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   17 and  name HD2* )(resid   17 and  name HN    ) 4.0 1.0 1.5
!assign (resid   17 and  name HD2* )(resid   17 and  name HA    ) 4.0 1.0 1.5
!assign (resid   17 and  name HD2* )(resid   17 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   17 and  name HD2* )(resid   17 and  name HB2   ) 3.5 1.0 1.5
!inter
assign (resid   17 and  name HN   )(resid   28 and  name HN    ) 3.5 1.0 1.5
assign (resid   17 and  name HN   )(resid   18 and  name HN    ) 3.5 1.0 1.5
assign (resid   17 and  name HN   )(resid   16 and  name HA    ) 3.0 1.0 1.0
assign (resid   17 and  name HN   )(resid   16 and  name HB    ) 3.0 1.0 1.0
assign (resid   17 and  name HN   )(resid   26 and  name HB#   ) 4.0 1.0 1.0
assign (resid   17 and  name HA   )(resid   18 and  name HB1   ) 4.0 1.0 1.5
assign (resid   17 and  name HA   )(resid   18 and  name HB2   ) 4.0 1.0 1.5
assign (resid   17 and  name HA   )(resid  101 and  name HA    ) 3.5 2.2 1.5
assign (resid   17 and  name HB1  )(resid   26 and  name HB1   ) 3.5 1.0 1.5
assign (resid   17 and  name HB1  )(resid   26 and  name HB2   ) 4.0 1.0 1.5
assign (resid   17 and  name HB1  )(resid   50 and  name HD2*  ) 3.5 1.0 1.5
assign (resid   17 and  name HB1  )(resid  101 and  name HA    ) 4.0 1.0 1.8
assign (resid   17 and  name HB2  )(resid   26 and  name HB1   ) 3.5 1.0 1.5
assign (resid   17 and  name HB2  )(resid   26 and  name HB2   ) 3.5 1.5 1.5
assign (resid   17 and  name HB2  )(resid  101 and  name HA    ) 4.0 1.0 1.8
assign (resid   17 and  name HG   )(resid   18 and  name HN    ) 3.5 1.0 1.5
!assign (resid   17 and  name HG   )(resid   26 and  name HB1   ) 4.0 1.0 1.8
assign (resid   17 and  name HG   )(resid   50 and  name HD2*  ) 3.5 1.0 2.0
assign (resid   17 and  name HG   )(resid   99 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   17 and  name HG   )(resid   99 and  name HD2*  ) 4.0 1.0 1.5
assign (resid   17 and  name HG   )(resid  101 and  name HA    ) 4.0 1.0 1.5
assign (resid   17 and  name HD1* )(resid   18 and  name HN    ) 3.5 1.0 1.5
!assign (resid   17 and  name HD1* )(resid   89 and  name HA    ) 4.0 1.0 1.5
!assign (resid   17 and  name HD1* )(resid   89 and  name HB1   ) 4.0 1.0 1.8
!assign (resid   17 and  name HD1* )(resid   99 and  name HD1*  ) 4.0 1.0 1.5
!assign (resid   17 and  name HD1* )(resid   99 and  name HD2*  ) 3.5 2.2 1.5
assign (resid   17 and  name HD1* )(resid  100 and  name HN    ) 3.5 1.0 2.0
assign (resid   17 and  name HD1* )(resid  101 and  name HA    ) 3.5 2.2 1.5
assign (resid   17 and  name HD1* )(resid  101 and  name HB1   ) 3.5 2.2 1.5
assign (resid   17 and  name HD1* )(resid  101 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   17 and  name HD2* )(resid   18 and  name HN    ) 4.0 1.0 1.5
assign (resid   17 and  name HD2* )(resid   26 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   17 and  name HD2* )(resid   26 and  name HB2   ) 4.0 1.0 1.5
assign (resid   17 and  name HD2* )(resid   50 and  name HA    ) 4.0 1.0 1.8
assign (resid   17 and  name HD2* )(resid   50 and  name HD2*  ) 3.5 2.2 1.5
assign (resid   17 and  name HD2* )(resid   99 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   17 and  name HD2* )(resid   99 and  name HD2*  ) 4.0 1.0 2.0
!Q18
!intra
!assign (resid   18 and  name HN   )(resid   18 and  name HA    ) 3.0 1.0 1.0
!assign (resid   18 and  name HN   )(resid   18 and  name HB#   ) 4.0 1.0 1.0
!assign (resid   18 and  name HA   )(resid   18 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   18 and  name HA   )(resid   18 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   18 and  name HG#  )(resid   18 and  name HN    ) 3.5 1.0 1.5
assign (resid   18 and  name HG#  )(resid   18 and  name HE2#  ) 3.5 1.5 1.5
!inter
assign (resid   18 and  name HN   )(resid   19 and  name HN    ) 4.0 1.0 1.0
assign (resid   18 and  name HN   )(resid  101 and  name HA    ) 4.0 1.0 1.0
assign (resid   18 and  name HN   )(resid   17 and  name HA    ) 3.0 1.2 0.5
assign (resid   18 and  name HN   )(resid   17 and  name HB#   ) 4.0 1.0 1.0
assign (resid   18 and  name HA   )(resid   17 and  name HA    ) 4.0 1.0 1.8
assign (resid   18 and  name HA   )(resid   25 and  name HG2*  ) 4.0 1.0 2.0
assign (resid   18 and  name HA   )(resid   25 and  name HD1*  ) 4.0 1.0 2.0
!assign (resid   18 and  name HB#  )(resid   25 and  name HG2*  ) 3.5 1.0 1.5
assign (resid   18 and  name HB#  )(resid   25 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   18 and  name HG#  )(resid   19 and  name HN    ) 3.5 1.0 1.5
assign (resid   18 and  name HG#  )(resid   25 and  name HG2*  ) 4.0 1.0 2.0
assign (resid   18 and  name HG#  )(resid   25 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   18 and  name HG#  )(resid  100 and  name HB    ) 4.0 1.0 1.5
!Q19
!intra
!assign (resid   19 and  name HN   )(resid   19 and  name HB#   ) 3.0 1.0 1.0
!assign (resid   19 and  name HN   )(resid   19 and  name HG#   ) 4.0 1.0 1.0
!assign (resid   19 and  name HA   )(resid   19 and  name HN    ) 4.0 1.5 1.5
!assign (resid   19 and  name HA   )(resid   19 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   19 and  name HA   )(resid   19 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   19 and  name HB1  )(resid   19 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   19 and  name HB1  )(resid   19 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   19 and  name HB2  )(resid   19 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   19 and  name HB2  )(resid   19 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   19 and  name HG1  )(resid   19 and  name HG2   ) 3.5 2.2 1.5
!inter
assign (resid   19 and  name HN   )(resid   18 and  name HA    ) 3.0 1.5 1.0
assign (resid   19 and  name HN   )(resid   18 and  name HB#   ) 3.0 1.0 1.5
!assign (resid   19 and  name HN   )(resid   22 and  name HB*   ) 4.0 1.0 1.0
assign (resid   19 and  name HN   )(resid   99 and  name HD2*  ) 4.0 1.0 1.5
assign (resid   19 and  name HA   )(resid   20 and  name HA    ) 4.0 1.0 1.8
assign (resid   19 and  name HA   )(resid   99 and  name HB2   ) 4.0 1.0 1.5
assign (resid   19 and  name HA   )(resid   99 and  name HG    ) 4.0 1.0 1.5
!assign (resid   19 and  name HA   )(resid   99 and  name HD1*  ) 4.0 1.0 2.5
assign (resid   19 and  name HA   )(resid   99 and  name HD2*  ) 3.5 2.2 1.5
assign (resid   19 and  name HA   )(resid  100 and  name HN    ) 3.5 1.5 1.5
assign (resid   19 and  name HB1  )(resid   53 and  name HE1   ) 4.0 1.0 1.5
!assign (resid   19 and  name HB1  )(resid   99 and  name HD1*  ) 4.0 1.0 1.8
assign (resid   19 and  name HB1  )(resid   99 and  name HD2*  ) 4.0 1.5 2.0
assign (resid   19 and  name HB2  )(resid   53 and  name HE1   ) 4.0 1.0 1.5
assign (resid   19 and  name HB2  )(resid   99 and  name HD2*  ) 3.5 1.5 1.5
!assign (resid   19 and  name HG1  )(resid   20 and  name HN    ) 3.5 1.0 1.5
assign (resid   19 and  name HG1  )(resid   99 and  name HD2*  ) 4.0 1.0 2.0
!assign (resid   19 and  name HG2  )(resid   20 and  name HN    ) 4.0 1.0 1.5
!assign (resid   19 and  name HG2  )(resid   99 and  name HD2*  ) 3.5 2.2 1.5
!D20
!intra
!assign (resid   20 and  name HN   )(resid   20 and  name HA    ) 3.0 1.0 0.5
!assign (resid   20 and  name HN   )(resid   20 and  name HB#   ) 4.0 1.0 1.0
!assign (resid   20 and  name HA   )(resid   20 and  name HB#   ) 3.5 2.2 1.5
!inter
assign (resid   20 and  name HN   )(resid   98 and  name HN    ) 4.0 1.5 1.0
assign (resid   20 and  name HN   )(resid   21 and  name HN    ) 4.0 1.0 1.0
assign (resid   20 and  name HN   )(resid   19 and  name HB#   ) 4.0 1.0 1.0
assign (resid   20 and  name HN   )(resid   98 and  name HB#   ) 4.0 1.0 1.0
assign (resid   20 and  name HN   )(resid  100 and  name HG2*  ) 3.5 1.0 1.5
!assign (resid   20 and  name HN   )(resid   99 and  name HD2*  ) 4.0 1.0 1.0
!assign (resid   20 and  name HA   )(resid   19 and  name HG1   ) 4.0 1.0 1.5
!assign (resid   20 and  name HA   )(resid   21 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   20 and  name HA   )(resid   21 and  name HG#   ) 3.5 1.0 1.5
assign (resid   20 and  name HA   )(resid   98 and  name HB2   ) 4.0 1.5 1.5
assign (resid   20 and  name HA   )(resid  100 and  name HG2*  ) 4.0 1.0 1.5
assign (resid   20 and  name HB1  )(resid   21 and  name HN    ) 3.5 2.2 1.5
!assign (resid   20 and  name HB1  )(resid   21 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   20 and  name HB1  )(resid   21 and  name HG#   ) 4.0 1.0 1.5
!assign (resid   20 and  name HB1  )(resid   22 and  name HA    ) 4.0 1.0 1.5
assign (resid   20 and  name HB1  )(resid   98 and  name HN    ) 4.0 1.0 1.5
assign (resid   20 and  name HB1  )(resid   98 and  name HB2   ) 4.0 1.5 1.5
!assign (resid   20 and  name HB1  )(resid  100 and  name HG2*  ) 4.0 1.0 1.8
assign (resid   20 and  name HB2  )(resid   21 and  name HN    ) 3.5 2.2 1.5
!assign (resid   20 and  name HB2  )(resid   21 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   20 and  name HB2  )(resid   21 and  name HG#   ) 3.5 1.0 1.5
assign (resid   20 and  name HB2  )(resid   98 and  name HN    ) 4.0 1.0 1.8
assign (resid   20 and  name HB2  )(resid   98 and  name HB2   ) 4.0 1.0 1.5
!assign (resid   20 and  name HB2  )(resid  100 and  name HG2*  ) 4.0 1.0 1.8
!E21
!intra
!assign (resid   21 and  name HN   )(resid   21 and  name HA    ) 3.5 1.0 0.5
!assign (resid   21 and  name HN   )(resid   21 and  name HB#   ) 3.0 1.0 1.0
!assign (resid   21 and  name HN   )(resid   21 and  name HG#   ) 4.0 1.0 1.0
!assign (resid   21 and  name HA   )(resid   21 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   21 and  name HA   )(resid   21 and  name HB2   ) 3.5 1.5 1.5
!assign (resid   21 and  name HB1  )(resid   21 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   21 and  name HG1  )(resid   21 and  name HA    ) 3.5 2.2 1.5
!assign (resid   21 and  name HG1  )(resid   21 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   21 and  name HG2  )(resid   21 and  name HA    ) 3.5 2.2 1.5
!assign (resid   21 and  name HG2  )(resid   21 and  name HB2   ) 3.5 2.2 1.5
!inter
assign (resid   21 and  name HN   )(resid   20 and  name HA    ) 3.5 1.0 1.0
!assign (resid   21 and  name HN   )(resid   22 and  name HB*   ) 4.0 1.0 1.0
!assign (resid   21 and  name HA   )(resid   20 and  name HB#   ) 4.0 1.0 1.5
assign (resid   21 and  name HA   )(resid   22 and  name HN    ) 3.5 1.0 1.5
!A22
!intra
!assign (resid   22 and  name HN   )(resid   22 and  name HB*   ) 3.0 1.0 1.2
!assign (resid   22 and  name HA   )(resid   22 and  name HN    ) 3.5 2.2 1.5
!assign (resid   22 and  name HA   )(resid   22 and  name HB*   ) 3.5 2.2 1.5
!inter
assign (resid   22 and  name HN   )(resid   20 and  name HN    ) 4.0 1.5 1.0
assign (resid   22 and  name HN   )(resid   20 and  name HA    ) 4.0 1.0 1.0
assign (resid   22 and  name HN   )(resid   20 and  name HB#   ) 3.0 1.0 2.0
assign (resid   22 and  name HN   )(resid   21 and  name HB#   ) 4.0 1.0 1.0
assign (resid   22 and  name HB*  )(resid   19 and  name HB2   ) 4.0 1.0 2.0
!assign (resid   22 and  name HB*  )(resid   19 and  name HG1   ) 3.5 1.0 1.5
assign (resid   22 and  name HB*  )(resid   19 and  name HG2   ) 3.5 1.0 1.5
!assign (resid   22 and  name HB*  )(resid   20 and  name HB1   ) 4.0 1.0 1.5
assign (resid   22 and  name HB*  )(resid   23 and  name HD#   ) 3.5 2.2 1.5
!P23
!intra
!assign (resid   23 and  name HA   )(resid   23 and  name HB1   ) 3.5 1.5 1.5
!assign (resid   23 and  name HA   )(resid   23 and  name HB2   ) 3.5 1.5 1.5
!assign (resid   23 and  name HA   )(resid   23 and  name HD#   ) 3.5 1.5 1.5
!assign (resid   23 and  name HB1  )(resid   23 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   23 and  name HB1  )(resid   23 and  name HD#   ) 4.0 1.0 1.5
!assign (resid   23 and  name HB2  )(resid   23 and  name HD#   ) 3.5 1.5 1.5
!assign (resid   23 and  name HG1  )(resid   23 and  name HA    ) 4.0 1.0 1.5
!assign (resid   23 and  name HG1  )(resid   23 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   23 and  name HG1  )(resid   23 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   23 and  name HG1  )(resid   23 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   23 and  name HG1  )(resid   23 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   23 and  name HG2  )(resid   23 and  name HA    ) 4.0 1.0 1.5
!assign (resid   23 and  name HG2  )(resid   23 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   23 and  name HG2  )(resid   23 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   23 and  name HG2  )(resid   23 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   23 and  name HG2  )(resid   23 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   23 and  name HD1  )(resid   23 and  name HD2   ) 3.5 1.0 1.5
!inter
assign (resid   23 and  name HA   )(resid   22 and  name HB#   ) 4.0 1.0 1.5
assign (resid   23 and  name HA   )(resid   24 and  name HN    ) 3.5 1.3 1.5
assign (resid   23 and  name HA   )(resid   24 and  name HA    ) 3.5 2.2 1.5
assign (resid   23 and  name HA   )(resid   24 and  name HB*   ) 4.0 1.0 2.0
assign (resid   23 and  name HB1  )(resid   24 and  name HN    ) 4.0 1.5 1.5
assign (resid   23 and  name HB1  )(resid   24 and  name HB*   ) 4.0 1.0 1.5
!assign (resid   23 and  name HB2  )(resid   24 and  name HN    ) 4.0 1.0 1.8
assign (resid   23 and  name HB2  )(resid   24 and  name HB*   ) 4.0 1.0 2.0
assign (resid   23 and  name HG1  )(resid   24 and  name HN    ) 4.0 1.0 1.8
assign (resid   23 and  name HG2  )(resid   24 and  name HN    ) 4.0 1.0 1.8
assign (resid   23 and  name HD1  )(resid   22 and  name HA    ) 4.0 1.6 1.5
assign (resid   23 and  name HD1  )(resid   24 and  name HN    ) 4.0 1.0 1.5
!assign (resid   23 and  name HD1  )(resid   24 and  name HB*   ) 4.0 1.0 1.8
assign (resid   23 and  name HD2  )(resid   22 and  name HA    ) 3.0 1.0 1.5
assign (resid   23 and  name HD2  )(resid   24 and  name HN    ) 4.0 1.0 1.5
!A24
!intra
!assign (resid   24 and  name HN   )(resid   24 and  name HA    ) 3.5 1.0 1.0
!assign (resid   24 and  name HN   )(resid   24 and  name HB*   ) 3.0 1.0 1.2
!assign (resid   24 and  name HA   )(resid   24 and  name HB*   ) 3.5 2.2 1.5
!inter
assign (resid   24 and  name HN   )(resid   22 and  name HB*   ) 4.0 1.0 2.0
!assign (resid   24 and  name HA   )(resid   23 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   24 and  name HA   )(resid   23 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   24 and  name HA   )(resid   25 and  name HG2*  ) 4.0 1.0 1.5
assign (resid   24 and  name HB*  )(resid   19 and  name HB2   ) 4.0 1.0 2.0
assign (resid   24 and  name HB*  )(resid   19 and  name HG1   ) 3.5 2.2 1.5
assign (resid   24 and  name HB*  )(resid   19 and  name HG2   ) 4.0 1.0 1.5
assign (resid   24 and  name HB*  )(resid   25 and  name HN    ) 3.5 2.2 1.5
!I25
!intra
!assign (resid   25 and  name HN   )(resid   25 and  name HG1*  ) 4.0 1.0 1.0
!assign (resid   25 and  name HN   )(resid   25 and  name HG2*  ) 3.0 1.0 1.5
!assign (resid   25 and  name HA   )(resid   25 and  name HN    ) 4.0 1.0 1.5
!assign (resid   25 and  name HA   )(resid   25 and  name HB    ) 3.5 1.5 1.5
!assign (resid   25 and  name HA   )(resid   25 and  name HG2*  ) 3.5 1.5 1.5
!assign (resid   25 and  name HA   )(resid   25 and  name HD1*  ) 3.5 1.5 1.5
!assign (resid   25 and  name HB   )(resid   25 and  name HN    ) 3.5 1.5 1.5
!assign (resid   25 and  name HB   )(resid   25 and  name HG1#  ) 3.5 1.5 1.5
!assign (resid   25 and  name HB   )(resid   25 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid   25 and  name HB   )(resid   25 and  name HD1*  ) 3.5 1.5 1.5
!assign (resid   25 and  name HG1# )(resid   25 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid   25 and  name HG1# )(resid   25 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   25 and  name HG2* )(resid   25 and  name HD1*  ) 3.5 2.2 1.5
!inter
assign (resid   25 and  name HN   )(resid   24 and  name HN    ) 4.0 1.0 1.0
assign (resid   25 and  name HN   )(resid   24 and  name HA    ) 3.0 1.0 0.5
assign (resid   25 and  name HA   )(resid   18 and  name HB#   ) 4.0 1.0 2.0
!assign (resid   25 and  name HB   )(resid   18 and  name HB#   ) 4.0 1.0 1.5
assign (resid   25 and  name HG1# )(resid   18 and  name HB#   ) 4.0 1.0 2.0
assign (resid   25 and  name HD1* )(resid   16 and  name HB    ) 4.0 1.0 2.0
!C26
!intra
!assign (resid   26 and  name HA   )(resid   26 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   26 and  name HA   )(resid   26 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   26 and  name HB1  )(resid   26 and  name HB2   ) 3.5 2.2 1.5
!inter
!assign (resid   26 and  name HA   )(resid   17 and  name HB2   ) 4.0 1.0 1.8
assign (resid   26 and  name HA   )(resid   49 and  name HB2   ) 3.5 1.0 1.5
assign (resid   26 and  name HB1  )(resid   27 and  name HN    ) 3.5 1.0 1.5
assign (resid   26 and  name HB1  )(resid   28 and  name HG    ) 4.0 1.0 1.5
!assign (resid   26 and  name HB1  )(resid   28 and  name HD1*  ) 3.5 1.0 1.8
assign (resid   26 and  name HB1  )(resid   49 and  name HB2   ) 3.5 1.0 1.5
assign (resid   26 and  name HB1  )(resid   50 and  name HD2*  ) 3.5 2.2 1.5
assign (resid   26 and  name HB2  )(resid   27 and  name HN    ) 3.5 1.0 1.5
assign (resid   26 and  name HB2  )(resid   28 and  name HG    ) 4.0 1.0 1.5
!assign (resid   26 and  name HB2  )(resid   28 and  name HD1*  ) 3.5 1.0 1.8
assign (resid   26 and  name HB2  )(resid   49 and  name HB2   ) 3.5 1.5 1.5
assign (resid   26 and  name HB2  )(resid   50 and  name HD2*  ) 3.5 2.2 1.5
!H27
!intra
!assign (resid   27 and  name HN   )(resid   27 and  name HB#   ) 3.0 1.0 1.5
!assign (resid   27 and  name HA   )(resid   27 and  name HB#   ) 3.5 1.0 1.5
assign (resid   27 and  name HD2  )(resid   27 and  name HN    ) 3.5 1.0 1.5
assign (resid   27 and  name HD2  )(resid   27 and  name HB#   ) 3.5 1.0 1.5
!inter
!assign (resid   27 and  name HN   )(resid   28 and  name HN    ) 4.0 0.5 1.0 - reduntant
assign (resid   27 and  name HN   )(resid   46 and  name HN    ) 4.0 0.5 1.0
!assign (resid   27 and  name HN   )(resid   26 and  name HA    ) 2.5 0.7 0.5 - reduntant
!assign (resid   27 and  name HN   )(resid   49 and  name HB#   ) 4.0 0.5 1.0
assign (resid   27 and  name HN   )(resid   16 and  name HA    ) 3.5 1.5 1.5
assign (resid   27 and  name HN   )(resid   16 and  name HG2*  ) 4.0 1.5 2.0
assign (resid   27 and  name HN   )(resid   26 and  name HA    ) 3.5 2.2 1.5
assign (resid   27 and  name HN   )(resid   28 and  name HN    ) 3.5 2.2 1.5
!assign (resid   27 and  name HN   )(resid   28 and  name HB1   ) 3.5 1.0 1.5
assign (resid   27 and  name HB#  )(resid   16 and  name HG2*  ) 4.0 1.0 1.5
assign (resid   27 and  name HB#  )(resid   26 and  name HA    ) 4.0 1.0 1.5
assign (resid   27 and  name HB#  )(resid   28 and  name HD2*  ) 4.5 1.0 2.0
assign (resid   27 and  name HB#  )(resid   46 and  name HB1   ) 4.0 1.0 1.5
assign (resid   27 and  name HD2  )(resid   26 and  name HA    ) 3.5 1.0 1.5
!assign (resid   27 and  name HE1  )(resid   16 and  name HG2*  ) 3.5 1.0 1.5 - reduntant
!L28
!intra
!assign (resid   28 and  name HN   )(resid   28 and  name HB#   ) 3.0 1.0 1.2
!assign (resid   28 and  name HN   )(resid   28 and  name HD2*  ) 4.0 1.0 1.0
!assign (resid   28 and  name HA   )(resid   28 and  name HN    ) 3.5 1.5 1.5
!assign (resid   28 and  name HA   )(resid   28 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   28 and  name HA   )(resid   28 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   28 and  name HA   )(resid   28 and  name HG    ) 3.5 1.5 1.5
!assign (resid   28 and  name HA   )(resid   28 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   28 and  name HB1  )(resid   28 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   28 and  name HB1  )(resid   28 and  name HG    ) 3.5 2.2 1.5
!assign (resid   28 and  name HB1  )(resid   28 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   28 and  name HB2  )(resid   28 and  name HG    ) 3.5 2.2 1.5
!assign (resid   28 and  name HB2  )(resid   28 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   28 and  name HG   )(resid   28 and  name HN    ) 3.5 1.5 1.5
!assign (resid   28 and  name HG   )(resid   28 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   28 and  name HD1* )(resid   28 and  name HN    ) 4.0 1.0 1.9
!assign (resid   28 and  name HD1* )(resid   28 and  name HB1   ) 3.5 1.5 1.5
!assign (resid   28 and  name HD1* )(resid   28 and  name HB2   ) 3.5 1.5 1.5
!inter
assign (resid   28 and  name HN   )(resid   29 and  name HN    ) 4.0 0.5 1.0
assign (resid   28 and  name HN   )(resid   15 and  name HA    ) 4.0 0.5 1.0
assign (resid   28 and  name HN   )(resid   27 and  name HB#   ) 4.0 1.0 1.0
assign (resid   28 and  name HN   )(resid   15 and  name HB#   ) 4.0 0.5 1.0
assign (resid   28 and  name HA   )(resid   45 and  name HA1   ) 3.5 1.0 1.5
assign (resid   28 and  name HA   )(resid   45 and  name HA2   ) 3.5 2.2 1.5
assign (resid   28 and  name HA   )(resid   30 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   28 and  name HB1  )(resid   29 and  name HN    ) 3.5 1.5 1.5
assign (resid   28 and  name HB1  )(resid   30 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   28 and  name HB2  )(resid   29 and  name HN    ) 3.5 2.2 1.5
assign (resid   28 and  name HB2  )(resid   30 and  name HD1*  ) 3.5 1.5 1.5
!assign (resid   28 and  name HG   )(resid   26 and  name HA    ) 4.0 1.0 1.9
assign (resid   28 and  name HG   )(resid   30 and  name HD1*  ) 4.0 1.0 1.9
!assign (resid   28 and  name HD1* )(resid   17 and  name HN    ) 4.0 1.0 1.9
!assign (resid   28 and  name HD1* )(resid   17 and  name HB2   ) 4.0 1.0 1.5
assign (resid   28 and  name HD1* )(resid   30 and  name HD1*  ) 3.5 1.5 1.5
!assign (resid   28 and  name HD1* )(resid   30 and  name HD2*  ) 4.0 1.5 2.0
assign (resid   28 and  name HD1* )(resid   50 and  name HG    ) 3.5 1.0 1.5
assign (resid   28 and  name HD1* )(resid   50 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   28 and  name HD1* )(resid  101 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   28 and  name HD2* )(resid   17 and  name HB2   ) 4.0 1.0 1.5
assign (resid   28 and  name HD2* )(resid   26 and  name HB1   ) 3.5 1.0 1.5
assign (resid   28 and  name HD2* )(resid   26 and  name HB2   ) 3.5 1.0 1.5
!assign (resid   28 and  name HD2* )(resid   30 and  name HD1*  ) 4.0 1.0 2.5
assign (resid   28 and  name HD2* )(resid   47 and  name HA    ) 3.5 1.5 1.5
assign (resid   28 and  name HD2* )(resid   50 and  name HG    ) 3.5 1.5 1.5
assign (resid   28 and  name HD2* )(resid   50 and  name HD1*  ) 3.5 1.0 1.5
!E29
!intra
!assign (resid   29 and  name HN   )(resid   29 and  name HA    ) 3.0 1.0 1.0
!assign (resid   29 and  name HN   )(resid   29 and  name HG#   ) 4.0 1.0 1.0
!assign (resid   29 and  name HN   )(resid   29 and  name HB#   ) 3.5 1.0 1.0
!assign (resid   29 and  name HA   )(resid   29 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   29 and  name HA   )(resid   29 and  name HB2   ) 3.5 1.5 1.5
!assign (resid   29 and  name HA   )(resid   29 and  name HG1   ) 3.5 1.5 1.5
!assign (resid   29 and  name HA   )(resid   29 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   29 and  name HB1  )(resid   29 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   29 and  name HB1  )(resid   29 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   29 and  name HB1  )(resid   29 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   29 and  name HB2  )(resid   29 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   29 and  name HB2  )(resid   29 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   29 and  name HG1  )(resid   29 and  name HG2   ) 3.5 2.2 1.5
!inter
assign (resid   29 and  name HN   )(resid   45 and  name HN    ) 4.0 0.5 1.0
assign (resid   29 and  name HN   )(resid   30 and  name HN    ) 4.0 1.0 1.0
assign (resid   29 and  name HN   )(resid   44 and  name HN    ) 3.5 1.0 1.0
!assign (resid   29 and  name HN   )(resid   43 and  name HA    ) 4.0 1.0 1.0
assign (resid   29 and  name HN   )(resid   28 and  name HA    ) 3.0 1.2 0.5
assign (resid   29 and  name HN   )(resid   45 and  name HA#   ) 4.0 1.0 1.0
assign (resid   29 and  name HN   )(resid   28 and  name HD2*  ) 4.0 1.0 1.0
assign (resid   29 and  name HN   )(resid   47 and  name HG2*  ) 4.0 1.0 1.0
assign (resid   29 and  name HN   )(resid   43 and  name HD1*  ) 4.0 1.0 1.0
assign (resid   29 and  name HA   )(resid   14 and  name HA    ) 3.5 1.0 1.5
assign (resid   29 and  name HA   )(resid   15 and  name HN    ) 3.5 1.5 1.5
assign (resid   29 and  name HA   )(resid   30 and  name HA    ) 4.0 1.0 1.5
assign (resid   29 and  name HA   )(resid   30 and  name HB1   ) 4.0 1.0 1.5
assign (resid   29 and  name HA   )(resid   30 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   29 and  name HB1  )(resid   30 and  name HN    ) 4.0 1.0 1.5
assign (resid   29 and  name HB1  )(resid   44 and  name HA2   ) 3.5 1.5 1.5
assign (resid   29 and  name HB2  )(resid   44 and  name HA2   ) 3.5 1.5 1.5
assign (resid   29 and  name HG1  )(resid   30 and  name HN    ) 4.0 1.0 1.5
assign (resid   29 and  name HG2  )(resid   30 and  name HN    ) 4.0 1.0 1.5
!L30
!intra
!assign (resid   30 and  name HN   )(resid   30 and  name HA    ) 3.0 1.0 1.0
!assign (resid   30 and  name HN   )(resid   30 and  name HB#   ) 3.0 1.0 1.0
!assign (resid   30 and  name HN   )(resid   30 and  name HD1*  ) 3.0 1.0 1.0
!assign (resid   30 and  name HN   )(resid   30 and  name HD2*  ) 4.0 1.0 1.0
!assign (resid   30 and  name HA   )(resid   30 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   30 and  name HA   )(resid   30 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   30 and  name HA   )(resid   30 and  name HG    ) 3.5 2.2 1.5
!assign (resid   30 and  name HA   )(resid   30 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   30 and  name HA   )(resid   30 and  name HD2*  ) 3.5 1.0 1.5
!assign (resid   30 and  name HB1  )(resid   30 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   30 and  name HB1  )(resid   30 and  name HG    ) 3.5 2.2 1.5
!assign (resid   30 and  name HB1  )(resid   30 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   30 and  name HB1  )(resid   30 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   30 and  name HB2  )(resid   30 and  name HG    ) 3.5 2.2 1.5
!assign (resid   30 and  name HB2  )(resid   30 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   30 and  name HB2  )(resid   30 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   30 and  name HG   )(resid   30 and  name HD2*  ) 3.5 1.5 1.5
!assign (resid   30 and  name HD1* )(resid   30 and  name HD2*  ) 3.5 2.2 1.5
!inter
assign (resid   30 and  name HN   )(resid   31 and  name HN    ) 4.0 1.0 1.0
assign (resid   30 and  name HN   )(resid   29 and  name HA    ) 3.0 1.2 0.5
!assign (resid   30 and  name HA   )(resid   31 and  name HG2   ) 4.0 1.0 1.5
assign (resid   30 and  name HA   )(resid   43 and  name HA    ) 3.5 1.5 1.5
assign (resid   30 and  name HA   )(resid   43 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   30 and  name HA   )(resid   61 and  name HE1   ) 3.5 1.5 1.5
assign (resid   30 and  name HB1  )(resid   13 and  name HN    ) 3.5 1.5 1.5
assign (resid   30 and  name HB1  )(resid   15 and  name HE1   ) 3.5 1.0 1.5
assign (resid   30 and  name HB2  )(resid   13 and  name HN    ) 3.5 1.5 1.5
assign (resid   30 and  name HB2  )(resid   15 and  name HE1   ) 4.0 1.0 1.5
!assign (resid   30 and  name HB2  )(resid   43 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   30 and  name HB2  )(resid   61 and  name HE1   ) 4.0 1.0 1.9
assign (resid   30 and  name HG   )(resid   31 and  name HN    ) 4.0 1.0 1.9
assign (resid   30 and  name HG   )(resid   43 and  name HD1*  ) 4.0 1.0 1.5
!assign (resid   30 and  name HD1* )(resid   12 and  name HN    ) 4.0 1.0 1.9
assign (resid   30 and  name HD1* )(resid   15 and  name HN    ) 4.0 1.0 1.9
assign (resid   30 and  name HD1* )(resid   15 and  name HE1   ) 3.5 2.0 1.5
assign (resid   30 and  name HD1* )(resid   15 and  name HB1   ) 3.5 2.2 1.5
assign (resid   30 and  name HD1* )(resid   15 and  name HB2   ) 4.0 1.0 1.5
assign (resid   30 and  name HD1* )(resid   43 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   30 and  name HD1* )(resid  101 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   30 and  name HD2* )(resid   15 and  name HE1   ) 3.5 1.0 1.5
assign (resid   30 and  name HD2* )(resid   43 and  name HD1*  ) 4.0 1.0 1.8
assign (resid   30 and  name HD2* )(resid   68 and  name HG2*  ) 4.0 1.0 2.0
assign (resid   30 and  name HD2* )(resid   68 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   30 and  name HD2* )(resid  101 and  name HD2*  ) 3.5 2.2 1.5
!R31
!intra
!assign (resid   31 and  name HN   )(resid   31 and  name HD#   ) 4.0 1.0 1.0
!assign (resid   31 and  name HN   )(resid   31 and  name HB#   ) 3.0 1.0 1.2
!assign (resid   31 and  name HN   )(resid   31 and  name HG#   ) 4.0 1.0 1.0
!assign (resid   31 and  name HA   )(resid   31 and  name HN    ) 3.5 1.5 1.5
!assign (resid   31 and  name HA   )(resid   31 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   31 and  name HA   )(resid   31 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   31 and  name HA   )(resid   31 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   31 and  name HA   )(resid   31 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   31 and  name HA   )(resid   31 and  name HD1   ) 4.0 1.0 1.8
!assign (resid   31 and  name HA   )(resid   31 and  name HD2   ) 4.0 1.0 1.8
!assign (resid   31 and  name HB1  )(resid   31 and  name HD1   ) 3.5 1.0 1.5
!assign (resid   31 and  name HB1  )(resid   31 and  name HD2   ) 3.5 1.5 1.5
!assign (resid   31 and  name HB1  )(resid   31 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   31 and  name HB1  )(resid   31 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   31 and  name HB2  )(resid   31 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   31 and  name HB2  )(resid   31 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   31 and  name HB2  )(resid   31 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   31 and  name HB2  )(resid   31 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   31 and  name HG1  )(resid   31 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   31 and  name HG1  )(resid   31 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   31 and  name HG1  )(resid   31 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   31 and  name HG2  )(resid   31 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   31 and  name HG2  )(resid   31 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   31 and  name HD1  )(resid   31 and  name HD2   ) 3.5 2.2 1.5
!inter
assign (resid   31 and  name HN   )(resid   32 and  name HN    ) 4.0 1.0 1.0
assign (resid   31 and  name HN   )(resid   44 and  name HN    ) 4.0 1.0 0.5
!assign (resid   31 and  name HN   )(resid   33 and  name HN    ) 4.0 0.5 1.0
assign (resid   31 and  name HN   )(resid   43 and  name HA    ) 3.5 1.0 1.0
assign (resid   31 and  name HN   )(resid   30 and  name HA    ) 3.0 1.0 1.0
assign (resid   31 and  name HN   )(resid   42 and  name HB#   ) 4.0 1.0 1.0
assign (resid   31 and  name HN   )(resid   43 and  name HD1*  ) 4.0 1.0 1.0
assign (resid   31 and  name HN   )(resid   30 and  name HB#   ) 4.0 1.0 1.0
assign (resid   31 and  name HN   )(resid   30 and  name HD1*  ) 4.0 1.0 1.0
assign (resid   31 and  name HN   )(resid   30 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   31 and  name HA   )(resid   13 and  name HN    ) 3.5 1.5 1.5
!assign (resid   31 and  name HA   )(resid   29 and  name HG1   ) 3.5 2.2 1.5
assign (resid   31 and  name HA   )(resid   30 and  name HA    ) 4.0 1.0 1.5
assign (resid   31 and  name HA   )(resid   33 and  name HN    ) 4.0 1.0 1.5
assign (resid   31 and  name HB1  )(resid   30 and  name HA    ) 4.0 1.0 1.8
!assign (resid   31 and  name HB1  )(resid   33 and  name HB2   ) 4.0 1.0 1.8
assign (resid   31 and  name HB1  )(resid   42 and  name HB#   ) 3.5 1.0 1.5
!assign (resid   31 and  name HB1  )(resid   61 and  name HE1   ) 4.0 1.0 1.8
assign (resid   31 and  name HB2  )(resid   33 and  name HB2   ) 4.0 1.0 1.5
assign (resid   31 and  name HB2  )(resid   42 and  name HB#   ) 3.5 1.0 1.5
assign (resid   31 and  name HG2  )(resid   42 and  name HB#   ) 4.0 1.0 1.5
assign (resid   31 and  name HG2  )(resid   44 and  name HN    ) 4.0 1.0 1.5
!assign (resid   31 and  name HD1  )(resid   42 and  name HB#   ) 3.5 2.2 1.5
!assign (resid   31 and  name HD2  )(resid   42 and  name HB#   ) 3.5 2.2 1.5
!D32
!intra
!assign (resid   32 and  name HN   )(resid   32 and  name HB#   ) 4.0 2.2 1.0
!assign (resid   32 and  name HA   )(resid   32 and  name HN    ) 3.5 2.2 1.5
!assign (resid   32 and  name HA   )(resid   32 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   32 and  name HA   )(resid   32 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   32 and  name HB1  )(resid   32 and  name HB2   ) 3.5 2.2 1.5
!inter
assign (resid   32 and  name HN   )(resid   33 and  name HN    ) 3.0 1.0 0.5
assign (resid   32 and  name HN   )(resid   31 and  name HA    ) 3.0 1.0 0.5
assign (resid   32 and  name HN   )(resid   31 and  name HD#   ) 4.0 1.0 1.0
!assign (resid   32 and  name HN   )(resid   42 and  name HB#   ) 3.5 1.0 1.0
assign (resid   32 and  name HN   )(resid   31 and  name HB#   ) 3.0 1.0 1.0
assign (resid   32 and  name HN   )(resid   31 and  name HG#   ) 4.0 1.0 1.0
assign (resid   32 and  name HN   )(resid   12 and  name HB*   ) 4.0 1.0 2.0
!assign (resid   32 and  name HN   )(resid    8 and  name HB*   ) 4.0 1.0 1.0
assign (resid   32 and  name HA   )(resid    8 and  name HB*   ) 4.0 1.5 1.5
!assign (resid   32 and  name HA   )(resid    9 and  name HN    ) 3.5 2.2 1.5
!assign (resid   32 and  name HA   )(resid    9 and  name HA    ) 4.0 1.0 1.5
assign (resid   32 and  name HA   )(resid   12 and  name HB*   ) 4.0 1.0 1.5
assign (resid   32 and  name HA   )(resid   33 and  name HN    ) 3.5 2.2 1.5
assign (resid   32 and  name HA   )(resid   41 and  name HB1   ) 3.5 1.0 2.5
!assign (resid   32 and  name HA   )(resid   41 and  name HB2   ) 3.5 1.0 1.5
!assign (resid   32 and  name HB1  )(resid    8 and  name HB*   ) 3.5 2.2 1.5 - reduntant
assign (resid   32 and  name HB1  )(resid   12 and  name HB*   ) 3.5 1.5 1.5
!assign (resid   32 and  name HB1  )(resid   41 and  name HB2   ) 4.0 1.0 1.5
!assign (resid   32 and  name HB2  )(resid    8 and  name HB*   ) 3.5 2.2 1.5 - reduntant
assign (resid   32 and  name HB2  )(resid   12 and  name HB*   ) 3.5 1.5 1.5
!assign (resid   32 and  name HB2  )(resid   41 and  name HB2   ) 4.0 1.0 1.5
!S33
!intra
!assign (resid   33 and  name HN   )(resid   33 and  name HB#   ) 3.5 1.0 1.0
!assign (resid   33 and  name HA   )(resid   33 and  name HN    ) 3.5 2.2 1.5
!assign (resid   33 and  name HA   )(resid   33 and  name HB#   ) 3.5 2.2 1.5
!inter
assign (resid   33 and  name HN   )(resid   34 and  name HN    ) 4.0 1.0 1.0
assign (resid   33 and  name HN   )(resid   41 and  name HB#   ) 3.5 1.0 1.5
!assign (resid   33 and  name HN   )(resid   31 and  name HD#   ) 4.0 1.0 1.0
assign (resid   33 and  name HN   )(resid   32 and  name HB#   ) 4.0 1.0 1.0
assign (resid   33 and  name HN   )(resid   42 and  name HB#   ) 4.0 1.0 0.5
assign (resid   33 and  name HN   )(resid   31 and  name HB#   ) 3.0 1.0 0.5
!assign (resid   33 and  name HN   )(resid    8 and  name HB*   ) 4.0 1.0 1.0
!assign (resid   33 and  name HA   )(resid   34 and  name HB1   ) 4.0 1.0 1.5
assign (resid   33 and  name HA   )(resid   34 and  name HG2   ) 4.0 1.0 1.5
!assign (resid   33 and  name HA   )(resid   42 and  name HN    ) 4.0 1.0 1.5
!assign (resid   33 and  name HB1  )(resid   34 and  name HG2   ) 4.0 1.0 1.5
assign (resid   33 and  name HB1  )(resid   42 and  name HN    ) 4.0 1.0 1.5
assign (resid   33 and  name HB1  )(resid   42 and  name HB1   ) 4.0 1.5 1.0
assign (resid   33 and  name HB2  )(resid   34 and  name HG2   ) 4.0 1.0 1.5
assign (resid   33 and  name HB2  )(resid   42 and  name HN    ) 4.0 1.0 1.5
!assign (resid   33 and  name HB2  )(resid   42 and  name HB1   ) 4.0 1.0 1.5 - reduntant
!E34
!intra
!assign (resid   34 and  name HN   )(resid   34 and  name HA    ) 3.0 1.0 1.0
!assign (resid   34 and  name HN   )(resid   34 and  name HG#   ) 3.0 1.0 1.2
!assign (resid   34 and  name HN   )(resid   34 and  name HB#   ) 3.0 1.0 1.2
!assign (resid   34 and  name HA   )(resid   34 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   34 and  name HA   )(resid   34 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   34 and  name HA   )(resid   34 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   34 and  name HB1  )(resid   34 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   34 and  name HB1  )(resid   34 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   34 and  name HB2  )(resid   34 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   34 and  name HB2  )(resid   34 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   34 and  name HG1  )(resid   34 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   34 and  name HG2  )(resid   34 and  name HA    ) 3.5 2.2 1.5
!assign (resid   34 and  name HG2  )(resid   34 and  name HB2   ) 3.5 2.2 1.5
!inter
assign (resid   34 and  name HN   )(resid   35 and  name HN    ) 4.0 1.0 1.0
assign (resid   34 and  name HN   )(resid   33 and  name HA    ) 3.0 1.0 0.5
assign (resid   34 and  name HN   )(resid   33 and  name HB#   ) 3.5 1.0 1.5
assign (resid   34 and  name HA   )(resid   35 and  name HB    ) 4.0 1.0 1.5
!assign (resid   34 and  name HA   )(resid   35 and  name HG2*  ) 4.0 1.0 1.9 - reduntant
assign (resid   34 and  name HA   )(resid   41 and  name HA    ) 3.5 2.2 1.5
!assign (resid   34 and  name HA   )(resid   41 and  name HB2   ) 4.0 1.0 1.5
assign (resid   34 and  name HB1  )(resid   35 and  name HN    ) 4.0 1.5 1.0
assign (resid   34 and  name HB2  )(resid   35 and  name HN    ) 3.5 1.5 1.5
!assign (resid   34 and  name HG1  )(resid   35 and  name HG2*  ) 4.0 1.0 2.0
!assign (resid   34 and  name HG1  )(resid   36 and  name HA    ) 4.0 1.0 1.9
assign (resid   34 and  name HG2  )(resid   36 and  name HB*   ) 4.0 1.0 3.0
!V35
!intra
!assign (resid   35 and  name HN   )(resid   35 and  name HA    ) 3.0 1.0 1.0
!assign (resid   35 and  name HN   )(resid   35 and  name HB    ) 3.0 1.0 0.5
!assign (resid   35 and  name HA   )(resid   35 and  name HB    ) 3.5 2.2 1.5
!assign (resid   35 and  name HA   )(resid   35 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid   35 and  name HB   )(resid   35 and  name HG1*  ) 3.5 2.2 1.5
!assign (resid   35 and  name HB   )(resid   35 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid   35 and  name HG1* )(resid   35 and  name HN    ) 3.5 1.5 1.5
!assign (resid   35 and  name HG1* )(resid   35 and  name HA    ) 3.5 2.2 1.5
!assign (resid   35 and  name HG2* )(resid   35 and  name HN    ) 3.5 1.5 1.5
!inter
assign (resid   35 and  name HN   )(resid   41 and  name HN    ) 4.0 1.0 1.0
assign (resid   35 and  name HN   )(resid   40 and  name HN    ) 3.0 0.5 1.2
assign (resid   35 and  name HN   )(resid   41 and  name HA    ) 3.0 1.0 0.5
assign (resid   35 and  name HN   )(resid   34 and  name HA    ) 3.0 1.2 0.5
assign (resid   35 and  name HN   )(resid   40 and  name HA#   ) 4.0 1.0 1.0
assign (resid   35 and  name HN   )(resid   34 and  name HG#   ) 4.0 1.0 1.0
assign (resid   35 and  name HA   )(resid   34 and  name HB2   ) 4.0 1.0 1.9
assign (resid   35 and  name HA   )(resid   36 and  name HB*   ) 4.0 1.0 1.5
!assign (resid   35 and  name HB   )(resid   36 and  name HB*   ) 3.5 1.0 1.5
assign (resid   35 and  name HB   )(resid   38 and  name HB*   ) 3.5 2.2 1.5
assign (resid   35 and  name HB   )(resid   60 and  name HB*   ) 3.5 1.0 1.5
assign (resid   35 and  name HG1* )(resid   36 and  name HB*   ) 4.0 1.0 2.0
assign (resid   35 and  name HG1* )(resid   37 and  name HB2   ) 3.5 2.2 1.5
assign (resid   35 and  name HG1* )(resid   37 and  name HG1   ) 4.0 1.0 1.5
assign (resid   35 and  name HG1* )(resid   38 and  name HB*   ) 3.5 2.2 1.5
assign (resid   35 and  name HG1* )(resid   60 and  name HA    ) 4.0 1.0 1.5
assign (resid   35 and  name HG1* )(resid   60 and  name HB*   ) 3.5 2.2 1.5
assign (resid   35 and  name HG2* )(resid   34 and  name HA    ) 4.0 1.0 1.5
assign (resid   35 and  name HG2* )(resid   38 and  name HN    ) 4.0 1.0 1.9
assign (resid   35 and  name HG2* )(resid   41 and  name HA    ) 3.5 1.0 1.5
assign (resid   35 and  name HG2* )(resid   41 and  name HB2   ) 4.0 1.0 1.5
assign (resid   35 and  name HG2* )(resid   42 and  name HA    ) 3.5 2.2 1.5
assign (resid   35 and  name HG2* )(resid   42 and  name HB2   ) 3.5 2.2 1.5
assign (resid   35 and  name HG2* )(resid   43 and  name HN    ) 4.0 1.0 1.5
assign (resid   35 and  name HG2* )(resid   60 and  name HB*   ) 3.5 2.2 1.5
!A36
!intra
!assign (resid   36 and  name HN   )(resid   36 and  name HB*   ) 3.0 1.0 1.0
!assign (resid   36 and  name HA   )(resid   36 and  name HB*   ) 3.5 2.2 1.5
!inter
assign (resid   36 and  name HN   )(resid   35 and  name HA    ) 3.0 1.2 0.5
!assign (resid   36 and  name HA   )(resid   34 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   36 and  name HA   )(resid   34 and  name HB2   ) 4.0 1.0 1.9
assign (resid   36 and  name HA   )(resid   35 and  name HN    ) 4.0 1.0 1.5
assign (resid   36 and  name HA   )(resid   35 and  name HG1*  ) 4.0 1.0 1.5
assign (resid   36 and  name HA   )(resid   39 and  name HN    ) 3.5 2.2 1.5
assign (resid   36 and  name HA   )(resid   40 and  name HN    ) 4.0 1.0 1.5
!assign (resid   36 and  name HB*  )(resid   34 and  name HB2   ) 4.0 1.0 1.5
!E37
!intra
!assign (resid   37 and  name HN   )(resid   37 and  name HA    ) 3.0 1.0 1.0
!assign (resid   37 and  name HN   )(resid   37 and  name HG#   ) 4.0 1.0 1.0
!assign (resid   37 and  name HN   )(resid   37 and  name HB#   ) 3.0 1.0 0.5
!assign (resid   37 and  name HA   )(resid   37 and  name HB#   ) 3.5 2.2 1.5
!assign (resid   37 and  name HA   )(resid   37 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   37 and  name HB1  )(resid   37 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   37 and  name HB2  )(resid   37 and  name HG#   ) 3.5 2.2 1.5
!inter
assign (resid   37 and  name HN   )(resid   38 and  name HN    ) 3.0 1.0 1.0
assign (resid   37 and  name HN   )(resid   36 and  name HB*   ) 3.0 1.0 1.5
assign (resid   37 and  name HA   )(resid   36 and  name HB*   ) 3.5 1.0 1.5
assign (resid   37 and  name HA   )(resid   38 and  name HN    ) 3.5 2.2 1.5
assign (resid   37 and  name HA   )(resid   39 and  name HN    ) 4.0 1.0 1.5
assign (resid   37 and  name HB1  )(resid   36 and  name HB*   ) 4.0 1.0 1.5
!assign (resid   37 and  name HB2  )(resid   36 and  name HB*   ) 4.0 1.0 1.9
!assign (resid   37 and  name HG1  )(resid   36 and  name HB*   ) 4.0 1.0 2.0
!assign (resid   37 and  name HG1  )(resid   38 and  name HB*   ) 3.5 1.0 1.5
assign (resid   37 and  name HG2  )(resid   35 and  name HG1*  ) 4.0 1.0 1.5
!assign (resid   37 and  name HG2  )(resid   36 and  name HB*   ) 4.0 1.0 2.0
!A38
!intra
!assign (resid   38 and  name HN   )(resid   38 and  name HB*   ) 3.0 1.0 1.2
!assign (resid   38 and  name HA   )(resid   38 and  name HB*   ) 3.5 2.2 1.5
!inter
assign (resid   38 and  name HN   )(resid   39 and  name HN    ) 3.0 1.0 0.5
assign (resid   38 and  name HN   )(resid   40 and  name HN    ) 4.0 1.0 1.0
assign (resid   38 and  name HN   )(resid   36 and  name HA    ) 4.0 0.5 1.0
assign (resid   38 and  name HN   )(resid   37 and  name HG#   ) 4.0 1.0 1.0
assign (resid   38 and  name HN   )(resid   37 and  name HB#   ) 3.0 1.0 1.5
assign (resid   38 and  name HN   )(resid   35 and  name HB    ) 4.0 1.0 1.0
assign (resid   38 and  name HN   )(resid   36 and  name HB*   ) 4.0 1.0 1.5
assign (resid   38 and  name HN   )(resid   35 and  name HG1*  ) 3.0 1.2 1.5
assign (resid   38 and  name HA   )(resid   37 and  name HB#   ) 4.0 1.0 1.5
!assign (resid   38 and  name HA   )(resid   37 and  name HG1   ) 4.0 1.0 1.5
assign (resid   38 and  name HA   )(resid   39 and  name HN    ) 3.5 2.2 1.5
assign (resid   38 and  name HA   )(resid   39 and  name HA    ) 3.5 1.5 1.5
assign (resid   38 and  name HA   )(resid   71 and  name HB2   ) 4.0 1.0 1.5
assign (resid   38 and  name HA   )(resid   71 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   38 and  name HA   )(resid   76 and  name HN    ) 4.0 1.0 1.9
assign (resid   38 and  name HB*  )(resid   37 and  name HB2   ) 4.0 1.0 1.5
assign (resid   38 and  name HB*  )(resid   60 and  name HB*   ) 3.5 2.2 1.5
assign (resid   38 and  name HB*  )(resid   71 and  name HB1   ) 3.5 2.2 1.5
assign (resid   38 and  name HB*  )(resid   71 and  name HB2   ) 3.5 1.5 1.9
assign (resid   38 and  name HB*  )(resid   71 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   38 and  name HB*  )(resid   73 and  name HA    ) 3.5 1.5 1.5
!S39
!intra
!assign (resid   39 and  name HN   )(resid   39 and  name HA    ) 3.0 1.0 0.5
!assign (resid   39 and  name HB1  )(resid   39 and  name HN    ) 3.5 1.5 1.5
!assign (resid   39 and  name HB1  )(resid   39 and  name HA    ) 3.5 2.2 1.5
!assign (resid   39 and  name HB1  )(resid   39 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   39 and  name HB2  )(resid   39 and  name HN    ) 3.5 1.5 1.5
!assign (resid   39 and  name HB2  )(resid   39 and  name HA    ) 3.5 2.2 1.5
!inter
assign (resid   39 and  name HN   )(resid   40 and  name HN    ) 3.0 1.0 0.5
assign (resid   39 and  name HN   )(resid   37 and  name HB#   ) 4.0 1.0 1.0
assign (resid   39 and  name HN   )(resid   35 and  name HB    ) 4.0 1.0 1.0
assign (resid   39 and  name HN   )(resid   36 and  name HB*   ) 4.0 1.0 1.0
assign (resid   39 and  name HN   )(resid   38 and  name HB*   ) 3.5 1.0 1.5
assign (resid   39 and  name HN   )(resid   35 and  name HG1*  ) 4.0 1.0 1.0
assign (resid   39 and  name HB1  )(resid   40 and  name HN    ) 4.0 1.0 1.5
assign (resid   39 and  name HB2  )(resid   40 and  name HN    ) 4.0 1.0 1.5
!G40
!intra
!assign (resid   40 and  name HN   )(resid   40 and  name HA#   ) 3.0 1.0 1.0
!assign (resid   40 and  name HA1  )(resid   40 and  name HA2   ) 3.5 2.2 1.5
!inter
assign (resid   40 and  name HN   )(resid   41 and  name HN    ) 4.0 1.0 1.0
assign (resid   40 and  name HN   )(resid   39 and  name HA    ) 3.0 1.0 1.2
assign (resid   40 and  name HN   )(resid   35 and  name HB    ) 3.5 1.0 1.0
assign (resid   40 and  name HN   )(resid   36 and  name HB*   ) 4.0 1.0 2.0
assign (resid   40 and  name HN   )(resid   38 and  name HB*   ) 4.0 1.0 1.0
assign (resid   40 and  name HA1  )(resid   35 and  name HB    ) 4.0 1.0 1.5
assign (resid   40 and  name HA1  )(resid   38 and  name HB*   ) 4.0 1.0 2.0
assign (resid   40 and  name HA1  )(resid   60 and  name HB*   ) 4.0 1.0 2.0
assign (resid   40 and  name HA1  )(resid   71 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   40 and  name HA2  )(resid   35 and  name HB    ) 3.5 1.0 1.5
assign (resid   40 and  name HA2  )(resid   38 and  name HB*   ) 3.5 1.0 1.5
assign (resid   40 and  name HA2  )(resid   60 and  name HB*   ) 4.0 1.0 1.5
assign (resid   40 and  name HA2  )(resid   71 and  name HD1*  ) 3.5 2.2 1.5
!Y41
!intra
!assign (resid   41 and  name HN   )(resid   41 and  name HB#   ) 3.0 1.0 1.5
!assign (resid   41 and  name HA   )(resid   41 and  name HN    ) 3.5 1.5 1.5
!assign (resid   41 and  name HA   )(resid   41 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   41 and  name HA   )(resid   41 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   41 and  name HB1  )(resid   41 and  name HB2   ) 3.5 2.2 1.5
assign (resid   41 and  name HD1  )(resid   41 and  name HN    ) 3.5 1.5 1.5
assign (resid   41 and  name HD1  )(resid   41 and  name HB1   ) 3.5 1.5 1.5
assign (resid   41 and  name HD1  )(resid   41 and  name HB2   ) 3.5 1.5 1.5
assign (resid   41 and  name HD2  )(resid   41 and  name HN    ) 3.5 1.5 1.5
assign (resid   41 and  name HE1  )(resid   41 and  name HN    ) 3.5 1.5 1.5
!inter
assign (resid   41 and  name HN   )(resid   61 and  name HN    ) 3.0 1.0 0.5
assign (resid   41 and  name HN   )(resid   60 and  name HA    ) 4.0 1.0 1.0
assign (resid   41 and  name HN   )(resid   62 and  name HA    ) 3.5 1.0 1.5
assign (resid   41 and  name HN   )(resid   40 and  name HA#   ) 3.0 1.2 0.5
assign (resid   41 and  name HN   )(resid   62 and  name HB#   ) 4.0 1.0 1.0
assign (resid   41 and  name HN   )(resid   60 and  name HB*   ) 4.0 1.0 1.0
assign (resid   41 and  name HN   )(resid   71 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   41 and  name HA   )(resid   34 and  name HB1   ) 4.0 1.0 1.8
!assign (resid   41 and  name HA   )(resid   34 and  name HB1   ) 4.0 1.0 1.5 - reduntant
assign (resid   41 and  name HA   )(resid   35 and  name HB    ) 4.0 1.0 1.5
assign (resid   41 and  name HA   )(resid   42 and  name HB1   ) 4.0 1.5 1.5
!assign (resid   41 and  name HA   )(resid   61 and  name HE1   ) 4.0 1.0 1.5
assign (resid   41 and  name HB1  )(resid   34 and  name HA    ) 4.0 1.0 1.5
assign (resid   41 and  name HB1  )(resid   61 and  name HN    ) 4.0 1.0 1.5
!assign (resid   41 and  name HB1  )(resid   61 and  name HE1   ) 3.5 1.5 1.5
assign (resid   41 and  name HB2  )(resid    8 and  name HB*   ) 4.0 1.0 1.5
!assign (resid   41 and  name HB2  )(resid   42 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   41 and  name HB2  )(resid   42 and  name HB2   ) 4.0 1.0 1.5
assign (resid   41 and  name HB2  )(resid   61 and  name HN    ) 4.0 1.0 1.5
!assign (resid   41 and  name HB2  )(resid   61 and  name HE1   ) 3.5 2.2 1.5
assign (resid   41 and  name HD1  )(resid    8 and  name HB*   ) 3.5 1.5 2.5
assign (resid   41 and  name HD1  )(resid   35 and  name HN    ) 3.5 1.5 2.5
assign (resid   41 and  name HD1  )(resid   40 and  name HA1   ) 3.5 1.5 1.5
assign (resid   41 and  name HD1  )(resid   40 and  name HA2   ) 3.5 1.5 1.5
assign (resid   41 and  name HD1  )(resid   62 and  name HA    ) 3.5 1.5 1.5
assign (resid   41 and  name HD1  )(resid   62 and  name HB#   ) 3.5 1.5 1.5
assign (resid   41 and  name HE1  )(resid    8 and  name HB*   ) 3.5 1.5 1.5
assign (resid   41 and  name HE1  )(resid   35 and  name HN    ) 3.5 1.5 2.5
assign (resid   41 and  name HE1  )(resid   40 and  name HA1   ) 3.5 1.5 1.5
assign (resid   41 and  name HE1  )(resid   40 and  name HA2   ) 3.5 1.5 1.5
assign (resid   41 and  name HE1  )(resid   62 and  name HA    ) 3.5 1.5 1.5
!assign (resid   41 and  name HE1  )(resid   62 and  name HB#   ) 3.5 1.5 1.5
!D42
!intra
!assign (resid   42 and  name HN   )(resid   42 and  name HA    ) 3.0 1.0 1.0
!assign (resid   42 and  name HN   )(resid   42 and  name HB#   ) 3.0 1.0 1.0
!assign (resid   42 and  name HA   )(resid   42 and  name HB2   ) 4.0 1.0 1.5
!assign (resid   42 and  name HB1  )(resid   42 and  name HA    ) 3.5 2.2 1.5
!inter
assign (resid   42 and  name HN   )(resid   41 and  name HN    ) 4.0 0.5 1.0
assign (resid   42 and  name HN   )(resid   43 and  name HN    ) 4.0 0.5 1.0
assign (resid   42 and  name HN   )(resid   33 and  name HN    ) 3.0 1.0 1.0
assign (resid   42 and  name HN   )(resid   41 and  name HA    ) 3.0 1.2 0.5
assign (resid   42 and  name HN   )(resid   34 and  name HA    ) 4.0 1.0 1.0
assign (resid   42 and  name HN   )(resid   31 and  name HB#   ) 4.0 1.0 1.0
assign (resid   42 and  name HN   )(resid   35 and  name HB    ) 4.0 1.0 1.0
assign (resid   42 and  name HN   )(resid   41 and  name HB#   ) 3.0 1.0 1.0
assign (resid   42 and  name HN   )(resid   35 and  name HG2*  ) 3.0 1.0 1.3
assign (resid   42 and  name HA   )(resid   31 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   42 and  name HA   )(resid   31 and  name HG2   ) 4.0 1.0 1.9
assign (resid   42 and  name HA   )(resid   41 and  name HB2   ) 4.0 1.0 1.8
assign (resid   42 and  name HA   )(resid   43 and  name HB2   ) 4.0 1.0 1.5
assign (resid   42 and  name HA   )(resid   43 and  name HA    ) 4.0 1.0 1.5
assign (resid   42 and  name HA   )(resid   60 and  name HA    ) 3.5 2.2 1.5
assign (resid   42 and  name HB1  )(resid   33 and  name HB2   ) 3.5 2.2 1.5
assign (resid   42 and  name HB1  )(resid   35 and  name HG2*  ) 3.5 2.2 1.5
!L43
!intra
!assign (resid   43 and  name HN   )(resid   43 and  name HA    ) 3.0 1.0 1.0
!assign (resid   43 and  name HN   )(resid   43 and  name HB#   ) 3.0 1.0 1.5
!assign (resid   43 and  name HN   )(resid   43 and  name HG    ) 4.0 1.0 1.0
!assign (resid   43 and  name HN   )(resid   43 and  name HD1*  ) 4.0 1.0 1.0
!assign (resid   43 and  name HA   )(resid   43 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   43 and  name HA   )(resid   43 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   43 and  name HA   )(resid   43 and  name HG    ) 3.5 2.2 1.5
!assign (resid   43 and  name HA   )(resid   43 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   43 and  name HB1  )(resid   43 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   43 and  name HB1  )(resid   43 and  name HG    ) 3.5 2.2 1.5
!assign (resid   43 and  name HB1  )(resid   43 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   43 and  name HB1  )(resid   43 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   43 and  name HB2  )(resid   43 and  name HG    ) 3.5 2.2 1.5
!assign (resid   43 and  name HB2  )(resid   43 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   43 and  name HB2  )(resid   43 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   43 and  name HD1* )(resid   43 and  name HG    ) 3.5 2.2 1.5
!inter
assign (resid   43 and  name HN   )(resid   44 and  name HN    ) 4.0 1.0 1.0
assign (resid   43 and  name HN   )(resid   61 and  name HN    ) 4.0 1.0 1.0
assign (resid   43 and  name HN   )(resid   60 and  name HA    ) 3.0 1.0 0.5
assign (resid   43 and  name HN   )(resid   42 and  name HA    ) 3.0 1.2 0.5
!assign (resid   43 and  name HN   )(resid   30 and  name HA    ) 4.0 1.0 1.0
assign (resid   43 and  name HN   )(resid   44 and  name HA#   ) 4.0 1.0 1.0
assign (resid   43 and  name HN   )(resid   42 and  name HB#   ) 4.0 1.0 1.0
assign (resid   43 and  name HN   )(resid   60 and  name HB*   ) 4.0 1.0 1.0
assign (resid   43 and  name HA   )(resid   30 and  name HG    ) 3.5 1.0 1.5
!assign (resid   43 and  name HA   )(resid   44 and  name HN    ) 3.5 2.2 1.5
!assign (resid   43 and  name HA   )(resid   61 and  name HA    ) 4.0 1.0 1.5
!assign (resid   43 and  name HB1  )(resid   30 and  name HG    ) 4.0 1.0 1.5
assign (resid   43 and  name HB1  )(resid   44 and  name HN    ) 4.0 1.0 1.5
assign (resid   43 and  name HB1  )(resid   60 and  name HA    ) 3.5 2.2 1.5
!assign (resid   43 and  name HB1  )(resid   61 and  name HB2   ) 3.5 1.0 1.5
!assign (resid   43 and  name HB2  )(resid   30 and  name HG    ) 4.0 1.0 1.9
assign (resid   43 and  name HB2  )(resid   44 and  name HN    ) 4.0 1.0 1.5
assign (resid   43 and  name HB2  )(resid   58 and  name HB1   ) 4.0 1.0 1.5
assign (resid   43 and  name HB2  )(resid   60 and  name HN    ) 3.5 1.0 1.5
assign (resid   43 and  name HB2  )(resid   60 and  name HA    ) 3.5 2.2 1.5
assign (resid   43 and  name HD1* )(resid   28 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   43 and  name HD1* )(resid   60 and  name HN    ) 4.0 1.0 1.9
assign (resid   43 and  name HD1* )(resid   60 and  name HA    ) 4.0 1.0 1.9
assign (resid   43 and  name HD1* )(resid   61 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   43 and  name HD1* )(resid   61 and  name HB2   ) 3.5 2.2 1.5
!G44
!intra
!assign (resid   44 and  name HN   )(resid   44 and  name HA#   ) 3.0 1.0 1.0
!assign (resid   44 and  name HA1  )(resid   44 and  name HA2   ) 3.5 2.2 1.5
!inter
assign (resid   44 and  name HN   )(resid   45 and  name HN    ) 4.0 1.0 1.0
assign (resid   44 and  name HN   )(resid   43 and  name HA    ) 3.0 1.2 0.5
assign (resid   44 and  name HN   )(resid   30 and  name HA    ) 3.5 1.0 1.0
assign (resid   44 and  name HN   )(resid   31 and  name HD#   ) 4.0 1.0 1.0
!assign (resid   44 and  name HN   )(resid   29 and  name HG#   ) 4.0 1.0 1.0
assign (resid   44 and  name HN   )(resid   29 and  name HB#   ) 3.0 1.0 1.7
!assign (resid   44 and  name HN   )(resid   43 and  name HG    ) 4.0 1.0 0.5
assign (resid   44 and  name HN   )(resid   43 and  name HD1*  ) 4.0 1.0 1.0
assign (resid   44 and  name HN   )(resid   30 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   44 and  name HA1  )(resid   29 and  name HN    ) 4.0 1.0 1.5
assign (resid   44 and  name HA1  )(resid   29 and  name HB1   ) 4.0 1.0 1.5
assign (resid   44 and  name HA1  )(resid   29 and  name HB2   ) 4.0 1.0 1.5
assign (resid   44 and  name HA1  )(resid   43 and  name HA    ) 4.0 1.0 1.5
assign (resid   44 and  name HA1  )(resid   43 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   44 and  name HA1  )(resid   47 and  name HG2*  ) 3.5 1.5 1.5
assign (resid   44 and  name HA2  )(resid   29 and  name HN    ) 4.0 1.0 1.5
assign (resid   44 and  name HA2  )(resid   31 and  name HD1   ) 3.5 1.5 1.5
assign (resid   44 and  name HA2  )(resid   43 and  name HA    ) 4.0 1.0 1.5
assign (resid   44 and  name HA2  )(resid   43 and  name HD1*  ) 4.0 1.0 1.9
assign (resid   44 and  name HA2  )(resid   47 and  name HG2*  ) 3.5 1.5 1.9
!G45
!intra
!assign (resid   45 and  name HN   )(resid   45 and  name HA#   ) 3.0 1.0 0.5
!assign (resid   45 and  name HA1  )(resid   45 and  name HA2   ) 3.5 2.2 1.5
!inter
assign (resid   45 and  name HN   )(resid   46 and  name HN    ) 4.0 1.0 1.0
assign (resid   45 and  name HN   )(resid   44 and  name HA#   ) 3.0 1.0 0.5
assign (resid   45 and  name HN   )(resid   29 and  name HB#   ) 4.0 1.0 1.0
assign (resid   45 and  name HA1  )(resid   29 and  name HB1   ) 4.0 1.5 1.0
!assign (resid   45 and  name HA1  )(resid   29 and  name HB2   ) 4.0 1.0 1.5
assign (resid   45 and  name HA1  )(resid   29 and  name HG1   ) 3.5 1.5 1.5
!assign (resid   45 and  name HA1  )(resid   43 and  name HD1*  ) 4.0 1.0 1.9
assign (resid   45 and  name HA1  )(resid   46 and  name HB1   ) 4.0 1.0 1.5
assign (resid   45 and  name HA2  )(resid   29 and  name HB1   ) 3.5 1.5 1.5
!assign (resid   45 and  name HA2  )(resid   29 and  name HB2   ) 4.0 1.0 1.5
assign (resid   45 and  name HA2  )(resid   29 and  name HG1   ) 4.0 1.0 1.5
assign (resid   45 and  name HA2  )(resid   43 and  name HD1*  ) 4.0 1.0 2.0
!assign (resid   45 and  name HA2  )(resid   46 and  name HB1   ) 4.0 1.0 1.5
assign (resid   45 and  name HA2  )(resid   47 and  name HG2*  ) 4.0 1.0 1.9
!assign (resid   45 and  name HA2  )(resid   48 and  name HN    ) 4.0 1.0 1.9
!D46
!intra
!assign (resid   46 and  name HN   )(resid   44 and  name HN    ) 4.0 1.0 1.0
!assign (resid   46 and  name HN   )(resid   46 and  name HA    ) 3.0 1.0 1.0
!assign (resid   46 and  name HN   )(resid   46 and  name HB#   ) 3.0 1.0 0.5
!assign (resid   46 and  name HA   )(resid   46 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   46 and  name HA   )(resid   46 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   46 and  name HB1  )(resid   46 and  name HB2   ) 3.5 2.2 1.5
!inter
assign (resid   46 and  name HN   )(resid   47 and  name HN    ) 3.5 1.0 1.0
assign (resid   46 and  name HN   )(resid   29 and  name HN    ) 4.0 1.0 1.0
assign (resid   46 and  name HN   )(resid   45 and  name HA#   ) 3.0 1.0 0.8
assign (resid   46 and  name HN   )(resid   28 and  name HD1*  ) 4.0 1.0 1.0
assign (resid   46 and  name HN   )(resid   28 and  name HD2*  ) 4.0 1.0 1.0
assign (resid   46 and  name HA   )(resid   45 and  name HA1   ) 3.5 1.0 1.5
assign (resid   46 and  name HA   )(resid   48 and  name HB*   ) 3.5 1.5 1.5
assign (resid   46 and  name HB1  )(resid   26 and  name HA    ) 3.5 1.0 1.5
assign (resid   46 and  name HB1  )(resid   27 and  name HN    ) 3.5 2.2 1.5
!assign (resid   46 and  name HB1  )(resid   48 and  name HB*   ) 4.0 1.0 1.9
!assign (resid   46 and  name HB1  )(resid   49 and  name HB1   ) 3.5 1.5 1.5
assign (resid   46 and  name HB2  )(resid   26 and  name HA    ) 3.5 1.0 1.5
assign (resid   46 and  name HB2  )(resid   27 and  name HN    ) 3.5 2.2 1.5
assign (resid   46 and  name HB2  )(resid   45 and  name HA1   ) 4.0 1.0 1.9
!assign (resid   46 and  name HB2  )(resid   48 and  name HB*   ) 4.0 1.0 1.9
assign (resid   46 and  name HB2  )(resid   49 and  name HB1   ) 3.5 2.2 1.5
!T47
!intra
!assign (resid   47 and  name HN   )(resid   47 and  name HB    ) 4.0 1.2 1.0
!assign (resid   47 and  name HN   )(resid   47 and  name HA    ) 3.0 1.0 1.0
!assign (resid   47 and  name HN   )(resid   47 and  name HG2*  ) 3.0 1.0 1.3
!assign (resid   47 and  name HA   )(resid   47 and  name HB    ) 3.5 2.2 1.5
!assign (resid   47 and  name HA   )(resid   47 and  name HG2*  ) 3.5 2.2 1.5
!inter
assign (resid   47 and  name HN   )(resid   48 and  name HN    ) 3.0 1.0 1.0
assign (resid   47 and  name HN   )(resid   46 and  name HA    ) 3.0 1.0 0.5
assign (resid   47 and  name HN   )(resid   45 and  name HA#   ) 4.0 1.0 1.0
assign (resid   47 and  name HN   )(resid   46 and  name HB#   ) 4.0 1.0 1.0
assign (resid   47 and  name HN   )(resid   28 and  name HD2*  ) 4.0 1.0 1.0
assign (resid   47 and  name HA   )(resid   43 and  name HG    ) 4.0 1.0 1.5
!assign (resid   47 and  name HA   )(resid   49 and  name HB2   ) 3.5 2.2 1.5
assign (resid   47 and  name HA   )(resid   50 and  name HB1   ) 3.5 1.0 1.5
assign (resid   47 and  name HA   )(resid   50 and  name HB2   ) 3.5 1.0 1.5
assign (resid   47 and  name HA   )(resid   50 and  name HG    ) 3.5 2.2 1.5
assign (resid   47 and  name HA   )(resid   57 and  name HG2   ) 4.0 1.0 1.5
!assign (resid   47 and  name HB   )(resid   28 and  name HD2*  ) 4.0 1.0 1.5
assign (resid   47 and  name HB   )(resid   43 and  name HG    ) 4.0 1.0 1.5
assign (resid   47 and  name HB   )(resid   48 and  name HN    ) 4.0 1.0 1.9
assign (resid   47 and  name HB   )(resid   50 and  name HG    ) 3.5 2.2 1.5
assign (resid   47 and  name HB   )(resid   50 and  name HB2   ) 4.0 1.0 1.9
assign (resid   47 and  name HB   )(resid   57 and  name HG2   ) 3.5 2.2 1.5
assign (resid   47 and  name HG2* )(resid   28 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   47 and  name HG2* )(resid   43 and  name HG    ) 3.5 2.2 1.5
assign (resid   47 and  name HG2* )(resid   50 and  name HG    ) 4.0 1.0 1.5
assign (resid   47 and  name HG2* )(resid   57 and  name HG2   ) 4.0 1.0 1.5
assign (resid   47 and  name HG2* )(resid   58 and  name HG1   ) 3.5 2.2 1.5
!A48
!intra
!assign (resid   48 and  name HN   )(resid   48 and  name HA    ) 3.0 1.0 1.0
!assign (resid   48 and  name HN   )(resid   48 and  name HB*   ) 3.0 1.0 1.2
!assign (resid   48 and  name HA   )(resid   48 and  name HB*   ) 3.5 2.2 1.5
!inter
assign (resid   48 and  name HN   )(resid   46 and  name HN    ) 4.0 1.0 1.0
assign (resid   48 and  name HN   )(resid   49 and  name HN    ) 3.0 1.0 0.7
assign (resid   48 and  name HN   )(resid   50 and  name HN    ) 4.0 1.0 1.0
assign (resid   48 and  name HN   )(resid   46 and  name HA    ) 4.0 1.5 0.5
assign (resid   48 and  name HN   )(resid   47 and  name HA    ) 4.0 1.0 1.0
assign (resid   48 and  name HN   )(resid   49 and  name HB#   ) 4.0 1.0 1.0
assign (resid   48 and  name HN   )(resid   57 and  name HG#   ) 4.0 1.0 1.0
!assign (resid   48 and  name HN   )(resid   57 and  name HB#   ) 4.0 1.0 1.0
assign (resid   48 and  name HN   )(resid   47 and  name HG2*  ) 4.0 1.0 1.0
assign (resid   48 and  name HA   )(resid   51 and  name HG2*  ) 3.5 2.2 1.5
assign (resid   48 and  name HA   )(resid   57 and  name HB1   ) 3.5 1.5 1.5
assign (resid   48 and  name HA   )(resid   57 and  name HG2   ) 3.5 2.2 1.5
assign (resid   48 and  name HB*  )(resid   47 and  name HN    ) 4.0 1.0 2.0
!C49
!intra
!assign (resid   49 and  name HN   )(resid   49 and  name HA    ) 3.0 1.0 1.0
!assign (resid   49 and  name HN   )(resid   49 and  name HB#   ) 3.0 1.0 0.5
!assign (resid   49 and  name HA   )(resid   49 and  name HB#   ) 3.5 2.2 1.5
!inter
assign (resid   49 and  name HN   )(resid   50 and  name HN    ) 3.0 1.2 0.5
assign (resid   49 and  name HN   )(resid   47 and  name HN    ) 4.0 1.0 1.0
assign (resid   49 and  name HN   )(resid   47 and  name HA    ) 3.0 1.0 1.0
assign (resid   49 and  name HN   )(resid   50 and  name HB#   ) 4.0 1.0 1.0
assign (resid   49 and  name HN   )(resid   50 and  name HG    ) 4.0 1.0 1.0
assign (resid   49 and  name HN   )(resid   48 and  name HB*   ) 3.0 1.0 1.5
assign (resid   49 and  name HA   )(resid   48 and  name HB*   ) 3.5 1.5 1.5
assign (resid   49 and  name HA   )(resid   51 and  name HN    ) 4.0 1.0 1.5
assign (resid   49 and  name HB#  )(resid   26 and  name HB2   ) 3.5 2.2 1.5
assign (resid   49 and  name HB#  )(resid   28 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   49 and  name HB#  )(resid   48 and  name HB*   ) 4.0 1.0 1.9
assign (resid   49 and  name HB#  )(resid   50 and  name HG    ) 4.0 1.0 1.5
assign (resid   49 and  name HB#  )(resid   50 and  name HD2*  ) 4.0 1.0 2.0
!L50
!intra
!assign (resid   50 and  name HN   )(resid   50 and  name HA    ) 3.0 1.0 1.0
!assign (resid   50 and  name HN   )(resid   50 and  name HB#   ) 3.0 1.0 1.5
!assign (resid   50 and  name HN   )(resid   50 and  name HG    ) 3.0 1.2 0.5
!assign (resid   50 and  name HN   )(resid   50 and  name HD1*  ) 4.0 1.0 1.0
!assign (resid   50 and  name HA   )(resid   50 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   50 and  name HA   )(resid   50 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   50 and  name HA   )(resid   50 and  name HG    ) 3.5 2.2 1.5
!assign (resid   50 and  name HA   )(resid   50 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   50 and  name HB1  )(resid   50 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   50 and  name HB1  )(resid   50 and  name HG    ) 3.5 2.2 1.5
!assign (resid   50 and  name HB1  )(resid   50 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   50 and  name HB2  )(resid   50 and  name HG    ) 3.5 2.2 1.5
!assign (resid   50 and  name HB2  )(resid   50 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   50 and  name HG   )(resid   50 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   50 and  name HD2* )(resid   50 and  name HN    ) 4.0 1.0 1.5
!inter
assign (resid   50 and  name HN   )(resid   51 and  name HN    ) 3.0 1.0 1.0
assign (resid   50 and  name HN   )(resid   49 and  name HA    ) 3.5 1.0 1.0
assign (resid   50 and  name HN   )(resid   47 and  name HA    ) 3.5 1.0 1.0
assign (resid   50 and  name HN   )(resid   49 and  name HB#   ) 3.0 1.0 1.5
assign (resid   50 and  name HN   )(resid   48 and  name HB*   ) 4.0 1.0 2.0
assign (resid   50 and  name HN   )(resid   51 and  name HG2*  ) 4.0 1.0 1.5
assign (resid   50 and  name HA   )(resid   53 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   50 and  name HB1  )(resid   17 and  name HD2*  ) 4.0 1.0 1.9
!assign (resid   50 and  name HB1  )(resid   28 and  name HD2*  ) 4.0 1.0 1.9
assign (resid   50 and  name HB1  )(resid   53 and  name HN    ) 4.0 1.0 1.9
assign (resid   50 and  name HB1  )(resid   57 and  name HA    ) 3.5 2.2 1.5
assign (resid   50 and  name HB2  )(resid   17 and  name HD2*  ) 4.0 1.0 1.9
assign (resid   50 and  name HB2  )(resid   28 and  name HD2*  ) 4.0 1.0 1.9
assign (resid   50 and  name HB2  )(resid   53 and  name HN    ) 4.0 1.0 1.9
assign (resid   50 and  name HB2  )(resid   57 and  name HA    ) 3.5 2.2 1.5
assign (resid   50 and  name HG   )(resid   17 and  name HD2*  ) 4.0 1.0 1.5
assign (resid   50 and  name HG   )(resid   26 and  name HB2   ) 4.0 1.0 1.9
!assign (resid   50 and  name HG   )(resid   28 and  name HN    ) 3.5 2.2 1.5
assign (resid   50 and  name HG   )(resid   53 and  name HN    ) 4.0 1.0 1.9
assign (resid   50 and  name HG   )(resid   57 and  name HA    ) 4.0 1.0 1.9
assign (resid   50 and  name HD1* )(resid   17 and  name HD2*  ) 4.0 1.0 1.9
assign (resid   50 and  name HD1* )(resid   47 and  name HA    ) 3.5 1.5 1.5
assign (resid   50 and  name HD1* )(resid   51 and  name HN    ) 4.0 1.0 2.0
!assign (resid   50 and  name HD1* )(resid   53 and  name HN    ) 4.0 1.0 1.9
assign (resid   50 and  name HD1* )(resid   58 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   50 and  name HD2* )(resid   47 and  name HN    ) 4.0 1.0 1.9
assign (resid   50 and  name HD2* )(resid   47 and  name HA    ) 3.5 1.5 1.5
assign (resid   50 and  name HD2* )(resid   53 and  name HN    ) 4.0 1.0 1.9
!T51
!intra
!assign (resid   51 and  name HN   )(resid   51 and  name HA    ) 3.0 1.0 1.0
!assign (resid   51 and  name HN   )(resid   51 and  name HG2*  ) 3.0 1.2 1.5
!assign (resid   51 and  name HA   )(resid   51 and  name HB    ) 3.5 2.2 1.5
!assign (resid   51 and  name HA   )(resid   51 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid   51 and  name HB   )(resid   51 and  name HN    ) 3.5 1.5 1.5
!assign (resid   51 and  name HB   )(resid   51 and  name HG2*  ) 3.5 2.2 1.5
!inter
assign (resid   51 and  name HN   )(resid   52 and  name HN    ) 3.0 1.0 1.0
assign (resid   51 and  name HN   )(resid   53 and  name HN    ) 4.0 1.0 1.0
assign (resid   51 and  name HN   )(resid   50 and  name HA    ) 4.0 1.0 1.0
assign (resid   51 and  name HN   )(resid   48 and  name HA    ) 3.0 1.0 1.5
assign (resid   51 and  name HN   )(resid   50 and  name HB#   ) 3.0 1.0 1.0
assign (resid   51 and  name HN   )(resid   50 and  name HG    ) 4.0 1.0 1.0
assign (resid   51 and  name HN   )(resid   48 and  name HB*   ) 4.0 1.0 2.0
assign (resid   51 and  name HN   )(resid   52 and  name HB#   ) 4.0 1.0 1.0
!assign (resid   51 and  name HN   )(resid   50 and  name HG    ) 4.0 1.0 1.0 - reduntant
assign (resid   51 and  name HA   )(resid   54 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   51 and  name HA   )(resid   54 and  name HD1*  ) 4.0 1.5 2.0
assign (resid   51 and  name HA   )(resid   56 and  name HN    ) 3.5 1.5 1.5
assign (resid   51 and  name HB   )(resid   52 and  name HN    ) 4.0 1.0 1.5
assign (resid   51 and  name HB   )(resid   53 and  name HN    ) 4.0 1.0 1.8
!assign (resid   51 and  name HB   )(resid   54 and  name HD1*  ) 3.5 1.0 1.5
!assign (resid   51 and  name HG2* )(resid   53 and  name HN    ) 4.0 1.0 1.9
assign (resid   51 and  name HG2* )(resid   56 and  name HN    ) 4.0 1.0 2.0
assign (resid   51 and  name HG2* )(resid   57 and  name HA    ) 3.5 1.5 1.5
assign (resid   51 and  name HG2* )(resid   57 and  name HB1   ) 3.5 2.2 1.5
assign (resid   51 and  name HG2* )(resid   57 and  name HB2   ) 4.0 1.0 1.5
!R52
!intra
!assign (resid   52 and  name HN   )(resid   52 and  name HA    ) 3.0 1.0 1.0
!assign (resid   52 and  name HN   )(resid   52 and  name HB#   ) 3.0 1.0 1.3
!assign (resid   52 and  name HA   )(resid   52 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   52 and  name HA   )(resid   52 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   52 and  name HA   )(resid   52 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   52 and  name HA   )(resid   52 and  name HD1   ) 3.5 1.5 1.5
!assign (resid   52 and  name HB1  )(resid   52 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   52 and  name HB1  )(resid   52 and  name HD#   ) 3.5 2.2 1.5
!assign (resid   52 and  name HB2  )(resid   52 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   52 and  name HB2  )(resid   52 and  name HD#   ) 3.5 2.2 1.5
!assign (resid   52 and  name HG1  )(resid   52 and  name HN    ) 3.5 2.2 1.5
!assign (resid   52 and  name HG1  )(resid   52 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   52 and  name HG1  )(resid   52 and  name HD#   ) 3.5 2.2 1.5
!assign (resid   52 and  name HG2  )(resid   52 and  name HN    ) 3.5 2.2 1.5
!assign (resid   52 and  name HG2  )(resid   52 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   52 and  name HG2  )(resid   52 and  name HD#   ) 3.5 2.2 1.5
!inter
assign (resid   52 and  name HN   )(resid   53 and  name HN    ) 3.0 1.2 0.5
assign (resid   52 and  name HN   )(resid   50 and  name HN    ) 4.0 1.0 1.0
assign (resid   52 and  name HN   )(resid   51 and  name HA    ) 3.0 1.0 1.5
assign (resid   52 and  name HN   )(resid   50 and  name HA    ) 3.0 1.0 1.2
assign (resid   52 and  name HN   )(resid   49 and  name HA    ) 4.0 1.0 1.0
!assign (resid   52 and  name HN   )(resid   50 and  name HG    ) 4.0 1.0 1.0
assign (resid   52 and  name HN   )(resid   50 and  name HB#   ) 4.0 1.0 1.0
assign (resid   52 and  name HN   )(resid   51 and  name HG2*  ) 4.0 1.0 1.0
assign (resid   52 and  name HD1  )(resid   24 and  name HB*   ) 4.0 1.0 2.0
assign (resid   52 and  name HD2  )(resid   24 and  name HB*   ) 4.0 1.0 2.0
!W53
!intra
!assign (resid   53 and  name HN   )(resid   53 and  name HA    ) 3.0 1.0 1.0
!assign (resid   53 and  name HN   )(resid   53 and  name HB#   ) 3.0 1.0 1.2
!assign (resid   53 and  name HA   )(resid   53 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   53 and  name HA   )(resid   53 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   53 and  name HB1  )(resid   53 and  name HB2   ) 3.5 2.2 1.5
assign (resid   53 and  name HE3  )(resid   53 and  name HB1   ) 3.5 1.5 2.5
assign (resid   53 and  name HE3  )(resid   53 and  name HB2   ) 3.5 1.5 2.5
!inter
assign (resid   53 and  name HN   )(resid   54 and  name HN    ) 3.0 1.2 0.5
assign (resid   53 and  name HN   )(resid   51 and  name HA    ) 3.5 1.0 1.0
assign (resid   53 and  name HN   )(resid   50 and  name HA    ) 3.5 1.0 1.0
assign (resid   53 and  name HN   )(resid   52 and  name HA    ) 3.5 1.0 1.0
assign (resid   53 and  name HN   )(resid   54 and  name HB#   ) 4.0 1.0 1.0
assign (resid   53 and  name HN   )(resid   52 and  name HB#   ) 4.0 1.0 1.0
assign (resid   53 and  name HN   )(resid   52 and  name HG#   ) 3.0 1.0 1.0
assign (resid   53 and  name HA   )(resid   52 and  name HG1   ) 4.0 1.0 1.5
assign (resid   53 and  name HA   )(resid   54 and  name HG    ) 4.0 1.0 1.5
assign (resid   53 and  name HA   )(resid   99 and  name HD2*  ) 4.0 1.0 1.9
!assign (resid   53 and  name HB1  )(resid   50 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   53 and  name HB1  )(resid   52 and  name HG1   ) 4.0 1.0 1.5
!assign (resid   53 and  name HB1  )(resid   54 and  name HB1   ) 4.0 1.0 1.5
assign (resid   53 and  name HB1  )(resid   54 and  name HG    ) 3.5 2.2 1.5
assign (resid   53 and  name HB1  )(resid   99 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   53 and  name HB1  )(resid   99 and  name HD2*  ) 3.5 1.5 1.8
!assign (resid   53 and  name HB2  )(resid   50 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   53 and  name HB2  )(resid   52 and  name HG1   ) 4.0 1.0 1.5
assign (resid   53 and  name HB2  )(resid   54 and  name HB1   ) 4.0 1.0 1.9
assign (resid   53 and  name HB2  )(resid   54 and  name HG    ) 3.5 1.5 1.5
assign (resid   53 and  name HB2  )(resid   99 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   53 and  name HB2  )(resid   99 and  name HD2*  ) 3.5 1.5 1.8
!assign (resid   53 and  name HD1  )(resid   52 and  name HB1   ) 3.5 2.2 1.5
assign (resid   53 and  name HD1  )(resid   52 and  name HG2   ) 3.5 2.2 1.5
assign (resid   53 and  name HD1  )(resid   99 and  name HD1*  ) 3.5 2.2 2.5
assign (resid   53 and  name HD1  )(resid   99 and  name HD2*  ) 3.5 2.2 2.5
assign (resid   53 and  name HZ2  )(resid   19 and  name HN    ) 3.5 2.2 1.5
assign (resid   53 and  name HZ2  )(resid   19 and  name HB1   ) 3.5 1.5 1.5
assign (resid   53 and  name HZ2  )(resid   19 and  name HB2   ) 3.5 1.5 1.5
assign (resid   53 and  name HZ2  )(resid   24 and  name HB*   ) 3.5 1.5 1.5
!assign (resid   53 and  name HZ2  )(resid   52 and  name HG2   ) 3.5 1.5 1.5
assign (resid   53 and  name HZ2  )(resid   52 and  name HD2   ) 3.5 1.5 1.5
assign (resid   53 and  name HZ2  )(resid   99 and  name HD2*  ) 3.5 1.5 1.5
assign (resid   53 and  name HH2  )(resid   17 and  name HB2   ) 3.5 1.5 1.5
assign (resid   53 and  name HH2  )(resid   17 and  name HD2*  ) 3.5 1.5 2.5
assign (resid   53 and  name HH2  )(resid   19 and  name HN    ) 3.5 1.5 1.5
assign (resid   53 and  name HH2  )(resid   26 and  name HN    ) 3.5 1.5 1.5
assign (resid   53 and  name HH2  )(resid   26 and  name HB1   ) 3.5 1.5 1.5
!assign (resid   53 and  name HH2  )(resid   52 and  name HB#   ) 3.5 1.5 1.5
assign (resid   53 and  name HZ3  )(resid   17 and  name HB#   ) 3.5 1.5 1.5
assign (resid   53 and  name HZ3  )(resid   17 and  name HD2*  ) 3.5 1.5 1.5
assign (resid   53 and  name HZ3  )(resid   26 and  name HN    ) 3.5 1.5 1.5
assign (resid   53 and  name HZ3  )(resid   26 and  name HB1   ) 3.5 1.5 1.5
assign (resid   53 and  name HZ3  )(resid   26 and  name HB2   ) 3.5 1.5 1.5
assign (resid   53 and  name HZ3  )(resid   50 and  name HA    ) 3.5 1.5 1.5
assign (resid   53 and  name HZ3  )(resid   50 and  name HD2*  ) 3.5 1.5 1.5
assign (resid   53 and  name HE3  )(resid   17 and  name HD2*  ) 3.5 1.5 1.5
assign (resid   53 and  name HE3  )(resid   50 and  name HA    ) 3.5 1.5 1.5
assign (resid   53 and  name HE3  )(resid   50 and  name HB2   ) 3.5 1.5 1.5
assign (resid   53 and  name HE3  )(resid   54 and  name HN    ) 3.5 1.5 2.0
!assign (resid   53 and  name HE3  )(resid   79 and  name HE*   ) 3.5 1.5 2.0
!assign (resid   53 and  name HE3  )(resid   99 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   53 and  name HE3  )(resid   99 and  name HD2*  ) 3.5 1.5 2.5
!L54
!intra
!assign (resid   54 and  name HN   )(resid   54 and  name HA    ) 3.0 1.0 1.0
!assign (resid   54 and  name HN   )(resid   54 and  name HB#   ) 3.0 1.2 1.3
!assign (resid   54 and  name HN   )(resid   54 and  name HG    ) 3.0 1.0 1.0
!assign (resid   54 and  name HN   )(resid   54 and  name HD1*  ) 4.0 1.0 1.0
!assign (resid   54 and  name HA   )(resid   54 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   54 and  name HA   )(resid   54 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   54 and  name HA   )(resid   54 and  name HG    ) 3.5 2.2 1.5
!assign (resid   54 and  name HA   )(resid   54 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   54 and  name HA   )(resid   54 and  name HD2*  ) 3.5 1.0 1.5
!assign (resid   54 and  name HB1  )(resid   54 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   54 and  name HB1  )(resid   54 and  name HG    ) 3.5 2.2 1.5
!assign (resid   54 and  name HB1  )(resid   54 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   54 and  name HB1  )(resid   54 and  name HD2*  ) 3.5 1.0 1.5
!assign (resid   54 and  name HB2  )(resid   54 and  name HG    ) 3.5 2.2 1.5
!assign (resid   54 and  name HB2  )(resid   54 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   54 and  name HB2  )(resid   54 and  name HD2*  ) 3.5 1.0 1.5
!assign (resid   54 and  name HG   )(resid   54 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   54 and  name HG   )(resid   54 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   54 and  name HD2* )(resid   54 and  name HN    ) 3.5 1.0 1.5
!inter
assign (resid   54 and  name HN   )(resid   52 and  name HN    ) 3.5 1.0 1.5
assign (resid   54 and  name HN   )(resid   53 and  name HA    ) 3.5 1.0 1.5
assign (resid   54 and  name HN   )(resid   51 and  name HA    ) 3.0 1.0 1.0
assign (resid   54 and  name HN   )(resid   50 and  name HA    ) 4.0 1.0 1.0
assign (resid   54 and  name HN   )(resid   52 and  name HA    ) 4.0 1.0 1.0
assign (resid   54 and  name HN   )(resid   55 and  name HD#   ) 4.0 1.0 1.0
assign (resid   54 and  name HN   )(resid   53 and  name HB#   ) 3.0 1.0 1.2
assign (resid   54 and  name HN   )(resid   51 and  name HG2*  ) 4.0 1.0 2.0
!assign (resid   54 and  name HN   )(resid   52 and  name HB#   ) 4.0 1.0 1.0
!assign (resid   54 and  name HN   )(resid   52 and  name HG#   ) 4.0 1.0 1.0
assign (resid   54 and  name HA   )(resid   53 and  name HN    ) 4.0 1.0 1.5
assign (resid   54 and  name HA   )(resid   55 and  name HD1   ) 3.5 2.2 1.5
assign (resid   54 and  name HA   )(resid   55 and  name HG1   ) 3.5 2.2 1.5
assign (resid   54 and  name HA   )(resid   55 and  name HG2   ) 3.5 2.2 1.5
assign (resid   54 and  name HA   )(resid   55 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   54 and  name HA   )(resid   78 and  name HD1*  ) 4.0 1.0 1.9
assign (resid   54 and  name HA   )(resid   78 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   54 and  name HB1  )(resid   55 and  name HD1   ) 3.5 2.2 1.5
assign (resid   54 and  name HB1  )(resid   55 and  name HD2   ) 3.5 2.2 1.5
assign (resid   54 and  name HB1  )(resid   57 and  name HA    ) 4.0 1.0 1.5
assign (resid   54 and  name HB1  )(resid   78 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   54 and  name HB1  )(resid   78 and  name HD2*  ) 4.0 1.5 2.0
assign (resid   54 and  name HB2  )(resid   51 and  name HA    ) 4.0 1.0 1.5
assign (resid   54 and  name HB2  )(resid   55 and  name HD1   ) 3.5 2.2 1.5
assign (resid   54 and  name HB2  )(resid   55 and  name HD2   ) 3.5 2.2 1.5
assign (resid   54 and  name HB2  )(resid   57 and  name HA    ) 4.0 1.0 1.5
assign (resid   54 and  name HB2  )(resid   78 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   54 and  name HB2  )(resid   78 and  name HD2*  ) 3.5 1.5 1.5
assign (resid   54 and  name HG   )(resid   50 and  name HB2   ) 3.5 1.5 1.5
assign (resid   54 and  name HG   )(resid   53 and  name HN    ) 3.5 1.0 1.5
assign (resid   54 and  name HG   )(resid   55 and  name HD1   ) 4.0 1.0 1.5
assign (resid   54 and  name HG   )(resid   55 and  name HD2   ) 4.0 1.0 1.9
assign (resid   54 and  name HG   )(resid   56 and  name HN    ) 4.0 1.0 1.9
assign (resid   54 and  name HG   )(resid   78 and  name HB2   ) 4.0 1.0 1.5
!assign (resid   54 and  name HG   )(resid   78 and  name HD2*  ) 4.0 1.0 1.9
assign (resid   54 and  name HG   )(resid   79 and  name HB1   ) 3.5 2.2 1.5
assign (resid   54 and  name HD1* )(resid   50 and  name HB2   ) 3.5 2.2 1.5
assign (resid   54 and  name HD1* )(resid   53 and  name HN    ) 4.0 1.0 2.0
assign (resid   54 and  name HD1* )(resid   53 and  name HB1   ) 3.5 1.5 1.5
assign (resid   54 and  name HD1* )(resid   56 and  name HN    ) 4.0 1.0 1.5
assign (resid   54 and  name HD1* )(resid   78 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   54 and  name HD1* )(resid   78 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   54 and  name HD2* )(resid   53 and  name HN    ) 4.0 1.0 1.5
assign (resid   54 and  name HD2* )(resid   53 and  name HB1   ) 3.5 1.0 1.5
assign (resid   54 and  name HD2* )(resid   53 and  name HB2   ) 4.0 1.0 1.5
assign (resid   54 and  name HD2* )(resid   55 and  name HD1   ) 3.5 2.2 1.5
assign (resid   54 and  name HD2* )(resid   55 and  name HD2   ) 3.5 2.2 1.5
assign (resid   54 and  name HD2* )(resid   56 and  name HN    ) 4.0 1.0 1.5
assign (resid   54 and  name HD2* )(resid   78 and  name HA    ) 3.5 1.0 1.5
assign (resid   54 and  name HD2* )(resid   78 and  name HB2   ) 3.5 2.5 1.5
assign (resid   54 and  name HD2* )(resid   78 and  name HD2*  ) 4.0 1.5 2.0
assign (resid   54 and  name HD2* )(resid   79 and  name HN    ) 4.0 1.0 1.5
assign (resid   54 and  name HD2* )(resid   79 and  name HB1   ) 3.5 2.2 1.5
assign (resid   54 and  name HD2* )(resid   79 and  name HG2   ) 3.5 2.2 1.5
!P55
!intra
!assign (resid   55 and  name HA   )(resid   55 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   55 and  name HA   )(resid   55 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   55 and  name HA   )(resid   55 and  name HD1   ) 4.0 1.0 1.5
!assign (resid   55 and  name HB1  )(resid   55 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   55 and  name HB1  )(resid   55 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   55 and  name HB1  )(resid   55 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   55 and  name HB2  )(resid   55 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   55 and  name HB2  )(resid   55 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   55 and  name HG1  )(resid   55 and  name HA    ) 4.0 1.0 1.5
!assign (resid   55 and  name HG1  )(resid   55 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   55 and  name HG1  )(resid   55 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   55 and  name HG1  )(resid   55 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   55 and  name HG1  )(resid   55 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   55 and  name HG2  )(resid   55 and  name HA    ) 4.0 1.0 1.5
!assign (resid   55 and  name HG2  )(resid   55 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   55 and  name HG2  )(resid   55 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   55 and  name HG2  )(resid   55 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   55 and  name HD1  )(resid   55 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   55 and  name HD2  )(resid   55 and  name HA    ) 4.0 1.0 1.5
!inter
assign (resid   55 and  name HA   )(resid   56 and  name HN    ) 3.5 2.2 1.5
assign (resid   55 and  name HG1  )(resid   78 and  name HD2*  ) 3.5 1.5 1.5
assign (resid   55 and  name HG2  )(resid   78 and  name HD2*  ) 3.5 1.5 1.5
assign (resid   55 and  name HD1  )(resid   78 and  name HB2   ) 3.5 2.2 1.5
assign (resid   55 and  name HD1  )(resid   78 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   55 and  name HD1  )(resid   78 and  name HD2*  ) 3.5 1.5 1.5
assign (resid   55 and  name HD2  )(resid   78 and  name HB2   ) 3.5 1.5 1.5
assign (resid   55 and  name HD2  )(resid   78 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   55 and  name HD2  )(resid   78 and  name HD2*  ) 3.5 1.5 1.5
!S56
!intra
!assign (resid   56 and  name HA   )(resid   56 and  name HN    ) 3.5 2.2 1.5
!assign (resid   56 and  name HA   )(resid   56 and  name HB#   ) 3.5 2.2 1.5
!assign (resid   56 and  name HB1  )(resid   56 and  name HN    ) 3.5 1.5 1.5
!assign (resid   56 and  name HB1  )(resid   56 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   56 and  name HB2  )(resid   56 and  name HN    ) 3.5 2.2 1.5
!inter
assign (resid   56 and  name HN   )(resid   54 and  name HN    ) 4.0 1.0 1.0
assign (resid   56 and  name HN   )(resid   57 and  name HN    ) 4.0 1.0 1.0
assign (resid   56 and  name HN   )(resid   54 and  name HA    ) 4.0 1.0 1.0
assign (resid   56 and  name HN   )(resid   55 and  name HD#   ) 4.0 1.5 0.8
assign (resid   56 and  name HN   )(resid   55 and  name HB#   ) 4.0 1.0 1.0
assign (resid   56 and  name HN   )(resid   55 and  name HG#   ) 3.0 1.0 1.6
assign (resid   56 and  name HN   )(resid   54 and  name HB#   ) 3.0 1.2 1.0
assign (resid   56 and  name HN   )(resid   78 and  name HB#   ) 4.0 1.0 1.0
!assign (resid   56 and  name HN   )(resid   51 and  name HG2*  ) 4.0 1.0 1.0 - reduntant
assign (resid   56 and  name HN   )(resid   78 and  name HD1*  ) 4.0 1.0 1.0
assign (resid   56 and  name HN   )(resid   78 and  name HD2*  ) 4.0 1.0 1.0
assign (resid   56 and  name HA   )(resid   51 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid   56 and  name HA   )(resid   55 and  name HG1   ) 4.0 1.0 1.5
assign (resid   56 and  name HA   )(resid   57 and  name HB1   ) 3.5 1.5 1.5
assign (resid   56 and  name HA   )(resid   57 and  name HB2   ) 3.5 1.0 1.5
!assign (resid   56 and  name HB1  )(resid   51 and  name HG2*  ) 4.0 1.0 1.9
assign (resid   56 and  name HB1  )(resid   57 and  name HN    ) 3.5 2.2 1.5
assign (resid   56 and  name HB1  )(resid   78 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   56 and  name HB1  )(resid   78 and  name HD2*  ) 4.0 1.5 1.9
!assign (resid   56 and  name HB2  )(resid   51 and  name HG2*  ) 4.0 1.0 1.9
assign (resid   56 and  name HB2  )(resid   57 and  name HN    ) 3.5 2.2 1.5
assign (resid   56 and  name HB2  )(resid   78 and  name HD1*  ) 4.0 1.5 2.0
assign (resid   56 and  name HB2  )(resid   78 and  name HD2*  ) 4.0 1.5 1.9
!E57
!intra
!assign (resid   57 and  name HN   )(resid   57 and  name HA    ) 3.0 1.0 1.0
!assign (resid   57 and  name HN   )(resid   57 and  name HG#   ) 4.0 1.0 1.0
!assign (resid   57 and  name HN   )(resid   57 and  name HB#   ) 3.0 1.0 1.0
!assign (resid   57 and  name HA   )(resid   57 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   57 and  name HA   )(resid   57 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   57 and  name HA   )(resid   57 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   57 and  name HB1  )(resid   57 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   57 and  name HB2  )(resid   57 and  name HG#   ) 3.5 2.2 1.5
!inter
assign (resid   57 and  name HN   )(resid   56 and  name HA    ) 3.0 1.2 1.0
assign (resid   57 and  name HN   )(resid   51 and  name HG2*  ) 3.0 1.0 1.7
assign (resid   57 and  name HA   )(resid   51 and  name HA    ) 4.0 1.0 1.5
assign (resid   57 and  name HA   )(resid   50 and  name HD1*  ) 3.5 1.0 1.5
assign (resid   57 and  name HA   )(resid   58 and  name HA    ) 4.0 1.0 1.5
assign (resid   57 and  name HA   )(resid   58 and  name HD2   ) 3.5 2.2 1.5
assign (resid   57 and  name HA   )(resid   78 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   57 and  name HB1  )(resid   58 and  name HD2   ) 3.5 1.0 1.5
assign (resid   57 and  name HB2  )(resid   58 and  name HD2   ) 3.5 1.0 1.5
!assign (resid   57 and  name HG#  )(resid   47 and  name HN    ) 3.5 2.2 1.5
assign (resid   57 and  name HG#  )(resid   48 and  name HA    ) 3.5 2.2 1.5
assign (resid   57 and  name HG#  )(resid   48 and  name HB*   ) 4.0 1.5 1.5
assign (resid   57 and  name HG#  )(resid   50 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   57 and  name HG#  )(resid   51 and  name HG2*  ) 4.0 1.0 2.0
assign (resid   57 and  name HG#  )(resid   59 and  name HA    ) 4.0 1.0 1.9
!assign (resid   57 and  name HG#  )(resid   59 and  name HD1   ) 4.0 1.0 1.5
!assign (resid   57 and  name HG#  )(resid   59 and  name HD2   ) 4.0 1.0 1.5
!assign (resid   57 and  name HG#  )(resid   78 and  name HD1*  ) 4.0 1.0 1.5
!P58
!intra
!assign (resid   58 and  name HA   )(resid   58 and  name HB#   ) 3.5 2.2 1.5
!assign (resid   58 and  name HA   )(resid   58 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   58 and  name HB1  )(resid   58 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   58 and  name HB1  )(resid   58 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   58 and  name HB1  )(resid   58 and  name HD1   ) 3.5 1.0 1.5
!assign (resid   58 and  name HB1  )(resid   58 and  name HD2   ) 3.5 1.0 1.5
!assign (resid   58 and  name HB2  )(resid   58 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   58 and  name HB2  )(resid   58 and  name HD1   ) 3.5 1.0 1.5
!assign (resid   58 and  name HB2  )(resid   58 and  name HD2   ) 3.5 1.0 1.5
!assign (resid   58 and  name HG1  )(resid   58 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   58 and  name HG1  )(resid   58 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   58 and  name HG2  )(resid   58 and  name HA    ) 3.5 1.0 1.5
!assign (resid   58 and  name HG2  )(resid   58 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   58 and  name HG2  )(resid   58 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   58 and  name HD1  )(resid   58 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   58 and  name HD2  )(resid   58 and  name HA    ) 3.5 1.5 1.5
!inter
!assign (resid   58 and  name HA   )(resid   50 and  name HD1*  ) 4.0 1.0 1.9
assign (resid   58 and  name HA   )(resid   72 and  name HA    ) 3.5 2.2 1.5
assign (resid   58 and  name HA   )(resid   73 and  name HN    ) 4.0 1.0 1.5
assign (resid   58 and  name HA   )(resid   78 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   58 and  name HB1  )(resid   50 and  name HD1*  ) 3.5 1.0 1.5
assign (resid   58 and  name HB1  )(resid   59 and  name HN    ) 3.5 2.2 1.5
assign (resid   58 and  name HB1  )(resid   71 and  name HN    ) 3.5 2.2 1.5
assign (resid   58 and  name HB1  )(resid   78 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   58 and  name HB2  )(resid   50 and  name HD1*  ) 3.5 1.0 2.0
assign (resid   58 and  name HB2  )(resid   59 and  name HN    ) 3.5 1.5 1.5
assign (resid   58 and  name HB2  )(resid   71 and  name HN    ) 3.5 1.0 1.5
assign (resid   58 and  name HB2  )(resid   78 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   58 and  name HG1  )(resid   50 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   58 and  name HG1  )(resid   59 and  name HN    ) 4.0 1.0 1.5
assign (resid   58 and  name HG1  )(resid   78 and  name HD1*  ) 4.0 1.0 1.9
assign (resid   58 and  name HG2  )(resid   50 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   58 and  name HG2  )(resid   59 and  name HN    ) 4.0 1.0 1.9
assign (resid   58 and  name HG2  )(resid   78 and  name HD1*  ) 3.5 1.0 1.9
assign (resid   58 and  name HD1  )(resid   50 and  name HB1   ) 3.5 2.2 1.5
assign (resid   58 and  name HD1  )(resid   50 and  name HB2   ) 3.5 2.2 1.5
assign (resid   58 and  name HD1  )(resid   50 and  name HG    ) 4.0 1.5 1.5
assign (resid   58 and  name HD1  )(resid   51 and  name HG2*  ) 4.0 1.0 2.0
assign (resid   58 and  name HD1  )(resid   57 and  name HA    ) 3.5 2.2 1.5
assign (resid   58 and  name HD1  )(resid   78 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   58 and  name HD2  )(resid   50 and  name HB1   ) 3.5 2.2 1.5
assign (resid   58 and  name HD2  )(resid   50 and  name HB2   ) 3.5 2.2 1.5
assign (resid   58 and  name HD2  )(resid   50 and  name HG    ) 3.5 1.5 1.5
assign (resid   58 and  name HD2  )(resid   50 and  name HD1*  ) 3.5 1.5 1.9
assign (resid   58 and  name HD2  )(resid   51 and  name HG2*  ) 4.0 1.0 2.0
assign (resid   58 and  name HD2  )(resid   78 and  name HD1*  ) 4.0 1.5 1.5
!R59
!intra
!assign (resid   59 and  name HN   )(resid   59 and  name HD#   ) 4.0 1.0 1.0
!assign (resid   59 and  name HN   )(resid   59 and  name HG#   ) 4.0 1.0 1.0
!assign (resid   59 and  name HN   )(resid   59 and  name HB#   ) 3.0 1.0 1.0
!assign (resid   59 and  name HA   )(resid   59 and  name HN    ) 3.5 2.2 1.5
!assign (resid   59 and  name HA   )(resid   59 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   59 and  name HA   )(resid   59 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   59 and  name HA   )(resid   59 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   59 and  name HA   )(resid   59 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   59 and  name HA   )(resid   59 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   59 and  name HB1  )(resid   59 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   59 and  name HB1  )(resid   59 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   59 and  name HB1  )(resid   59 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   59 and  name HB2  )(resid   59 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   59 and  name HB2  )(resid   59 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   59 and  name HB2  )(resid   59 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   59 and  name HG#  )(resid   59 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   59 and  name HG#  )(resid   59 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   59 and  name HD1  )(resid   59 and  name HD2   ) 3.5 2.2 1.5
!inter
assign (resid   59 and  name HN   )(resid   71 and  name HN    ) 4.0 1.0 1.0
assign (resid   59 and  name HN   )(resid   73 and  name HN    ) 4.0 1.0 1.0
assign (resid   59 and  name HN   )(resid   60 and  name HA    ) 4.0 1.0 1.0
assign (resid   59 and  name HN   )(resid   58 and  name HA    ) 3.0 1.2 0.5
assign (resid   59 and  name HN   )(resid   60 and  name HB*   ) 4.0 1.0 1.0
assign (resid   59 and  name HA   )(resid   47 and  name HG2*  ) 4.0 1.0 1.5
assign (resid   59 and  name HA   )(resid   58 and  name HA    ) 4.0 1.0 1.5
assign (resid   59 and  name HA   )(resid   60 and  name HN    ) 3.5 2.2 1.5
assign (resid   59 and  name HB1  )(resid   58 and  name HA    ) 4.0 1.0 1.5
assign (resid   59 and  name HB1  )(resid   73 and  name HN    ) 3.5 1.0 1.5
assign (resid   59 and  name HB1  )(resid   73 and  name HA    ) 4.0 1.0 1.5
assign (resid   59 and  name HB2  )(resid   60 and  name HB*   ) 4.0 1.0 1.5
!A60
!intra
!assign (resid   60 and  name HN   )(resid   60 and  name HA    ) 3.5 1.0 1.0
!assign (resid   60 and  name HN   )(resid   60 and  name HB*   ) 3.0 1.0 1.2
!assign (resid   60 and  name HA   )(resid   60 and  name HB*   ) 3.5 2.2 1.5
!inter
assign (resid   60 and  name HN   )(resid   71 and  name HN    ) 3.5 1.0 1.0
assign (resid   60 and  name HN   )(resid   61 and  name HN    ) 4.0 1.0 1.0
assign (resid   60 and  name HN   )(resid   59 and  name HN    ) 3.0 1.2 0.6
assign (resid   60 and  name HN   )(resid   61 and  name HA    ) 4.0 1.0 1.0
assign (resid   60 and  name HN   )(resid   58 and  name HA    ) 3.5 1.0 1.0
assign (resid   60 and  name HN   )(resid   58 and  name HB#   ) 3.5 1.0 1.5
assign (resid   60 and  name HN   )(resid   59 and  name HB#   ) 4.0 1.0 1.0
assign (resid   60 and  name HN   )(resid   59 and  name HG#   ) 4.0 1.0 1.5
assign (resid   60 and  name HA   )(resid   35 and  name HG2*  ) 3.5 2.2 1.5
assign (resid   60 and  name HA   )(resid   43 and  name HA    ) 4.0 1.0 1.5
assign (resid   60 and  name HA   )(resid   43 and  name HD2*  ) 4.0 1.0 1.5
assign (resid   60 and  name HA   )(resid   61 and  name HA    ) 4.0 1.0 1.9
assign (resid   60 and  name HA   )(resid   61 and  name HB2   ) 4.0 1.0 1.9
assign (resid   60 and  name HB*  )(resid   40 and  name HN    ) 4.0 1.0 1.5
!assign (resid   60 and  name HB*  )(resid   41 and  name HB2   ) 3.5 2.2 1.5
assign (resid   60 and  name HB*  )(resid   42 and  name HN    ) 4.0 1.0 2.0
assign (resid   60 and  name HB*  )(resid   42 and  name HA    ) 4.0 1.0 1.5
!assign (resid   60 and  name HB*  )(resid   59 and  name HG#   ) 3.5 2.2 1.5
assign (resid   60 and  name HB*  )(resid   61 and  name HA    ) 4.0 1.0 1.5
assign (resid   60 and  name HB*  )(resid   71 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   60 and  name HB*  )(resid   73 and  name HA    ) 3.5 1.5 1.5
!W61
!intra
!assign (resid   61 and  name HN   )(resid   61 and  name HA    ) 3.0 1.0 1.0
!assign (resid   61 and  name HN   )(resid   61 and  name HB#   ) 4.0 1.5 1.0
!assign (resid   61 and  name HA   )(resid   61 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   61 and  name HA   )(resid   61 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   61 and  name HB1  )(resid   61 and  name HB2   ) 3.5 2.2 1.5
!inter
assign (resid   61 and  name HN   )(resid   71 and  name HB#   ) 4.0 1.0 1.5
assign (resid   61 and  name HN   )(resid   71 and  name HN    ) 4.0 1.0 1.0
assign (resid   61 and  name HN   )(resid   60 and  name HA    ) 3.0 1.2 0.5
assign (resid   61 and  name HN   )(resid   41 and  name HA    ) 4.0 1.0 1.0
assign (resid   61 and  name HN   )(resid   40 and  name HA#   ) 4.0 1.0 1.0
assign (resid   61 and  name HN   )(resid   42 and  name HA    ) 4.0 1.0 1.0
assign (resid   61 and  name HN   )(resid   43 and  name HB#   ) 4.0 1.0 1.0
assign (resid   61 and  name HN   )(resid   60 and  name HB*   ) 3.0 1.2 1.0
assign (resid   61 and  name HN   )(resid   71 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   61 and  name HA   )(resid   68 and  name HG2*  ) 4.0 1.0 2.0
assign (resid   61 and  name HA   )(resid   70 and  name HA    ) 3.5 2.2 1.5
assign (resid   61 and  name HA   )(resid   70 and  name HB2   ) 3.5 1.0 1.5
assign (resid   61 and  name HA   )(resid   71 and  name HG    ) 3.5 2.2 1.5
assign (resid   61 and  name HA   )(resid   71 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   61 and  name HB1  )(resid   30 and  name HG    ) 4.0 1.0 1.5
!assign (resid   61 and  name HB1  )(resid   30 and  name HD2*  ) 4.0 1.0 1.9
assign (resid   61 and  name HB1  )(resid   43 and  name HB1   ) 4.0 1.0 1.5
assign (resid   61 and  name HB1  )(resid   68 and  name HG2*  ) 3.5 2.2 1.5
assign (resid   61 and  name HB1  )(resid   70 and  name HD2*  ) 3.5 2.2 1.5
assign (resid   61 and  name HB1  )(resid   71 and  name HG    ) 4.0 1.0 1.5
assign (resid   61 and  name HB2  )(resid   30 and  name HG    ) 4.0 1.0 1.5
!assign (resid   61 and  name HB2  )(resid   30 and  name HD2*  ) 4.0 1.0 1.9
!assign (resid   61 and  name HB2  )(resid   43 and  name HB2   ) 4.0 1.0 1.5
assign (resid   61 and  name HB2  )(resid   68 and  name HG2*  ) 4.0 1.0 1.5
assign (resid   61 and  name HB2  )(resid   70 and  name HA    ) 4.0 1.0 1.5
!assign (resid   61 and  name HB2  )(resid   70 and  name HB2   ) 4.0 1.0 1.5
assign (resid   61 and  name HB2  )(resid   70 and  name HD2*  ) 3.5 2.2 1.5
assign (resid   61 and  name HB2  )(resid   71 and  name HG    ) 4.0 1.0 1.5
assign (resid   61 and  name HD1  )(resid   30 and  name HA    ) 3.5 1.5 1.5
!assign (resid   61 and  name HD1  )(resid   30 and  name HB2   ) 3.5 1.5 1.5
assign (resid   61 and  name HD1  )(resid   30 and  name HG    ) 3.5 1.5 1.5
!assign (resid   61 and  name HD1  )(resid   31 and  name HN    ) 3.5 1.5 1.5
!assign (resid   61 and  name HD1  )(resid   41 and  name HB1   ) 3.5 1.5 1.5
!assign (resid   61 and  name HD1  )(resid   43 and  name HN    ) 3.5 1.5 1.5
assign (resid   61 and  name HD1  )(resid   43 and  name HA    ) 3.5 1.5 1.5
assign (resid   61 and  name HD1  )(resid   43 and  name HB1   ) 3.5 1.5 1.5
assign (resid   61 and  name HD1  )(resid   43 and  name HB2   ) 3.5 1.5 1.5
assign (resid   61 and  name HD1  )(resid   43 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   61 and  name HD1  )(resid   60 and  name HA    ) 3.5 1.5 2.5
assign (resid   61 and  name HD1  )(resid   60 and  name HB*   ) 3.5 1.5 2.5
assign (resid   61 and  name HD1  )(resid   62 and  name HN    ) 4.0 1.0 1.5
!assign (resid   61 and  name HZ2  )(resid    8 and  name HA    ) 3.5 1.5 1.5
!assign (resid   61 and  name HZ2  )(resid    8 and  name HB*   ) 3.5 1.5 1.5
!assign (resid   61 and  name HZ2  )(resid   11 and  name HN    ) 3.5 1.5 1.5
assign (resid   61 and  name HZ2  )(resid   11 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   61 and  name HZ2  )(resid   12 and  name HA    ) 3.5 1.5 1.5
assign (resid   61 and  name HZ2  )(resid   30 and  name HB1   ) 3.5 1.5 1.5
assign (resid   61 and  name HZ2  )(resid   30 and  name HG    ) 3.5 1.5 1.5
assign (resid   61 and  name HZ2  )(resid   30 and  name HD2*  ) 3.5 1.5 2.5
!assign (resid   61 and  name HZ2  )(resid   31 and  name HN    ) 3.5 1.5 1.5
!assign (resid   61 and  name HZ2  )(resid   32 and  name HB1   ) 3.5 1.5 1.5
!assign (resid   61 and  name HZ2  )(resid   41 and  name HB2   ) 3.5 1.5 1.5
!assign (resid   61 and  name HH2  )(resid    8 and  name HA    ) 3.5 1.5 1.5
assign (resid   61 and  name HH2  )(resid    8 and  name HB*   ) 4.0 1.0 1.5
assign (resid   61 and  name HH2  )(resid   11 and  name HB1   ) 3.5 2.0 1.5
assign (resid   61 and  name HH2  )(resid   11 and  name HB2   ) 3.5 1.5 1.5
!assign (resid   61 and  name HH2  )(resid   11 and  name HG    ) 3.5 1.5 1.5
assign (resid   61 and  name HH2  )(resid   11 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   61 and  name HH2  )(resid   12 and  name HN    ) 3.5 1.5 1.5
assign (resid   61 and  name HH2  )(resid   30 and  name HD2*  ) 3.5 1.5 2.5
assign (resid   61 and  name HH2  )(resid   63 and  name HB#   ) 3.5 1.5 2.5
!assign (resid   61 and  name HZ3  )(resid    8 and  name HA    ) 3.5 1.5 1.5
!assign (resid   61 and  name HZ3  )(resid   11 and  name HB1   ) 3.5 1.5 1.5
assign (resid   61 and  name HZ3  )(resid   11 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   61 and  name HZ3  )(resid   30 and  name HD2*  ) 3.5 1.5 1.5
assign (resid   61 and  name HZ3  )(resid   68 and  name HD1*  ) 3.5 1.5 2.5
assign (resid   61 and  name HE3  )(resid   30 and  name HD2*  ) 3.5 1.5 2.5
assign (resid   61 and  name HE3  )(resid   62 and  name HN    ) 3.5 1.5 1.5
assign (resid   61 and  name HE3  )(resid   62 and  name HA    ) 3.5 1.5 1.5
!assign (resid   61 and  name HE3  )(resid   68 and  name HG11  ) 3.5 1.5 1.5
!R62
!intra
!assign (resid   62 and  name HN   )(resid   62 and  name HA    ) 3.0 1.0 1.0
!assign (resid   62 and  name HA   )(resid   62 and  name HB#   ) 3.5 2.2 1.5
!assign (resid   62 and  name HB1  )(resid   62 and  name HN    ) 3.5 1.0 1.5
!assign (resid   62 and  name HB1  )(resid   62 and  name HD#   ) 3.5 1.5 1.5
!assign (resid   62 and  name HB1  )(resid   62 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   62 and  name HB2  )(resid   62 and  name HN    ) 3.5 1.0 1.5
!assign (resid   62 and  name HB2  )(resid   62 and  name HD#   ) 3.5 1.5 1.5
!assign (resid   62 and  name HB2  )(resid   62 and  name HG#   ) 3.5 2.2 1.5
!inter
assign (resid   62 and  name HN   )(resid   61 and  name HN    ) 4.0 1.0 1.0
assign (resid   62 and  name HN   )(resid   71 and  name HN    ) 4.0 1.0 1.0
assign (resid   62 and  name HN   )(resid   61 and  name HA    ) 3.0 1.2 0.5
assign (resid   62 and  name HN   )(resid   63 and  name HA    ) 4.0 1.0 1.0
assign (resid   62 and  name HN   )(resid   61 and  name HB#   ) 3.0 1.2 0.5
assign (resid   62 and  name HN   )(resid   69 and  name HB*   ) 4.0 1.5 1.0
!assign (resid   62 and  name HN   )(resid   41 and  name HB#   ) 4.0 1.0 1.0
assign (resid   62 and  name HN   )(resid   71 and  name HD1*  ) 4.0 1.0 1.0
!assign (resid   62 and  name HN   )(resid   68 and  name HG2*  ) 4.0 1.2 1.0 - reduntant
!assign (resid   62 and  name HA   )(resid    8 and  name HB*   ) 4.0 1.0 1.9
assign (resid   62 and  name HA   )(resid   40 and  name HA2   ) 4.0 1.0 1.5
!assign (resid   62 and  name HA   )(resid   41 and  name HB1   ) 4.0 1.0 1.5
assign (resid   62 and  name HA   )(resid   63 and  name HG1   ) 4.0 1.0 1.5
assign (resid   62 and  name HA   )(resid   63 and  name HG2   ) 4.0 1.0 1.5
assign (resid   62 and  name HA   )(resid   63 and  name HD#   ) 3.5 2.2 1.5
assign (resid   62 and  name HA   )(resid   71 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   62 and  name HB1  )(resid   40 and  name HA1   ) 3.5 1.0 1.5
assign (resid   62 and  name HB1  )(resid   40 and  name HA2   ) 3.5 1.0 1.5
!assign (resid   62 and  name HB1  )(resid   41 and  name HB1   ) 3.5 1.5 1.5
assign (resid   62 and  name HB1  )(resid   41 and  name HD1   ) 4.0 1.0 1.9
assign (resid   62 and  name HB1  )(resid   63 and  name HD#   ) 3.5 1.0 1.5
assign (resid   62 and  name HB1  )(resid   71 and  name HD1*  ) 3.5 1.0 1.5
assign (resid   62 and  name HB2  )(resid   40 and  name HA1   ) 3.5 1.5 1.5
assign (resid   62 and  name HB2  )(resid   40 and  name HA2   ) 3.5 1.5 1.5
!assign (resid   62 and  name HB2  )(resid   41 and  name HB1   ) 3.5 1.5 1.5
assign (resid   62 and  name HB2  )(resid   41 and  name HD1   ) 4.0 1.0 1.9
assign (resid   62 and  name HB2  )(resid   63 and  name HD#   ) 3.5 1.0 1.5
assign (resid   62 and  name HB2  )(resid   69 and  name HB*   ) 3.5 2.2 1.5
assign (resid   62 and  name HB2  )(resid   71 and  name HD1*  ) 3.5 2.2 1.5
!P63
!intra
!assign (resid   63 and  name HA   )(resid   63 and  name HB#   ) 3.5 2.2 1.5
!assign (resid   63 and  name HA   )(resid   63 and  name HG2   ) 3.5 1.0 1.5
!assign (resid   63 and  name HB#  )(resid   63 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   63 and  name HB#  )(resid   63 and  name HD#   ) 3.5 2.2 1.5
!inter
assign (resid   63 and  name HA   )(resid   11 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   63 and  name HA   )(resid   64 and  name HG2*  ) 4.0 1.0 1.5
assign (resid   63 and  name HA   )(resid   68 and  name HA    ) 3.5 2.2 1.5
assign (resid   63 and  name HA   )(resid   68 and  name HG12  ) 3.5 2.2 1.5
assign (resid   63 and  name HA   )(resid   68 and  name HD1*  ) 4.0 1.0 1.9
!assign (resid   63 and  name HB#  )(resid    9 and  name HA    ) 3.5 2.2 1.5
!T64
!intra
!assign (resid   64 and  name HN   )(resid   64 and  name HA    ) 3.0 1.0 1.0
!assign (resid   64 and  name HN   )(resid   64 and  name HG2*  ) 4.0 1.0 1.0
!assign (resid   64 and  name HA   )(resid   64 and  name HB    ) 3.5 2.2 1.5
!assign (resid   64 and  name HA   )(resid   64 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid   64 and  name HB   )(resid   64 and  name HN    ) 4.0 1.0 1.5
!assign (resid   64 and  name HB   )(resid   64 and  name HG2*  ) 3.5 2.2 1.5
!inter
assign (resid   64 and  name HN   )(resid   69 and  name HN    ) 4.0 1.0 1.0
assign (resid   64 and  name HN   )(resid   67 and  name HN    ) 3.0 1.0 1.0
assign (resid   64 and  name HN   )(resid   63 and  name HA    ) 3.0 1.2 0.5
assign (resid   64 and  name HN   )(resid   68 and  name HA    ) 3.0 1.0 1.0
assign (resid   64 and  name HN   )(resid   65 and  name HD#   ) 4.0 1.0 1.0
assign (resid   64 and  name HN   )(resid   63 and  name HB#   ) 4.0 1.0 1.0
assign (resid   64 and  name HN   )(resid   11 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   64 and  name HN   )(resid   68 and  name HG1#  ) 4.0 1.0 1.0
assign (resid   64 and  name HN   )(resid   68 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   64 and  name HA   )(resid   65 and  name HG1   ) 4.0 1.0 1.5
assign (resid   64 and  name HA   )(resid   65 and  name HG2   ) 3.5 1.0 1.5
assign (resid   64 and  name HA   )(resid   65 and  name HD1   ) 3.5 2.2 1.5
assign (resid   64 and  name HA   )(resid   65 and  name HD2   ) 3.5 2.2 1.5
assign (resid   64 and  name HB   )(resid   65 and  name HD1   ) 3.5 2.2 1.5
assign (resid   64 and  name HB   )(resid   65 and  name HD2   ) 3.5 2.2 1.5
assign (resid   64 and  name HB   )(resid   80 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   64 and  name HG2* )(resid   68 and  name HA    ) 4.0 1.0 1.5
assign (resid   64 and  name HG2* )(resid   69 and  name HB*   ) 3.5 2.2 1.5
!assign (resid   64 and  name HG2* )(resid   80 and  name HD1*  ) 3.5 1.5 1.5 - reduntant
!P65
!intra
!assign (resid   65 and  name HA   )(resid   65 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   65 and  name HA   )(resid   65 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   65 and  name HA   )(resid   65 and  name HG2   ) 3.5 1.0 1.5
!assign (resid   65 and  name HA   )(resid   65 and  name HD1   ) 4.0 1.0 1.5
!assign (resid   65 and  name HA   )(resid   65 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   65 and  name HB1  )(resid   65 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   65 and  name HB1  )(resid   65 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   65 and  name HB1  )(resid   65 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   65 and  name HB1  )(resid   65 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   65 and  name HB1  )(resid   65 and  name HD2   ) 3.5 1.5 1.5
!assign (resid   65 and  name HB2  )(resid   65 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   65 and  name HB2  )(resid   65 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   65 and  name HB2  )(resid   65 and  name HD1   ) 3.5 1.5 1.5
!assign (resid   65 and  name HB2  )(resid   65 and  name HD2   ) 3.5 1.0 1.5
!assign (resid   65 and  name HG1  )(resid   65 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   65 and  name HG1  )(resid   65 and  name HD1   ) 3.5 1.5 1.5
!assign (resid   65 and  name HG1  )(resid   65 and  name HD2   ) 3.5 1.0 1.5
!assign (resid   65 and  name HG2  )(resid   65 and  name HD1   ) 3.5 1.5 1.5
!assign (resid   65 and  name HG2  )(resid   65 and  name HD2   ) 3.5 1.0 1.5
!assign (resid   65 and  name HD1  )(resid   65 and  name HD2   ) 3.5 2.2 1.5
!inter
assign (resid   65 and  name HA   )(resid   66 and  name HB*   ) 4.0 1.0 1.9
assign (resid   65 and  name HB1  )(resid   66 and  name HB*   ) 4.0 1.0 1.5
assign (resid   65 and  name HB2  )(resid   66 and  name HB*   ) 4.0 1.0 2.0
assign (resid   65 and  name HD1  )(resid   64 and  name HG2*  ) 3.5 2.2 1.5
assign (resid   65 and  name HD2  )(resid   64 and  name HG2*  ) 3.5 2.2 1.5
!A66
!intra
!assign (resid   66 and  name HA   )(resid   66 and  name HB*   ) 3.5 2.2 1.5
!assign (resid   66 and  name HB*  )(resid   66 and  name HA    ) 3.5 2.2 1.5
!inter
assign (resid   66 and  name HA   )(resid   67 and  name HN    ) 3.5 2.2 1.5
assign (resid   66 and  name HA   )(resid   83 and  name HN    ) 4.0 1.0 1.5
assign (resid   66 and  name HA   )(resid   83 and  name HB2   ) 4.0 1.0 1.5
!assign (resid   66 and  name HA   )(resid   83 and  name HD2   ) 4.0 1.0 1.5
!assign (resid   66 and  name HA   )(resid   67 and  name HN    ) 4.0 1.0 1.5 - reduntant
assign (resid   66 and  name HB*  )(resid   83 and  name HN    ) 4.0 1.0 2.0
!G67
!intra
!assign (resid   67 and  name HA1  )(resid   67 and  name HN    ) 3.5 2.2 1.5
!assign (resid   67 and  name HA1  )(resid   67 and  name HA2   ) 3.5 2.2 1.5
!assign (resid   67 and  name HA2  )(resid   67 and  name HN    ) 3.5 2.2 1.5
!inter
assign (resid   67 and  name HN   )(resid   64 and  name HA    ) 4.0 1.0 1.0
assign (resid   67 and  name HN   )(resid   64 and  name HB    ) 4.0 1.0 1.0
assign (resid   67 and  name HN   )(resid   65 and  name HD#   ) 4.0 1.0 1.5
assign (resid   67 and  name HN   )(resid   83 and  name HB#   ) 4.0 1.0 1.0
assign (resid   67 and  name HN   )(resid   64 and  name HG2*  ) 4.0 1.0 1.5
assign (resid   67 and  name HA1  )(resid   68 and  name HB    ) 4.0 1.0 1.5
assign (resid   67 and  name HA1  )(resid   80 and  name HD1*  ) 4.0 1.0 1.9
assign (resid   67 and  name HA1  )(resid   83 and  name HB1   ) 3.5 1.0 1.5
assign (resid   67 and  name HA1  )(resid   83 and  name HB2   ) 4.0 1.0 1.5
assign (resid   67 and  name HA2  )(resid   80 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   67 and  name HA2  )(resid   83 and  name HB2   ) 4.0 1.0 1.8
!I68
!intra
!assign (resid   68 and  name HN   )(resid   68 and  name HA    ) 3.0 1.0 1.0
!assign (resid   68 and  name HN   )(resid   68 and  name HB    ) 3.0 1.2 0.5
!assign (resid   68 and  name HN   )(resid   68 and  name HG2*  ) 4.0 1.0 1.0
!assign (resid   68 and  name HN   )(resid   68 and  name HD1*  ) 4.0 1.0 1.0
!assign (resid   68 and  name HA   )(resid   68 and  name HB    ) 3.5 2.2 1.5
!assign (resid   68 and  name HA   )(resid   68 and  name HG12  ) 3.5 2.2 1.5
!assign (resid   68 and  name HA   )(resid   68 and  name HD1*  ) 3.5 1.0 1.5
!assign (resid   68 and  name HB   )(resid   68 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid   68 and  name HB   )(resid   68 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   68 and  name HG11 )(resid   68 and  name HN    ) 3.5 1.0 1.5
!assign (resid   68 and  name HG11 )(resid   68 and  name HA    ) 3.5 2.2 1.5
!assign (resid   68 and  name HG11 )(resid   68 and  name HG12  ) 3.5 2.2 1.5
!assign (resid   68 and  name HG11 )(resid   68 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   68 and  name HG12 )(resid   68 and  name HN    ) 3.5 1.5 1.5
!assign (resid   68 and  name HG12 )(resid   68 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   68 and  name HG2* )(resid   68 and  name HA    ) 3.5 2.2 1.5
!assign (resid   68 and  name HG2* )(resid   68 and  name HD1*  ) 3.5 2.2 1.5
!inter
assign (resid   68 and  name HN   )(resid   81 and  name HN    ) 3.0 1.0 1.0
assign (resid   68 and  name HN   )(resid   67 and  name HN    ) 4.0 1.0 1.0
assign (resid   68 and  name HN   )(resid   80 and  name HA    ) 4.0 1.0 1.0
assign (resid   68 and  name HN   )(resid   67 and  name HA#   ) 3.0 1.2 1.0
assign (resid   68 and  name HN   )(resid   89 and  name HB#   ) 4.0 1.0 1.0
assign (resid   68 and  name HA   )(resid   63 and  name HB2   ) 4.0 1.0 1.9
assign (resid   68 and  name HA   )(resid   69 and  name HA    ) 4.0 1.0 1.9
assign (resid   68 and  name HA   )(resid   69 and  name HB*   ) 3.5 1.5 1.5
assign (resid   68 and  name HG11 )(resid   30 and  name HD2*  ) 4.0 1.0 1.5
assign (resid   68 and  name HG11 )(resid   69 and  name HN    ) 4.0 1.0 1.5
assign (resid   68 and  name HG11 )(resid  101 and  name HD2*  ) 4.0 1.0 1.9
assign (resid   68 and  name HG12 )(resid  101 and  name HD2*  ) 4.0 1.0 1.9
!assign (resid   68 and  name HG2* )(resid   11 and  name HD1*  ) 3.5 1.0 1.5
!assign (resid   68 and  name HG2* )(resid   30 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   68 and  name HG2* )(resid   62 and  name HN    ) 4.0 1.5 1.5
assign (resid   68 and  name HG2* )(resid   81 and  name HN    ) 3.5 1.0 1.5
assign (resid   68 and  name HG2* )(resid   81 and  name HB1   ) 3.5 1.5 1.5
assign (resid   68 and  name HG2* )(resid   81 and  name HD1*  ) 4.0 1.0 2.0
!assign (resid   68 and  name HG2* )(resid  101 and  name HB2   ) 4.0 1.0 1.9
assign (resid   68 and  name HG2* )(resid  101 and  name HD2*  ) 4.0 1.0 1.5
!assign (resid   68 and  name HD1* )(resid   30 and  name HD1*  ) 4.0 1.0 1.9
!assign (resid   68 and  name HD1* )(resid   81 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   68 and  name HD1* )(resid   89 and  name HB1   ) 4.0 1.0 1.5
assign (resid   68 and  name HD1* )(resid  101 and  name HB2   ) 4.0 1.0 1.5
assign (resid   68 and  name HD1* )(resid  101 and  name HD2*  ) 3.5 2.2 1.5
!A69
!intra
!assign (resid   69 and  name HN   )(resid   69 and  name HA    ) 3.0 1.0 1.0
!assign (resid   69 and  name HN   )(resid   69 and  name HB*   ) 3.0 1.2 1.0
!assign (resid   69 and  name HA   )(resid   69 and  name HB*   ) 3.5 2.2 1.5
!inter
assign (resid   69 and  name HN   )(resid   68 and  name HN    ) 4.0 1.0 1.0
assign (resid   69 and  name HN   )(resid   61 and  name HA    ) 4.0 1.0 1.0
assign (resid   69 and  name HN   )(resid   63 and  name HA    ) 3.5 1.0 1.0
assign (resid   69 and  name HN   )(resid   80 and  name HA    ) 4.0 1.0 1.0
assign (resid   69 and  name HN   )(resid   68 and  name HA    ) 3.0 1.2 0.5
!assign (resid   69 and  name HN   )(resid   61 and  name HB#   ) 4.0 1.0 1.0
assign (resid   69 and  name HN   )(resid   64 and  name HG2*  ) 4.0 1.3 1.0
assign (resid   69 and  name HN   )(resid   68 and  name HG2*  ) 3.0 1.0 1.7
assign (resid   69 and  name HN   )(resid   68 and  name HD1*  ) 4.0 1.0 2.0
!assign (resid   69 and  name HA   )(resid   64 and  name HG2*  ) 3.5 2.2 1.5
assign (resid   69 and  name HA   )(resid   68 and  name HG2*  ) 3.5 1.5 1.5
assign (resid   69 and  name HA   )(resid   70 and  name HA    ) 3.5 1.5 1.5
!assign (resid   69 and  name HA   )(resid   70 and  name HB1   ) 3.5 1.5 1.5
assign (resid   69 and  name HA   )(resid   70 and  name HG    ) 3.5 1.5 1.5
assign (resid   69 and  name HA   )(resid   71 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   69 and  name HA   )(resid   77 and  name HG2*  ) 3.5 1.5 1.5
assign (resid   69 and  name HA   )(resid   80 and  name HA    ) 3.5 2.2 1.5
assign (resid   69 and  name HB*  )(resid   61 and  name HA    ) 4.0 1.0 1.5
assign (resid   69 and  name HB*  )(resid   68 and  name HG2*  ) 4.0 1.0 2.0
assign (resid   69 and  name HB*  )(resid   70 and  name HA    ) 4.0 1.0 1.5
assign (resid   69 and  name HB*  )(resid   71 and  name HD2*  ) 3.5 2.2 1.5
assign (resid   69 and  name HB*  )(resid   77 and  name HB    ) 4.0 1.0 1.5
assign (resid   69 and  name HB*  )(resid   77 and  name HG2*  ) 3.5 2.2 1.5
assign (resid   69 and  name HB*  )(resid   79 and  name HN    ) 4.0 1.0 1.5
assign (resid   69 and  name HB*  )(resid   80 and  name HA    ) 4.0 1.0 1.5
assign (resid   69 and  name HB*  )(resid   70 and  name HD1*  ) 3.5 2.2 1.5
!L70
!intra
!assign (resid   70 and  name HN   )(resid   70 and  name HA    ) 3.0 1.0 1.0
!assign (resid   70 and  name HN   )(resid   70 and  name HB#   ) 2.5 0.7 0.5
!assign (resid   70 and  name HN   )(resid   70 and  name HG    ) 4.0 1.0 1.0
!assign (resid   70 and  name HN   )(resid   70 and  name HD2*  ) 4.0 1.0 1.0
!assign (resid   70 and  name HA   )(resid   70 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   70 and  name HA   )(resid   70 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   70 and  name HA   )(resid   70 and  name HG    ) 3.5 2.2 1.5
!assign (resid   70 and  name HB1  )(resid   70 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   70 and  name HB1  )(resid   70 and  name HG    ) 3.5 2.2 1.5
!assign (resid   70 and  name HB1  )(resid   70 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   70 and  name HB2  )(resid   70 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   70 and  name HG   )(resid   70 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   70 and  name HG   )(resid   70 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   70 and  name HD1* )(resid   70 and  name HN    ) 3.5 1.5 1.5
!assign (resid   70 and  name HD1* )(resid   70 and  name HA    ) 4.0 1.0 1.5
!assign (resid   70 and  name HD2* )(resid   70 and  name HA    ) 3.5 2.2 1.5
!assign (resid   70 and  name HD2* )(resid   70 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   70 and  name HD2* )(resid   70 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   70 and  name HD2* )(resid   70 and  name HG    ) 3.5 2.2 1.5
!assign (resid   70 and  name HD2* )(resid   70 and  name HD1*  ) 3.5 2.2 1.5
!inter
assign (resid   70 and  name HN   )(resid   81 and  name HN    ) 4.0 1.0 1.0
assign (resid   70 and  name HN   )(resid   78 and  name HN    ) 4.0 1.0 1.0
assign (resid   70 and  name HN   )(resid   79 and  name HN    ) 3.0 1.0 1.0
assign (resid   70 and  name HN   )(resid   69 and  name HA    ) 3.0 1.2 0.5
assign (resid   70 and  name HN   )(resid   80 and  name HA    ) 3.5 1.0 1.0
assign (resid   70 and  name HN   )(resid   69 and  name HB*   ) 3.0 1.2 1.6
assign (resid   70 and  name HN   )(resid   77 and  name HG2*  ) 4.0 1.5 1.0
assign (resid   70 and  name HN   )(resid   68 and  name HG2*  ) 4.0 1.0 1.5
assign (resid   70 and  name HA   )(resid   43 and  name HD2*  ) 4.0 1.0 1.5
assign (resid   70 and  name HA   )(resid   61 and  name HB1   ) 3.5 1.5 1.5
assign (resid   70 and  name HA   )(resid   68 and  name HG2*  ) 4.0 1.0 1.5
assign (resid   70 and  name HB1  )(resid   58 and  name HB#   ) 3.5 2.2 1.5
assign (resid   70 and  name HB1  )(resid   71 and  name HN    ) 3.5 2.2 1.5
assign (resid   70 and  name HB1  )(resid   78 and  name HB1   ) 3.5 1.0 1.5
assign (resid   70 and  name HB1  )(resid   79 and  name HB2   ) 4.0 1.0 1.5
assign (resid   70 and  name HB2  )(resid   58 and  name HB#   ) 3.5 2.2 1.5
assign (resid   70 and  name HB2  )(resid   71 and  name HN    ) 3.5 2.2 1.5
assign (resid   70 and  name HB2  )(resid   78 and  name HB1   ) 3.5 1.0 1.5
assign (resid   70 and  name HB2  )(resid   79 and  name HB2   ) 4.0 1.0 1.5
assign (resid   70 and  name HG   )(resid   68 and  name HG2*  ) 4.0 1.0 1.5
assign (resid   70 and  name HD1* )(resid   50 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   70 and  name HD1* )(resid   58 and  name HB#   ) 4.0 1.5 1.5
assign (resid   70 and  name HD1* )(resid   79 and  name HN    ) 4.0 1.0 1.5
assign (resid   70 and  name HD1* )(resid   79 and  name HB2   ) 3.5 2.2 1.5
assign (resid   70 and  name HD1* )(resid  101 and  name HD1*  ) 4.0 1.0 2.0
!assign (resid   70 and  name HD2* )(resid   30 and  name HD1*  ) 3.5 1.0 1.5
!assign (resid   70 and  name HD2* )(resid   30 and  name HD2*  ) 3.5 1.0 1.5
assign (resid   70 and  name HD2* )(resid   50 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   70 and  name HD2* )(resid   58 and  name HB1   ) 3.5 2.2 1.5
assign (resid   70 and  name HD2* )(resid   61 and  name HA    ) 3.5 2.2 1.5
assign (resid   70 and  name HD2* )(resid   62 and  name HN    ) 4.0 1.0 2.0
assign (resid   70 and  name HD2* )(resid   68 and  name HG2*  ) 4.0 1.0 1.5
!assign (resid   70 and  name HD2* )(resid   68 and  name HD1*  ) 4.0 1.0 1.9
!assign (resid   70 and  name HD2* )(resid   69 and  name HA    ) 4.0 1.0 1.5
!assign (resid   70 and  name HD2* )(resid  101 and  name HD2*  ) 3.5 2.2 1.5
!L71
!intra
!assign (resid   71 and  name HN   )(resid   71 and  name HA    ) 3.0 1.0 1.0
!assign (resid   71 and  name HN   )(resid   71 and  name HG    ) 3.0 1.2 0.4
!assign (resid   71 and  name HN   )(resid   71 and  name HD2*  ) 4.0 1.0 1.0
!assign (resid   71 and  name HA   )(resid   71 and  name HB#   ) 3.5 2.2 1.5
!assign (resid   71 and  name HA   )(resid   71 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   71 and  name HB1  )(resid   71 and  name HN    ) 3.5 2.2 1.5
!assign (resid   71 and  name HB1  )(resid   71 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   71 and  name HB1  )(resid   71 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   71 and  name HB1  )(resid   71 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   71 and  name HB2  )(resid   71 and  name HN    ) 3.5 2.2 1.5
!assign (resid   71 and  name HB2  )(resid   71 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   71 and  name HB2  )(resid   71 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   71 and  name HG   )(resid   71 and  name HA    ) 3.5 1.5 1.5
!assign (resid   71 and  name HG   )(resid   71 and  name HB#   ) 3.5 2.2 1.5
!assign (resid   71 and  name HG   )(resid   71 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   71 and  name HG   )(resid   71 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   71 and  name HD1* )(resid   71 and  name HN    ) 4.0 1.0 1.5
!assign (resid   71 and  name HD1* )(resid   71 and  name HA    ) 4.0 1.0 1.5
!assign (resid   71 and  name HD1* )(resid   71 and  name HD2*  ) 3.5 2.2 1.5
!inter
assign (resid   71 and  name HN   )(resid   78 and  name HN    ) 4.0 1.0 1.0
assign (resid   71 and  name HN   )(resid   72 and  name HN    ) 4.0 1.0 1.0
assign (resid   71 and  name HN   )(resid   61 and  name HA    ) 3.0 1.2 0.5
assign (resid   71 and  name HN   )(resid   70 and  name HA    ) 3.0 1.2 0.2
assign (resid   71 and  name HN   )(resid   58 and  name HA    ) 4.0 1.0 1.0
assign (resid   71 and  name HN   )(resid   61 and  name HB#   ) 4.0 1.0 1.0
assign (resid   71 and  name HN   )(resid   60 and  name HB*   ) 4.0 1.0 1.0
assign (resid   71 and  name HA   )(resid   77 and  name HG2*  ) 3.5 1.5 1.5
assign (resid   71 and  name HA   )(resid   78 and  name HN    ) 3.5 2.2 1.5
assign (resid   71 and  name HB1  )(resid   60 and  name HN    ) 3.5 1.0 1.5
assign (resid   71 and  name HB1  )(resid   60 and  name HB*   ) 3.5 2.2 1.5
!assign (resid   71 and  name HB1  )(resid   61 and  name HA    ) 4.0 1.0 1.5
assign (resid   71 and  name HB2  )(resid   60 and  name HN    ) 3.5 1.0 1.5
assign (resid   71 and  name HB2  )(resid   60 and  name HB*   ) 3.5 2.2 1.5
assign (resid   71 and  name HB2  )(resid   61 and  name HA    ) 4.0 1.0 1.5
assign (resid   71 and  name HB2  )(resid   77 and  name HA    ) 4.0 1.0 1.9
assign (resid   71 and  name HG   )(resid   62 and  name HN    ) 4.0 1.0 1.5
assign (resid   71 and  name HG   )(resid   72 and  name HN    ) 4.0 1.0 1.5
assign (resid   71 and  name HD1* )(resid   40 and  name HN    ) 4.0 1.0 1.5
!assign (resid   71 and  name HD1* )(resid   60 and  name HN    ) 4.0 1.0 1.5
assign (resid   71 and  name HD1* )(resid   72 and  name HN    ) 4.0 1.0 2.0
assign (resid   71 and  name HD2* )(resid   61 and  name HA    ) 3.5 1.0 1.5
assign (resid   71 and  name HD2* )(resid   62 and  name HN    ) 4.0 1.0 1.5
!assign (resid   71 and  name HD2* )(resid   62 and  name HA    ) 4.0 1.0 1.9
assign (resid   71 and  name HD2* )(resid   62 and  name HB#   ) 3.5 1.0 1.5
assign (resid   71 and  name HD2* )(resid   75 and  name HA1   ) 4.0 1.0 1.5
assign (resid   71 and  name HD2* )(resid   76 and  name HN    ) 4.0 1.0 1.5
assign (resid   71 and  name HD2* )(resid   78 and  name HN    ) 3.5 2.2 1.5
!assign (resid   71 and  name HD2* )(resid   80 and  name HD1*  ) 4.0 1.0 1.9
!E72
!intra
!assign (resid   72 and  name HN   )(resid   72 and  name HA    ) 3.0 1.0 1.0
!assign (resid   72 and  name HN   )(resid   72 and  name HG#   ) 3.5 1.0 1.0
!assign (resid   72 and  name HN   )(resid   72 and  name HB#   ) 3.0 1.0 1.2
!assign (resid   72 and  name HA   )(resid   72 and  name HB#   ) 3.5 2.2 1.5
!assign (resid   72 and  name HA   )(resid   72 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   72 and  name HB#  )(resid   72 and  name HG#   ) 3.5 2.2 1.5
!inter
assign (resid   72 and  name HN   )(resid   78 and  name HN    ) 4.0 1.0 1.0
assign (resid   72 and  name HN   )(resid   76 and  name HN    ) 3.5 1.0 1.0
assign (resid   72 and  name HN   )(resid   75 and  name HN    ) 3.5 1.0 1.0
assign (resid   72 and  name HN   )(resid   71 and  name HA    ) 2.5 0.7 0.5
assign (resid   72 and  name HN   )(resid   58 and  name HA    ) 4.0 1.0 1.0
assign (resid   72 and  name HN   )(resid   75 and  name HA#   ) 4.0 1.0 2.0
assign (resid   72 and  name HN   )(resid   78 and  name HG    ) 3.0 1.0 1.0
assign (resid   72 and  name HN   )(resid   71 and  name HB#   ) 3.0 1.0 1.0
!assign (resid   72 and  name HN   )(resid   60 and  name HB*   ) 4.0 1.0 1.0
assign (resid   72 and  name HN   )(resid   78 and  name HD1*  ) 4.0 1.0 1.0
assign (resid   72 and  name HN   )(resid   71 and  name HD2*  ) 4.0 1.0 1.0
assign (resid   72 and  name HA   )(resid   59 and  name HN    ) 3.5 2.2 1.5
assign (resid   72 and  name HA   )(resid   71 and  name HA    ) 4.0 1.0 1.5
assign (resid   72 and  name HA   )(resid   73 and  name HA    ) 3.5 1.5 1.5
!assign (resid   72 and  name HA   )(resid   76 and  name HN    ) 3.5 1.5 1.5
!assign (resid   72 and  name HA   )(resid   78 and  name HB#   ) 3.5 2.2 1.5
assign (resid   72 and  name HA   )(resid   78 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   72 and  name HA   )(resid   78 and  name HD2*  ) 4.0 1.0 1.5
assign (resid   72 and  name HA   )(resid   78 and  name HG    ) 3.5 2.2 1.5
assign (resid   72 and  name HB#  )(resid   71 and  name HA    ) 4.0 1.0 1.5
!assign (resid   72 and  name HB#  )(resid   78 and  name HB#   ) 3.5 2.2 1.5
assign (resid   72 and  name HB#  )(resid   78 and  name HG    ) 3.5 2.2 1.5
assign (resid   72 and  name HG#  )(resid   71 and  name HA    ) 4.0 1.0 1.5
assign (resid   72 and  name HG#  )(resid   73 and  name HN    ) 3.5 1.5 1.5
assign (resid   72 and  name HG#  )(resid   73 and  name HA    ) 4.0 1.0 1.9
!assign (resid   72 and  name HG#  )(resid   78 and  name HB#   ) 3.5 2.2 1.5
!R73
!intra
!assign (resid   73 and  name HN   )(resid   73 and  name HA    ) 2.5 0.7 0.7
!assign (resid   73 and  name HN   )(resid   73 and  name HG#   ) 3.5 1.5 1.5
!assign (resid   73 and  name HN   )(resid   73 and  name HB#   ) 3.0 1.0 1.0
!assign (resid   73 and  name HA   )(resid   73 and  name HB#   ) 3.5 2.2 1.5
!assign (resid   73 and  name HA   )(resid   73 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   73 and  name HA   )(resid   73 and  name HD#   ) 3.5 2.2 1.5
!assign (resid   73 and  name HB#  )(resid   73 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   73 and  name HB#  )(resid   73 and  name HD#   ) 3.5 2.2 1.5
!assign (resid   73 and  name HG1  )(resid   73 and  name HD#   ) 3.5 2.2 1.5
assign (resid   73 and  name HG2  )(resid   73 and  name HD#   ) 3.5 2.2 1.5
!inter
assign (resid   73 and  name HN   )(resid   71 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   73 and  name HN   )(resid   72 and  name HN    ) 4.0 1.5 1.0
assign (resid   73 and  name HN   )(resid   74 and  name HN    ) 3.0 1.0 1.0
assign (resid   73 and  name HN   )(resid   75 and  name HN    ) 4.0 1.0 1.0
assign (resid   73 and  name HN   )(resid   72 and  name HA    ) 2.5 0.7 0.7
assign (resid   73 and  name HN   )(resid   72 and  name HB#   ) 4.0 1.0 1.0
assign (resid   73 and  name HN   )(resid   78 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   73 and  name HA   )(resid   35 and  name HG1*  ) 4.0 1.0 1.5
assign (resid   73 and  name HA   )(resid   59 and  name HN    ) 4.0 1.0 1.5
assign (resid   73 and  name HA   )(resid   59 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   73 and  name HA   )(resid   72 and  name HB#   ) 4.0 1.0 1.5
assign (resid   73 and  name HA   )(resid   74 and  name HN    ) 3.5 1.0 1.5
!assign (resid   73 and  name HB#  )(resid   35 and  name HG1*  ) 4.0 1.0 1.5
assign (resid   73 and  name HB#  )(resid   59 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   73 and  name HB#  )(resid   74 and  name HN    ) 4.0 1.0 1.5
assign (resid   73 and  name HG2  )(resid   59 and  name HB1   ) 3.5 2.2 1.5
assign (resid   73 and  name HD#  )(resid   35 and  name HG1*  ) 3.5 2.2 1.5
assign (resid   73 and  name HD#  )(resid   59 and  name HB1   ) 3.5 2.2 1.5
assign (resid   73 and  name HD#  )(resid   59 and  name HB2   ) 3.5 2.2 1.5
!G74
!intra
!assign (resid   74 and  name HN   )(resid   74 and  name HA#   ) 3.0 1.2 1.0
!assign (resid   74 and  name HA1  )(resid   74 and  name HA2   ) 3.5 2.2 1.5
!inter
assign (resid   74 and  name HN   )(resid   75 and  name HN    ) 2.0 0.7 0.8
assign (resid   74 and  name HN   )(resid   76 and  name HN    ) 4.0 1.0 1.0
assign (resid   74 and  name HN   )(resid   72 and  name HG#   ) 4.0 1.0 1.0
assign (resid   74 and  name HN   )(resid   72 and  name HB#   ) 4.0 1.0 1.0
!assign (resid   74 and  name HA1  )(resid   37 and  name HB2   ) 4.0 1.0 1.5
assign (resid   74 and  name HA1  )(resid   37 and  name HG1   ) 3.5 2.2 1.5
assign (resid   74 and  name HA1  )(resid   38 and  name HB*   ) 4.0 1.0 1.9
!assign (resid   74 and  name HA1  )(resid   73 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   74 and  name HA1  )(resid   73 and  name HG2   ) 4.0 1.0 1.5
!assign (resid   74 and  name HA2  )(resid   37 and  name HG1   ) 3.5 1.0 1.5
assign (resid   74 and  name HA2  )(resid   73 and  name HB1   ) 4.0 1.0 1.5
!assign (resid   74 and  name HA2  )(resid   73 and  name HG2   ) 4.0 1.0 1.5
!G75
!intra
!assign (resid   75 and  name HN   )(resid   75 and  name HA#   ) 3.0 1.0 1.0
!assign (resid   75 and  name HA1  )(resid   75 and  name HA2   ) 3.5 2.2 1.5
!inter
assign (resid   75 and  name HN   )(resid   76 and  name HN    ) 3.0 1.0 0.5
assign (resid   75 and  name HN   )(resid   74 and  name HA#   ) 3.0 0.5 1.0
assign (resid   75 and  name HN   )(resid   38 and  name HA    ) 3.0 1.0 0.7
assign (resid   75 and  name HN   )(resid   72 and  name HG#   ) 4.0 1.0 1.0
!assign (resid   75 and  name HN   )(resid   72 and  name HB#   ) 4.0 1.0 1.0
!assign (resid   75 and  name HN   )(resid   73 and  name HB#   ) 4.0 1.0 1.0
assign (resid   75 and  name HN   )(resid   76 and  name HB#   ) 4.0 1.0 1.0
assign (resid   75 and  name HN   )(resid   38 and  name HB*   ) 4.0 1.0 1.0
assign (resid   75 and  name HA1  )(resid   38 and  name HA    ) 3.5 2.2 1.5
assign (resid   75 and  name HA1  )(resid   38 and  name HB*   ) 3.5 2.2 1.5
assign (resid   75 and  name HA1  )(resid   71 and  name HB#   ) 3.5 2.2 1.5
assign (resid   75 and  name HA1  )(resid   71 and  name HD1*  ) 3.5 2.2 2.5
assign (resid   75 and  name HA2  )(resid   38 and  name HA    ) 3.5 2.2 1.5
assign (resid   75 and  name HA2  )(resid   38 and  name HB*   ) 4.0 1.0 2.0
assign (resid   75 and  name HA2  )(resid   71 and  name HB#   ) 3.5 2.2 2.5
assign (resid   75 and  name HA2  )(resid   71 and  name HD1*  ) 3.5 2.2 2.5
!L76
!intra
!assign (resid   76 and  name HN   )(resid   76 and  name HA    ) 3.0 1.0 1.0
!assign (resid   76 and  name HN   )(resid   76 and  name HB#   ) 3.0 1.2 1.2
!assign (resid   76 and  name HA   )(resid   76 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   76 and  name HA   )(resid   76 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   76 and  name HA   )(resid   76 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   76 and  name HB1  )(resid   76 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   76 and  name HB1  )(resid   76 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   76 and  name HB1  )(resid   76 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   76 and  name HB2  )(resid   76 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   76 and  name HB2  )(resid   76 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   76 and  name HG   )(resid   76 and  name HN    ) 3.5 2.2 1.5
!assign (resid   76 and  name HG   )(resid   76 and  name HA    ) 3.5 2.2 1.5
!assign (resid   76 and  name HG   )(resid   76 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   76 and  name HG   )(resid   76 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   76 and  name HD1* )(resid   76 and  name HN    ) 4.0 1.0 1.5
!assign (resid   76 and  name HD1* )(resid   76 and  name HA    ) 3.5 2.2 1.5
!assign (resid   76 and  name HD1* )(resid   76 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   76 and  name HD2* )(resid   76 and  name HN    ) 4.0 1.0 1.5
!inter
assign (resid   76 and  name HN   )(resid   71 and  name HA    ) 4.0 1.0 1.0
assign (resid   76 and  name HN   )(resid   75 and  name HA#   ) 3.5 1.0 1.0
assign (resid   76 and  name HN   )(resid   72 and  name HB#   ) 4.0 1.0 1.5
assign (resid   76 and  name HN   )(resid   72 and  name HG#   ) 3.0 1.0 1.0
assign (resid   76 and  name HN   )(resid   38 and  name HB*   ) 4.0 1.0 2.0
assign (resid   76 and  name HA   )(resid   71 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   76 and  name HA   )(resid   72 and  name HG#   ) 4.0 1.0 1.5
assign (resid   76 and  name HB1  )(resid   72 and  name HN    ) 4.0 1.0 1.5
!assign (resid   76 and  name HB1  )(resid   72 and  name HB#   ) 3.5 2.2 1.5
assign (resid   76 and  name HB1  )(resid   72 and  name HG#   ) 3.5 2.2 1.5
assign (resid   76 and  name HB2  )(resid   72 and  name HN    ) 4.0 1.0 1.5
!assign (resid   76 and  name HB2  )(resid   72 and  name HB#   ) 3.5 2.2 1.5
assign (resid   76 and  name HB2  )(resid   72 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   76 and  name HD1* )(resid   72 and  name HG#   ) 4.0 1.0 1.5
assign (resid   76 and  name HD1* )(resid   77 and  name HN    ) 4.0 1.0 1.9
assign (resid   76 and  name HD2* )(resid   72 and  name HG#   ) 4.0 1.0 1.9
!assign (resid   76 and  name HD2* )(resid   77 and  name HN    ) 4.0 1.0 1.9
!T77
!intra
!assign (resid   77 and  name HN   )(resid   77 and  name HA    ) 3.0 1.0 1.0
!assign (resid   77 and  name HN   )(resid   77 and  name HG2*  ) 4.0 1.0 1.0
!assign (resid   77 and  name HA   )(resid   77 and  name HB    ) 3.5 2.2 1.5
!assign (resid   77 and  name HA   )(resid   77 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid   77 and  name HB   )(resid   77 and  name HN    ) 3.5 2.2 1.5
!assign (resid   77 and  name HB   )(resid   77 and  name HG2*  ) 3.5 2.2 1.5
!inter
assign (resid   77 and  name HN   )(resid   76 and  name HN    ) 4.0 1.0 1.0
assign (resid   77 and  name HN   )(resid   78 and  name HN    ) 4.0 1.0 1.0
assign (resid   77 and  name HN   )(resid   71 and  name HA    ) 4.0 1.0 1.0
assign (resid   77 and  name HN   )(resid   76 and  name HA    ) 2.5 0.7 1.0
assign (resid   77 and  name HN   )(resid   76 and  name HB#   ) 3.0 1.0 1.5
assign (resid   77 and  name HN   )(resid   71 and  name HD2*  ) 4.0 1.0 1.0
assign (resid   77 and  name HA   )(resid   70 and  name HN    ) 4.0 1.0 1.5
assign (resid   77 and  name HA   )(resid   71 and  name HA    ) 3.5 2.2 1.5
assign (resid   77 and  name HA   )(resid   71 and  name HD2*  ) 3.5 2.2 1.5
assign (resid   77 and  name HA   )(resid   72 and  name HN    ) 3.5 1.5 1.5
assign (resid   77 and  name HA   )(resid   78 and  name HN    ) 3.5 2.2 1.5
assign (resid   77 and  name HA   )(resid   78 and  name HB#   ) 4.0 1.0 1.5
assign (resid   77 and  name HA   )(resid   78 and  name HG    ) 4.0 1.0 1.5
assign (resid   77 and  name HA   )(resid   79 and  name HN    ) 3.5 2.2 1.5
assign (resid   77 and  name HB   )(resid   71 and  name HA    ) 4.0 1.0 1.5
assign (resid   77 and  name HB   )(resid   71 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   77 and  name HB   )(resid   76 and  name HB2   ) 4.0 1.0 1.5
assign (resid   77 and  name HG2* )(resid   69 and  name HN    ) 4.0 1.0 2.0
!assign (resid   77 and  name HG2* )(resid   70 and  name HB1   ) 3.5 1.5 1.5
assign (resid   77 and  name HG2* )(resid   71 and  name HD2*  ) 3.5 2.2 1.5
assign (resid   77 and  name HG2* )(resid   80 and  name HD1*  ) 4.0 1.0 2.0
!assign (resid   77 and  name HG2* )(resid   81 and  name HN    ) 4.0 1.0 1.5
!L78
!intra
!assign (resid   78 and  name HN   )(resid   78 and  name HA    ) 3.0 1.0 1.0
!assign (resid   78 and  name HN   )(resid   78 and  name HG    ) 3.0 1.0 1.0
!assign (resid   78 and  name HN   )(resid   78 and  name HB#   ) 2.5 0.7 1.5
!assign (resid   78 and  name HN   )(resid   78 and  name HD1*  ) 4.0 1.0 1.0
!assign (resid   78 and  name HN   )(resid   78 and  name HD2*  ) 4.0 1.0 1.0
!assign (resid   78 and  name HA   )(resid   78 and  name HB#   ) 3.5 2.2 1.5
!assign (resid   78 and  name HA   )(resid   78 and  name HG    ) 3.5 2.2 1.5
!assign (resid   78 and  name HA   )(resid   78 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   78 and  name HA   )(resid   78 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   78 and  name HB#  )(resid   78 and  name HG    ) 3.5 2.2 1.5
!assign (resid   78 and  name HB#  )(resid   78 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   78 and  name HB#  )(resid   78 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   78 and  name HG   )(resid   78 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   78 and  name HG   )(resid   78 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   78 and  name HD1* )(resid   78 and  name HD2*  ) 3.5 2.2 1.5
!inter
assign (resid   78 and  name HN   )(resid   79 and  name HN    ) 2.5 0.7 0.5
!assign (resid   78 and  name HN   )(resid   71 and  name HA    ) 2.5 0.7 1.0 - reduntant
assign (resid   78 and  name HN   )(resid   77 and  name HB    ) 4.0 1.0 1.0
!assign (resid   78 and  name HN   )(resid   79 and  name HG#   ) 4.0 1.0 1.0
assign (resid   78 and  name HN   )(resid   70 and  name HB#   ) 4.0 1.0 1.0
assign (resid   78 and  name HN   )(resid   77 and  name HG2*  ) 3.5 1.0 1.5
!assign (resid   78 and  name HA   )(resid   65 and  name HD1   ) 4.0 1.0 1.9
!assign (resid   78 and  name HA   )(resid   72 and  name HG#   ) 4.0 1.0 1.9
assign (resid   78 and  name HA   )(resid   77 and  name HA    ) 4.0 1.0 1.9
assign (resid   78 and  name HA   )(resid   77 and  name HG2*  ) 4.0 1.0 2.0
assign (resid   78 and  name HA   )(resid   79 and  name HN    ) 3.5 1.5 1.5
assign (resid   78 and  name HA   )(resid   79 and  name HB1   ) 4.0 1.0 1.8
!assign (resid   78 and  name HB#  )(resid   58 and  name HB1   ) 3.5 1.0 1.5
assign (resid   78 and  name HB#  )(resid   71 and  name HA    ) 4.0 1.0 1.8
assign (resid   78 and  name HB#  )(resid   72 and  name HN    ) 4.0 1.0 1.8
assign (resid   78 and  name HB#  )(resid   79 and  name HB1   ) 3.5 1.5 1.5
assign (resid   78 and  name HG   )(resid   71 and  name HA    ) 3.5 1.0 1.5
assign (resid   78 and  name HG   )(resid   72 and  name HG#   ) 3.5 1.5 1.5 !intra
assign (resid   78 and  name HG   )(resid   78 and  name HA    ) 3.5 1.5 1.5
assign (resid   78 and  name HD1* )(resid   59 and  name HN    ) 3.5 1.0 1.5
assign (resid   78 and  name HD1* )(resid   71 and  name HN    ) 4.0 1.0 1.5
assign (resid   78 and  name HD1* )(resid   72 and  name HB#   ) 3.5 2.2 1.8
assign (resid   78 and  name HD1* )(resid   72 and  name HG#   ) 3.5 2.2 1.8
assign (resid   78 and  name HD1* )(resid   79 and  name HN    ) 4.0 1.0 1.9
!assign (resid   78 and  name HD2* )(resid   57 and  name HA    ) 4.0 1.0 1.9
assign (resid   78 and  name HD2* )(resid   71 and  name HA    ) 4.0 1.0 1.9
assign (resid   78 and  name HD2* )(resid   72 and  name HN    ) 4.0 1.0 1.5
assign (resid   78 and  name HD2* )(resid   72 and  name HB#   ) 3.5 2.2 1.8
assign (resid   78 and  name HD2* )(resid   72 and  name HG#   ) 3.5 2.2 1.8
assign (resid   78 and  name HD2* )(resid   79 and  name HN    ) 4.0 1.0 1.9
!M79
!intra
!assign (resid   79 and  name HN   )(resid   79 and  name HA    ) 3.0 1.0 1.0
!assign (resid   79 and  name HN   )(resid   79 and  name HG#   ) 4.0 1.0 1.0
!assign (resid   79 and  name HN   )(resid   79 and  name HB#   ) 3.0 1.0 1.2
!assign (resid   79 and  name HA   )(resid   79 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   79 and  name HA   )(resid   79 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   79 and  name HA   )(resid   79 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   79 and  name HA   )(resid   79 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   79 and  name HB1  )(resid   79 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   79 and  name HB1  )(resid   79 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   79 and  name HB1  )(resid   79 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   79 and  name HB2  )(resid   79 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   79 and  name HB2  )(resid   79 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   79 and  name HG1  )(resid   79 and  name HG2   ) 3.5 2.2 1.5
!inter
assign (resid   79 and  name HN   )(resid   69 and  name HA    ) 4.0 1.0 1.0
assign (resid   79 and  name HN   )(resid   80 and  name HN    ) 4.0 1.0 1.0
assign (resid   79 and  name HN   )(resid   71 and  name HA    ) 4.0 1.0 1.0
assign (resid   79 and  name HN   )(resid   80 and  name HA    ) 4.0 1.0 1.0
assign (resid   79 and  name HN   )(resid   77 and  name HB    ) 4.0 1.0 1.0
assign (resid   79 and  name HN   )(resid   70 and  name HB#   ) 4.0 1.5 1.0
assign (resid   79 and  name HN   )(resid   78 and  name HG    ) 4.0 1.0 1.0
assign (resid   79 and  name HN   )(resid   78 and  name HB#   ) 3.0 1.0 1.0
assign (resid   79 and  name HN   )(resid   77 and  name HG2*  ) 3.0 1.0 1.0
assign (resid   79 and  name HN   )(resid   71 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   79 and  name HA   )(resid   77 and  name HG2*  ) 4.0 1.0 2.0
assign (resid   79 and  name HB1  )(resid   54 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   79 and  name HB1  )(resid   70 and  name HD1*  ) 3.5 2.2 1.8
assign (resid   79 and  name HB2  )(resid   54 and  name HD1*  ) 3.5 2.2 1.8
assign (resid   79 and  name HB2  )(resid   54 and  name HD2*  ) 3.5 2.2 1.8
assign (resid   79 and  name HB2  )(resid   70 and  name HN    ) 3.5 1.0 1.5
assign (resid   79 and  name HG1  )(resid   54 and  name HD2*  ) 3.5 2.2 1.8
assign (resid   79 and  name HG1  )(resid   70 and  name HD1*  ) 3.5 2.2 1.8
assign (resid   79 and  name HG1  )(resid   91 and  name HG2*  ) 3.5 2.2 1.8
assign (resid   79 and  name HG2  )(resid   70 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   79 and  name HG2  )(resid   91 and  name HG2*  ) 3.5 2.2 1.8
!L80
!intra
!assign (resid   80 and  name HN   )(resid   80 and  name HA    ) 3.0 1.0 1.0
!assign (resid   80 and  name HN   )(resid   80 and  name HG    ) 4.0 1.0 1.0
!assign (resid   80 and  name HN   )(resid   80 and  name HB#   ) 2.5 0.7 1.0
!assign (resid   80 and  name HA   )(resid   80 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   80 and  name HA   )(resid   80 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   80 and  name HB1  )(resid   80 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   80 and  name HB1  )(resid   80 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   80 and  name HB1  )(resid   80 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   80 and  name HB2  )(resid   80 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   80 and  name HB2  )(resid   80 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   80 and  name HG   )(resid   80 and  name HA    ) 4.0 1.0 1.5
!assign (resid   80 and  name HG   )(resid   80 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   80 and  name HG   )(resid   80 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   80 and  name HG   )(resid   80 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   80 and  name HG   )(resid   80 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   80 and  name HD2* )(resid   80 and  name HA    ) 4.0 1.0 1.5
!inter
assign (resid   80 and  name HN   )(resid   69 and  name HA    ) 4.0 1.0 1.0
assign (resid   80 and  name HN   )(resid   79 and  name HA    ) 2.5 0.7 0.5
assign (resid   80 and  name HN   )(resid   79 and  name HG#   ) 3.0 0.8 0.8
assign (resid   80 and  name HN   )(resid   79 and  name HB#   ) 4.0 1.0 1.0
assign (resid   80 and  name HA   )(resid   79 and  name HA    ) 4.0 1.0 1.8
assign (resid   80 and  name HB1  )(resid   69 and  name HA    ) 4.0 1.0 1.5
assign (resid   80 and  name HB1  )(resid   77 and  name HG2*  ) 3.5 2.2 1.5
assign (resid   80 and  name HB2  )(resid   77 and  name HG2*  ) 4.0 1.0 2.0
assign (resid   80 and  name HG   )(resid   68 and  name HN    ) 4.0 1.0 1.5
assign (resid   80 and  name HG   )(resid   69 and  name HA    ) 4.0 1.0 1.5
assign (resid   80 and  name HD1* )(resid   68 and  name HN    ) 3.5 2.2 1.5
!assign (resid   80 and  name HD1* )(resid   69 and  name HA    ) 3.5 2.2 1.5 - reduntant
assign (resid   80 and  name HD1* )(resid   70 and  name HN    ) 4.0 1.0 1.9
assign (resid   80 and  name HD1* )(resid   81 and  name HN    ) 3.5 2.2 1.5
assign (resid   80 and  name HD1* )(resid   64 and  name HG2#  ) 3.5 2.2 1.5
!assign (resid   80 and  name HD1* )(resid   68 and  name HN    ) 4.0 1.0 1.5 - reduntant
assign (resid   80 and  name HD1* )(resid   69 and  name HA    ) 4.0 1.0 1.9
assign (resid   80 and  name HD2* )(resid   81 and  name HN    ) 4.0 1.0 2.0
!L81
!intra
!assign (resid   81 and  name HN   )(resid   81 and  name HA    ) 3.0 1.0 1.0
!assign (resid   81 and  name HN   )(resid   81 and  name HB#   ) 3.0 1.0 1.0
!assign (resid   81 and  name HN   )(resid   81 and  name HD1*  ) 4.0 1.0 1.0
!assign (resid   81 and  name HA   )(resid   81 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   81 and  name HA   )(resid   81 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   81 and  name HA   )(resid   81 and  name HG    ) 3.5 2.2 1.5
!assign (resid   81 and  name HA   )(resid   81 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   81 and  name HA   )(resid   81 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   81 and  name HB1  )(resid   81 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   81 and  name HB1  )(resid   81 and  name HG    ) 3.5 2.2 1.5
!assign (resid   81 and  name HB1  )(resid   81 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   81 and  name HB1  )(resid   81 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   81 and  name HG   )(resid   81 and  name HN    ) 3.5 1.5 1.5
!assign (resid   81 and  name HG   )(resid   81 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   81 and  name HG   )(resid   81 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   81 and  name HD2* )(resid   81 and  name HN    ) 3.5 1.0 1.5
!inter
assign (resid   81 and  name HN   )(resid   69 and  name HA    ) 3.5 1.0 0.8
assign (resid   81 and  name HN   )(resid   80 and  name HA    ) 2.5 0.7 0.5
assign (resid   81 and  name HN   )(resid   91 and  name HB    ) 4.0 1.0 1.0
assign (resid   81 and  name HN   )(resid   80 and  name HG    ) 3.5 1.0 0.8
assign (resid   81 and  name HN   )(resid   80 and  name HB#   ) 4.0 1.0 1.0
assign (resid   81 and  name HN   )(resid   68 and  name HB    ) 4.0 1.0 1.0
assign (resid   81 and  name HN   )(resid   70 and  name HG#   ) 4.0 1.0 1.0
assign (resid   81 and  name HA   )(resid   89 and  name HA    ) 4.0 1.0 2.0
assign (resid   81 and  name HA   )(resid   89 and  name HB1   ) 4.0 1.0 1.8
assign (resid   81 and  name HA   )(resid   89 and  name HB2   ) 4.0 1.0 1.5
assign (resid   81 and  name HA   )(resid   91 and  name HB    ) 3.5 2.2 1.5
assign (resid   81 and  name HB1  )(resid   68 and  name HN    ) 3.5 1.0 1.5
assign (resid   81 and  name HB1  )(resid   89 and  name HB1   ) 3.5 2.2 1.5
assign (resid   81 and  name HB1  )(resid   89 and  name HB2   ) 3.5 2.2 1.5
assign (resid   81 and  name HB1  )(resid  101 and  name HB2   ) 4.0 1.0 1.8
assign (resid   81 and  name HB2  )(resid   68 and  name HN    ) 4.0 1.0 1.5
assign (resid   81 and  name HB2  )(resid   68 and  name HB    ) 3.5 1.5 1.5
assign (resid   81 and  name HB2  )(resid   68 and  name HG2*  ) 4.0 1.0 1.9
assign (resid   81 and  name HB2  )(resid   89 and  name HB1   ) 3.5 2.2 1.5
assign (resid   81 and  name HB2  )(resid   89 and  name HB2   ) 3.5 2.2 1.5
assign (resid   81 and  name HB2  )(resid  101 and  name HB2   ) 4.0 1.0 1.5
assign (resid   81 and  name HB2  )(resid  101 and  name HD2*  ) 4.0 1.0 1.5
assign (resid   81 and  name HG   )(resid   79 and  name HG2   ) 3.5 2.2 1.5
assign (resid   81 and  name HG   )(resid   79 and  name HG1   ) 3.5 2.2 1.5
assign (resid   81 and  name HG   )(resid   82 and  name HN    ) 4.0 1.0 1.5
assign (resid   81 and  name HG   )(resid   91 and  name HB    ) 3.5 2.2 1.5
assign (resid   81 and  name HD2* )(resid   79 and  name HG1   ) 4.0 1.0 1.5
assign (resid   81 and  name HD2* )(resid   89 and  name HB1   ) 4.0 1.0 1.5
assign (resid   81 and  name HD2* )(resid   89 and  name HB2   ) 3.5 1.0 1.5
assign (resid   81 and  name HD2* )(resid   90 and  name HA    ) 4.0 1.0 1.5
!assign (resid   81 and  name HD2* )(resid   99 and  name HD1*  ) 3.5 1.5 1.8
!assign (resid   81 and  name HD2* )(resid   99 and  name HD2*  ) 3.5 2.2 1.8
assign (resid   81 and  name HD2* )(resid  101 and  name HB1   ) 3.5 2.2 1.5
!G82
!intra
!assign (resid   82 and  name HN   )(resid   82 and  name HA#   ) 3.0 1.0 0.5
!assign (resid   82 and  name HA1  )(resid   82 and  name HA2   ) 3.5 2.2 1.5
!inter
assign (resid   82 and  name HN   )(resid   83 and  name HN    ) 4.0 1.0 1.0
assign (resid   82 and  name HN   )(resid   90 and  name HN    ) 3.5 1.0 0.8 ! Strong
assign (resid   82 and  name HN   )(resid   89 and  name HD2   ) 4.0 1.0 1.0
assign (resid   82 and  name HN   )(resid   90 and  name HA    ) 4.0 1.0 1.0
assign (resid   82 and  name HN   )(resid   89 and  name HA    ) 4.0 1.0 1.0
assign (resid   82 and  name HN   )(resid   81 and  name HA    ) 2.5 0.7 0.7
assign (resid   82 and  name HN   )(resid   89 and  name HB#   ) 4.0 1.0 1.0
assign (resid   82 and  name HN   )(resid   91 and  name HB    ) 3.5 1.0 1.0
assign (resid   82 and  name HN   )(resid   81 and  name HB#   ) 3.5 1.0 1.5
assign (resid   82 and  name HN   )(resid   91 and  name HG2*  ) 4.0 1.0 2.0
assign (resid   82 and  name HN   )(resid   81 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   82 and  name HA1  )(resid   80 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   82 and  name HA1  )(resid   81 and  name HA    ) 4.0 1.0 1.5
assign (resid   82 and  name HA1  )(resid   83 and  name HB1   ) 4.0 1.0 1.5
assign (resid   82 and  name HA1  )(resid   83 and  name HB2   ) 4.0 1.0 1.5
assign (resid   82 and  name HA2  )(resid   80 and  name HD1*  ) 4.0 1.0 1.9
assign (resid   82 and  name HA2  )(resid   81 and  name HA    ) 4.0 1.0 1.5
assign (resid   82 and  name HA2  )(resid   83 and  name HB1   ) 4.0 1.0 1.5
assign (resid   82 and  name HA2  )(resid   83 and  name HB2   ) 4.0 1.0 1.5
!R83
!intra
!assign (resid   83 and  name HN   )(resid   83 and  name HA    ) 3.0 1.0 1.0
!assign (resid   83 and  name HN   )(resid   83 and  name HB#   ) 2.5 0.7 1.0
!assign (resid   83 and  name HN   )(resid   83 and  name HG#   ) 4.0 1.0 1.0
!assign (resid   83 and  name HN   )(resid   83 and  name HD#   ) 4.0 1.0 1.0
!assign (resid   83 and  name HA   )(resid   83 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   83 and  name HA   )(resid   83 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   83 and  name HA   )(resid   83 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   83 and  name HA   )(resid   83 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   83 and  name HA   )(resid   83 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   83 and  name HB1  )(resid   83 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   83 and  name HB1  )(resid   83 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   83 and  name HB1  )(resid   83 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   83 and  name HB1  )(resid   83 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   83 and  name HB1  )(resid   83 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   83 and  name HB2  )(resid   83 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   83 and  name HB2  )(resid   83 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   83 and  name HB2  )(resid   83 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   83 and  name HB2  )(resid   83 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   83 and  name HG1  )(resid   83 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   83 and  name HG1  )(resid   83 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   83 and  name HG1  )(resid   83 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   83 and  name HG2  )(resid   83 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   83 and  name HG2  )(resid   83 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   83 and  name HD1  )(resid   83 and  name HD2   ) 3.5 2.2 1.5
!inter
assign (resid   83 and  name HN   )(resid   84 and  name HN    ) 4.0 1.0 1.0
assign (resid   83 and  name HN   )(resid   89 and  name HA    ) 4.0 1.0 1.0
assign (resid   83 and  name HN   )(resid   82 and  name HA#   ) 2.5 0.7 1.0
assign (resid   83 and  name HN   )(resid   67 and  name HA#   ) 2.5 0.7 1.2
assign (resid   83 and  name HA   )(resid   89 and  name HA    ) 3.5 2.2 1.5
assign (resid   83 and  name HA   )(resid   89 and  name HB2   ) 4.0 1.0 1.5
!Q84
!intra
!assign (resid   84 and  name HN   )(resid   84 and  name HA    ) 3.0 1.0 1.0
!assign (resid   84 and  name HN   )(resid   84 and  name HB#   ) 3.0 1.0 1.0
!assign (resid   84 and  name HA   )(resid   84 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   84 and  name HA   )(resid   84 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   84 and  name HA   )(resid   84 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   84 and  name HB1  )(resid   84 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   84 and  name HB1  )(resid   84 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   84 and  name HB2  )(resid   84 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   84 and  name HG1  )(resid   84 and  name HN    ) 3.5 2.2 1.5
!assign (resid   84 and  name HG1  )(resid   84 and  name HG2   ) 3.5 2.2 1.5
assign (resid   84 and  name HG#  )(resid   84 and  name HE2#  ) 3.5 2.2 1.5
!inter
assign (resid   84 and  name HN   )(resid   89 and  name HD2   ) 4.0 1.0 1.0
assign (resid   84 and  name HN   )(resid   89 and  name HA    ) 2.5 0.7 1.0
assign (resid   84 and  name HN   )(resid   83 and  name HA    ) 2.5 0.7 0.6
assign (resid   84 and  name HN   )(resid   83 and  name HD#   ) 4.0 1.0 1.5
!assign (resid   84 and  name HN   )(resid   83 and  name HG#   ) 3.5 1.0 1.0 - reduntant
assign (resid   84 and  name HN   )(resid   83 and  name HB#   ) 4.0 1.0 1.0
assign (resid   84 and  name HN   )(resid   83 and  name HG#   ) 3.5 1.0 1.0
assign (resid   84 and  name HA   )(resid   89 and  name HA    ) 4.0 1.0 1.8
assign (resid   84 and  name HA   )(resid   90 and  name HD1   ) 4.0 1.0 1.5
!assign (resid   84 and  name HB1  )(resid   89 and  name HA    ) 4.0 1.0 1.5
assign (resid   84 and  name HB1  )(resid   90 and  name HD1   ) 4.0 1.0 1.5
assign (resid   84 and  name HB2  )(resid   90 and  name HD1   ) 3.5 2.2 1.5
assign (resid   84 and  name HG1  )(resid   89 and  name HA    ) 4.0 1.0 1.5
assign (resid   84 and  name HG1  )(resid   90 and  name HD1   ) 3.5 2.2 1.5
assign (resid   84 and  name HG1  )(resid   90 and  name HG2   ) 3.5 2.2 1.5
assign (resid   84 and  name HG2  )(resid   89 and  name HA    ) 4.0 1.0 1.5
assign (resid   84 and  name HG2  )(resid   90 and  name HG2   ) 3.5 2.2 1.5
assign (resid   84 and  name HG2  )(resid   90 and  name HD1   ) 3.5 2.2 1.5
!G85
!inter
assign (resid   85 and  name HN   )(resid   84 and  name HN    ) 2.5 0.7 0.6
assign (resid   85 and  name HN   )(resid   83 and  name HA    ) 3.5 1.0 1.0
assign (resid   85 and  name HN   )(resid   88 and  name HB#   ) 4.0 1.0 1.0
assign (resid   85 and  name HN   )(resid   84 and  name HB#   ) 3.5 1.0 1.0
assign (resid   85 and  name HN   )(resid   83 and  name HG#   ) 3.0 1.0 1.0
!E86
!intra
!assign (resid   86 and  name HN   )(resid   86 and  name HA    ) 3.0 1.0 1.0
!assign (resid   86 and  name HA   )(resid   86 and  name HB#   ) 3.5 2.2 1.5
!assign (resid   86 and  name HA   )(resid   86 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   86 and  name HB#  )(resid   86 and  name HG#   ) 3.5 2.2 1.5
!inter
assign (resid   86 and  name HN   )(resid   85 and  name HA#   ) 2.5 0.7 0.8
!G87
!intra
!assign (resid   87 and  name HN   )(resid   87 and  name HA#   ) 2.5 0.7 1.0
!inter
assign (resid   87 and  name HN   )(resid   88 and  name HN    ) 2.5 0.7 1.3
assign (resid   87 and  name HN   )(resid   86 and  name HA    ) 2.5 0.7 0.5
assign (resid   87 and  name HA1  )(resid   86 and  name HG#   ) 4.0 1.0 1.5
!assign (resid   87 and  name HA1  )(resid  103 and  name HB1   ) 4.0 1.0 1.5
assign (resid   87 and  name HA2  )(resid   86 and  name HG#   ) 4.0 1.0 1.5
!D88
!intra
!assign (resid   88 and  name HN   )(resid   88 and  name HA    ) 3.0 1.0 1.0
!assign (resid   88 and  name HN   )(resid   88 and  name HB#   ) 3.0 1.0 1.0
!assign (resid   88 and  name HA   )(resid   88 and  name HB#   ) 3.5 2.2 1.5
!inter
assign (resid   88 and  name HN   )(resid   85 and  name HN    ) 3.5 1.0 1.0
assign (resid   88 and  name HN   )(resid   89 and  name HN    ) 4.0 1.0 1.0
assign (resid   88 and  name HN   )(resid   84 and  name HN    ) 4.0 1.0 1.0
!assign (resid   88 and  name HN   )(resid   89 and  name HD1   ) 3.0 1.0 1.0 - reduntant
assign (resid   88 and  name HN   )(resid   86 and  name HA    ) 3.5 1.0 1.2
assign (resid   88 and  name HN   )(resid   87 and  name HA#   ) 3.0 1.0 1.5
!assign (resid   88 and  name HA   )(resid   89 and  name HB1   ) 3.5 1.5 1.5
assign (resid   88 and  name HA   )(resid  100 and  name HG1*  ) 3.5 2.2 1.5
assign (resid   88 and  name HA   )(resid  102 and  name HA    ) 3.5 2.2 1.5
assign (resid   88 and  name HA   )(resid  102 and  name HG1   ) 3.5 2.2 1.5
assign (resid   88 and  name HA   )(resid  103 and  name HN    ) 4.0 1.0 1.5
!assign (resid   88 and  name HB#  )(resid   84 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   88 and  name HB#  )(resid   87 and  name HA2   ) 3.5 2.2 1.5
!assign (resid   88 and  name HB#  )(resid   89 and  name HB1   ) 4.0 1.0 1.5
assign (resid   88 and  name HB#  )(resid  102 and  name HG1   ) 3.5 2.2 1.5
!Y89
!intra
!assign (resid   89 and  name HN   )(resid   89 and  name HA    ) 3.0 1.0 1.0
!assign (resid   89 and  name HN   )(resid   89 and  name HB#   ) 3.0 1.0 1.0
!assign (resid   89 and  name HA   )(resid   89 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   89 and  name HA   )(resid   89 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   89 and  name HB1  )(resid   89 and  name HB2   ) 3.5 2.2 1.5
assign (resid   89 and  name HD1  )(resid   89 and  name HB1   ) 3.5 1.5 1.5
assign (resid   89 and  name HD2  )(resid   89 and  name HB2   ) 3.5 1.5 1.5
assign (resid   89 and  name HE1  )(resid   89 and  name HN    ) 3.5 1.5 1.5
!inter
assign (resid   89 and  name HN   )(resid   84 and  name HN    ) 4.0 1.0 1.0
assign (resid   89 and  name HN   )(resid   90 and  name HN    ) 4.0 1.0 1.0
assign (resid   89 and  name HN   )(resid   90 and  name HA    ) 4.0 1.0 1.0
assign (resid   89 and  name HN   )(resid   88 and  name HA    ) 2.5 0.7 0.7
assign (resid   89 and  name HN   )(resid   88 and  name HB#   ) 4.0 1.0 1.0
assign (resid   89 and  name HN   )(resid  101 and  name HB#   ) 3.5 1.2 1.5
assign (resid   89 and  name HN   )(resid  100 and  name HG1*  ) 4.0 1.0 1.0
assign (resid   89 and  name HA   )(resid   83 and  name HB1   ) 4.0 1.0 1.5
assign (resid   89 and  name HA   )(resid   90 and  name HG1   ) 3.5 2.2 1.5
assign (resid   89 and  name HA   )(resid   90 and  name HG2   ) 3.5 1.0 1.5
!assign (resid   89 and  name HA   )(resid  104 and  name HB*   ) 3.5 2.2 1.5
assign (resid   89 and  name HB1  )(resid   68 and  name HB    ) 4.0 1.0 1.5
assign (resid   89 and  name HB1  )(resid   81 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   89 and  name HB1  )(resid  101 and  name HB1   ) 3.5 2.2 1.5
assign (resid   89 and  name HB1  )(resid  101 and  name HB2   ) 3.5 2.2 1.5
assign (resid   89 and  name HB1  )(resid  101 and  name HD2*  ) 3.5 2.2 1.5
assign (resid   89 and  name HB2  )(resid   68 and  name HB    ) 4.0 1.0 1.5
assign (resid   89 and  name HB2  )(resid   68 and  name HD1*  ) 4.0 1.0 1.9
assign (resid   89 and  name HB2  )(resid   81 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   89 and  name HB2  )(resid  101 and  name HB1   ) 4.0 1.0 1.5
assign (resid   89 and  name HB2  )(resid  101 and  name HB2   ) 3.5 2.2 1.5
assign (resid   89 and  name HB2  )(resid  101 and  name HD2*  ) 4.0 1.0 1.5
assign (resid   89 and  name HD1  )(resid   68 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   89 and  name HD1  )(resid   83 and  name HG2   ) 3.5 1.5 1.5
assign (resid   89 and  name HD1  )(resid   87 and  name HA1   ) 3.5 1.5 1.5
assign (resid   89 and  name HD1  )(resid   88 and  name HN    ) 3.5 1.5 1.5
assign (resid   89 and  name HD1  )(resid   89 and  name HN    ) 3.5 1.5 1.5 !intra
assign (resid   89 and  name HD1  )(resid   90 and  name HN    ) 4.0 1.0 1.5
assign (resid   89 and  name HD1  )(resid  101 and  name HB2   ) 3.5 1.5 1.5
assign (resid   89 and  name HD1  )(resid  101 and  name HG    ) 3.5 1.5 1.5
assign (resid   89 and  name HD1  )(resid  102 and  name HA    ) 3.5 1.5 1.5
assign (resid   89 and  name HD1  )(resid  101 and  name HD2*  ) 3.5 1.5 2.5
assign (resid   89 and  name HD2  )(resid   67 and  name HA1   ) 3.5 1.5 1.5
assign (resid   89 and  name HD2  )(resid   68 and  name HN    ) 3.5 1.5 1.5
assign (resid   89 and  name HD2  )(resid   68 and  name HB    ) 3.5 1.5 1.5
assign (resid   89 and  name HD2  )(resid   68 and  name HG12  ) 3.5 1.5 1.5
assign (resid   89 and  name HD2  )(resid   68 and  name HD1*  ) 3.5 1.5 2.5
assign (resid   89 and  name HD2  )(resid   83 and  name HA    ) 3.5 1.5 1.5
assign (resid   89 and  name HD2  )(resid   83 and  name HG2   ) 3.5 1.5 1.5
assign (resid   89 and  name HD2  )(resid  101 and  name HD2*  ) 3.5 1.5 2.5
assign (resid   89 and  name HE1  )(resid   11 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   89 and  name HE1  )(resid   68 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   89 and  name HE1  )(resid   83 and  name HA    ) 3.5 1.5 1.5
!assign (resid   89 and  name HE1  )(resid   83 and  name HD1   ) 3.5 1.5 1.5
assign (resid   89 and  name HE1  )(resid   83 and  name HG2   ) 3.5 1.5 1.5
assign (resid   89 and  name HE1  )(resid   88 and  name HN    ) 3.5 1.5 1.5
assign (resid   89 and  name HE2  )(resid   11 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   89 and  name HE2  )(resid   67 and  name HN    ) 3.5 1.5 1.5
assign (resid   89 and  name HE2  )(resid   67 and  name HA1   ) 3.5 2.0 1.5
assign (resid   89 and  name HE2  )(resid   68 and  name HN    ) 3.5 1.5 1.5
assign (resid   89 and  name HE2  )(resid   68 and  name HG12  ) 3.5 1.5 1.5
assign (resid   89 and  name HE2  )(resid   68 and  name HD1*  ) 3.5 1.5 1.5
assign (resid   89 and  name HE2  )(resid   83 and  name HA    ) 3.5 1.5 1.5
assign (resid   89 and  name HE2  )(resid   83 and  name HB1   ) 3.5 1.5 1.5
assign (resid   89 and  name HE2  )(resid   83 and  name HB2   ) 3.5 1.5 1.5
assign (resid   89 and  name HE2  )(resid   83 and  name HG2   ) 3.5 1.5 1.5
!assign (resid   89 and  name HE2  )(resid   83 and  name HD1   ) 3.5 1.5 1.5
!R90
!intra
!assign (resid   90 and  name HN   )(resid   90 and  name HA    ) 3.0 1.0 1.0
!assign (resid   90 and  name HN   )(resid   90 and  name HB#   ) 4.0 1.5 1.0
!assign (resid   90 and  name HN   )(resid   90 and  name HG#   ) 3.0 0.5 1.5
!assign (resid   90 and  name HA   )(resid   90 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   90 and  name HA   )(resid   90 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   90 and  name HA   )(resid   90 and  name HD1   ) 4.0 1.0 1.5
!assign (resid   90 and  name HA   )(resid   90 and  name HD2   ) 4.0 1.0 1.5
!assign (resid   90 and  name HB1  )(resid   90 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   90 and  name HB1  )(resid   90 and  name HD1   ) 4.0 1.0 1.5
!assign (resid   90 and  name HB1  )(resid   90 and  name HD2   ) 4.0 1.0 1.5
!assign (resid   90 and  name HB2  )(resid   90 and  name HD1   ) 4.0 1.0 1.5
!assign (resid   90 and  name HB2  )(resid   90 and  name HD2   ) 4.0 1.0 1.5
!assign (resid   90 and  name HG1  )(resid   90 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   90 and  name HG1  )(resid   90 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   90 and  name HG1  )(resid   90 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   90 and  name HG2  )(resid   90 and  name HD1   ) 3.5 2.2 1.5
!assign (resid   90 and  name HG2  )(resid   90 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   90 and  name HD1  )(resid   90 and  name HN    ) 4.0 1.0 1.5
!assign (resid   90 and  name HD1  )(resid   90 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   90 and  name HD2  )(resid   90 and  name HN    ) 4.0 1.0 1.8
!inter
assign (resid   90 and  name HN   )(resid   91 and  name HN    ) 4.0 1.0 1.0
!assign (resid   90 and  name HN   )(resid   89 and  name HD1   ) 4.0 1.0 1.0
assign (resid   90 and  name HN   )(resid   89 and  name HA    ) 2.5 0.7 0.6
assign (resid   90 and  name HN   )(resid   81 and  name HA    ) 4.0 1.0 1.0
assign (resid   90 and  name HN   )(resid   82 and  name HA#   ) 4.0 1.0 1.0
assign (resid   90 and  name HN   )(resid   83 and  name HA    ) 4.0 1.0 1.0
assign (resid   90 and  name HN   )(resid   89 and  name HB#   ) 3.5 1.0 1.2
assign (resid   90 and  name HN   )(resid   84 and  name HG#   ) 3.5 1.0 1.5
assign (resid   90 and  name HN   )(resid   81 and  name HB#   ) 4.0 1.0 1.5
assign (resid   90 and  name HN   )(resid   81 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   90 and  name HA   )(resid   91 and  name HB    ) 4.0 1.0 1.5
assign (resid   90 and  name HA   )(resid   98 and  name HG1   ) 4.0 1.0 2.0
assign (resid   90 and  name HA   )(resid  100 and  name HA    ) 3.5 1.5 1.5
assign (resid   90 and  name HA   )(resid  100 and  name HG2*  ) 3.5 2.2 1.5
assign (resid   90 and  name HB1  )(resid   91 and  name HN    ) 3.5 2.2 1.5
assign (resid   90 and  name HB1  )(resid   98 and  name HG1   ) 4.0 1.0 2.0
!assign (resid   90 and  name HB1  )(resid  100 and  name HG1*  ) 4.0 1.0 1.5
!assign (resid   90 and  name HB1  )(resid  100 and  name HG2*  ) 3.5 2.2 1.5
assign (resid   90 and  name HB2  )(resid   91 and  name HN    ) 3.5 2.2 1.5
assign (resid   90 and  name HB2  )(resid  100 and  name HG1*  ) 4.0 1.0 2.0
assign (resid   90 and  name HB2  )(resid  100 and  name HG2*  ) 3.5 2.2 1.5
assign (resid   90 and  name HG1  )(resid   84 and  name HG2   ) 3.5 1.0 1.5
assign (resid   90 and  name HG1  )(resid   91 and  name HN    ) 3.5 1.0 1.5
assign (resid   90 and  name HG1  )(resid  101 and  name HN    ) 4.0 1.0 1.5
assign (resid   90 and  name HG1  )(resid  100 and  name HG2*  ) 3.5 2.2 1.5
assign (resid   90 and  name HG2  )(resid   91 and  name HN    ) 4.0 1.0 1.5
assign (resid   90 and  name HG2  )(resid  100 and  name HG1*  ) 4.0 1.0 2.0
!assign (resid   90 and  name HG2  )(resid  100 and  name HG2*  ) 3.5 2.2 1.5
assign (resid   90 and  name HD1  )(resid   98 and  name HG1   ) 4.0 1.0 2.0
assign (resid   90 and  name HD1  )(resid  100 and  name HG1*  ) 4.0 1.0 2.0
assign (resid   90 and  name HD1  )(resid  100 and  name HG2*  ) 3.5 2.2 1.5
assign (resid   90 and  name HD2  )(resid   84 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   90 and  name HD2  )(resid   91 and  name HN    ) 4.0 1.0 1.5
!assign (resid   90 and  name HD2  )(resid   98 and  name HG1   ) 4.0 1.0 1.5
assign (resid   90 and  name HD2  )(resid  100 and  name HG1*  ) 4.0 1.0 2.0
assign (resid   90 and  name HD2  )(resid  100 and  name HG2*  ) 4.0 1.0 2.0
!V91
!intra
!assign (resid   91 and  name HN   )(resid   91 and  name HA    ) 3.0 1.0 1.0
!assign (resid   91 and  name HN   )(resid   91 and  name HB    ) 3.5 1.0 1.0
!assign (resid   91 and  name HN   )(resid   91 and  name HG1*  ) 4.0 1.5 1.0
!assign (resid   91 and  name HN   )(resid   91 and  name HG2*  ) 4.0 1.0 1.0
!assign (resid   91 and  name HA   )(resid   91 and  name HB    ) 3.5 2.2 1.5
!assign (resid   91 and  name HA   )(resid   91 and  name HG1*  ) 4.0 1.0 1.9
!assign (resid   91 and  name HA   )(resid   91 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid   91 and  name HB   )(resid   91 and  name HG1*  ) 3.5 2.2 1.5
!assign (resid   91 and  name HB   )(resid   91 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid   91 and  name HG1* )(resid   91 and  name HG2*  ) 3.5 2.2 1.5
!inter
assign (resid   91 and  name HN   )(resid   90 and  name HA    ) 2.5 0.7 0.8  !Strong
assign (resid   91 and  name HN   )(resid   92 and  name HA    ) 4.0 1.0 1.0
assign (resid   91 and  name HN   )(resid   98 and  name HG#   ) 4.0 1.0 1.0
assign (resid   91 and  name HN   )(resid   99 and  name HB#   ) 4.0 1.3 1.0
assign (resid   91 and  name HN   )(resid   81 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   91 and  name HA   )(resid   81 and  name HA    ) 3.5 1.0 1.5
!assign (resid   91 and  name HA   )(resid   81 and  name HD2*  ) 4.0 1.0 1.9
assign (resid   91 and  name HA   )(resid   90 and  name HB1   ) 4.0 1.0 1.5
assign (resid   91 and  name HA   )(resid   90 and  name HB2   ) 4.0 1.0 1.5
assign (resid   91 and  name HA   )(resid   92 and  name HN    ) 3.5 2.2 1.5
!assign (resid   91 and  name HA   )(resid   92 and  name HB1   ) 4.0 1.0 1.5
assign (resid   91 and  name HB   )(resid   81 and  name HD2*  ) 4.0 1.0 1.5
assign (resid   91 and  name HB   )(resid   90 and  name HB1   ) 4.0 1.0 1.9
assign (resid   91 and  name HB   )(resid   90 and  name HB2   ) 4.0 1.0 1.9
assign (resid   91 and  name HB   )(resid   99 and  name HB1   ) 4.0 1.0 1.9
assign (resid   91 and  name HB   )(resid   99 and  name HD1*  ) 4.0 1.0 1.9
assign (resid   91 and  name HG1* )(resid   79 and  name HG1   ) 3.5 2.2 1.8
assign (resid   91 and  name HG1* )(resid   81 and  name HA    ) 3.5 1.5 1.5
assign (resid   91 and  name HG1* )(resid   81 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   91 and  name HG1* )(resid   90 and  name HA    ) 4.0 1.0 1.5
!assign (resid   91 and  name HG1* )(resid   90 and  name HB1   ) 3.5 1.5 1.5
!assign (resid   91 and  name HG1* )(resid   90 and  name HB2   ) 3.5 1.0 1.5
assign (resid   91 and  name HG1* )(resid   99 and  name HN    ) 3.5 2.2 1.5
assign (resid   91 and  name HG1* )(resid   99 and  name HB1   ) 3.5 2.2 1.5
assign (resid   91 and  name HG1* )(resid   99 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   91 and  name HG1* )(resid   99 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   91 and  name HG2* )(resid   81 and  name HA    ) 3.5 1.0 1.5
!assign (resid   91 and  name HG2* )(resid   81 and  name HD2*  ) 3.5 1.5 1.5
!assign (resid   91 and  name HG2* )(resid   90 and  name HA    ) 4.0 1.0 1.9
assign (resid   91 and  name HG2* )(resid   99 and  name HD1*  ) 4.0 1.0 2.0
!Q92
!intra
!assign (resid   92 and  name HN   )(resid   92 and  name HA    ) 3.0 1.0 1.0
!assign (resid   92 and  name HN   )(resid   92 and  name HG#   ) 2.5 0.7 1.5
!assign (resid   92 and  name HN   )(resid   92 and  name HB#   ) 3.0 1.0 1.2
!assign (resid   92 and  name HA   )(resid   92 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   92 and  name HA   )(resid   92 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   92 and  name HA   )(resid   92 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   92 and  name HB1  )(resid   92 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   92 and  name HB1  )(resid   92 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   92 and  name HG1  )(resid   92 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   92 and  name HG1  )(resid   92 and  name HG2   ) 3.5 2.2 1.5
!inter
assign (resid   92 and  name HN   )(resid   93 and  name HN    ) 4.0 1.0 1.0
assign (resid   92 and  name HN   )(resid   91 and  name HB    ) 4.0 1.0 1.0
assign (resid   92 and  name HN   )(resid   91 and  name HG1*  ) 4.0 1.0 1.0
assign (resid   92 and  name HN   )(resid   91 and  name HG2*  ) 3.0 1.0 1.4
assign (resid   92 and  name HA   )(resid   98 and  name HA    ) 3.5 2.2 1.5
assign (resid   92 and  name HG1  )(resid   93 and  name HN    ) 4.0 1.0 1.5
assign (resid   92 and  name HG2  )(resid   93 and  name HN    ) 4.0 1.0 1.5
!K93
!intra
!assign (resid   93 and  name HN   )(resid   93 and  name HB#   ) 3.0 1.0 1.2
!assign (resid   93 and  name HA   )(resid   93 and  name HN    ) 3.5 1.5 1.5
!assign (resid   93 and  name HA   )(resid   93 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   93 and  name HA   )(resid   93 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   93 and  name HA   )(resid   93 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   93 and  name HA   )(resid   93 and  name HE#   ) 4.0 1.0 1.9
!assign (resid   93 and  name HB1  )(resid   93 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   93 and  name HB1  )(resid   93 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   93 and  name HB1  )(resid   93 and  name HE#   ) 3.5 1.5 1.9
!assign (resid   93 and  name HB2  )(resid   93 and  name HG#   ) 3.5 2.2 1.5
!assign (resid   93 and  name HB2  )(resid   93 and  name HE#   ) 3.5 2.2 1.5
!assign (resid   93 and  name HG#  )(resid   93 and  name HN    ) 3.5 2.2 1.5
!assign (resid   93 and  name HG#  )(resid   93 and  name HD#   ) 3.5 2.2 1.5
!assign (resid   93 and  name HG#  )(resid   93 and  name HE#   ) 3.5 2.2 1.5
!assign (resid   93 and  name HD1  )(resid   93 and  name HD2   ) 3.5 2.2 1.5
!assign (resid   93 and  name HD1  )(resid   93 and  name HE#   ) 3.5 2.2 1.5
!assign (resid   93 and  name HD2  )(resid   93 and  name HE#   ) 3.5 2.2 1.5
!inter
assign (resid   93 and  name HN   )(resid   97 and  name HN    ) 4.0 1.0 1.0
assign (resid   93 and  name HN   )(resid   98 and  name HA    ) 3.0 1.0 1.0
assign (resid   93 and  name HN   )(resid   92 and  name HA    ) 2.5 0.7 0.7
assign (resid   93 and  name HN   )(resid   92 and  name HB#   ) 3.5 2.0 1.0
assign (resid   93 and  name HN   )(resid   99 and  name HG    ) 4.0 1.0 1.0
!assign (resid   93 and  name HA   )(resid   99 and  name HD1*  ) 4.0 1.0 1.9
assign (resid   93 and  name HB1  )(resid   99 and  name HG    ) 3.5 1.0 1.5
!assign (resid   93 and  name HB1  )(resid   99 and  name HD1*  ) 4.0 1.0 1.9
!assign (resid   93 and  name HB2  )(resid   99 and  name HD1*  ) 4.0 1.0 1.9
assign (resid   93 and  name HG#  )(resid   99 and  name HG    ) 3.5 2.2 1.5
assign (resid   93 and  name HG#  )(resid   99 and  name HD1*  ) 4.0 1.0 2.0
!assign (resid   93 and  name HG#  )(resid   99 and  name HD2*  ) 3.5 1.0 1.5
assign (resid   93 and  name HD1  )(resid   99 and  name HG    ) 3.5 1.0 1.5
!assign (resid   93 and  name HD1  )(resid   99 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   93 and  name HD1  )(resid   99 and  name HD2*  ) 3.5 1.5 1.5
assign (resid   93 and  name HD2  )(resid   99 and  name HG    ) 3.5 1.0 1.5
assign (resid   93 and  name HD2  )(resid   99 and  name HD1*  ) 4.0 1.0 1.5
assign (resid   93 and  name HD2  )(resid   99 and  name HD2*  ) 4.0 1.0 2.0
assign (resid   93 and  name HE#  )(resid   99 and  name HG    ) 4.0 1.0 1.5
assign (resid   93 and  name HE#  )(resid   99 and  name HD1*  ) 4.0 1.0 2.0
assign (resid   93 and  name HE#  )(resid   99 and  name HD2*  ) 4.0 1.0 2.0
!G94
!intra
!assign (resid   94 and  name HA1  )(resid   94 and  name HA2   ) 3.5 2.2 1.5
!D95
!intra
!assign (resid   95 and  name HA   )(resid   95 and  name HB1   ) 3.5 2.2 1.5
!assign (resid   95 and  name HA   )(resid   95 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   95 and  name HB1  )(resid   95 and  name HB2   ) 3.5 2.2 1.5
!G96
!intra
!assign (resid   96 and  name HN   )(resid   96 and  name HA#   ) 3.0 1.0 1.0
!inter
assign (resid   96 and  name HN   )(resid   97 and  name HN    ) 2.5 1.2 0.5
assign (resid   96 and  name HN   )(resid   95 and  name HN    ) 3.0 1.0 1.0
assign (resid   96 and  name HN   )(resid   95 and  name HB#   ) 3.0 1.0 1.5
!G97
!intra
!assign (resid   97 and  name HN   )(resid   97 and  name HA#   ) 3.0 1.0 0.5
!assign (resid   97 and  name HA1  )(resid   97 and  name HA2   ) 3.5 2.2 1.5
!inter
assign (resid   97 and  name HN   )(resid   98 and  name HN    ) 4.0 1.0 1.0
assign (resid   97 and  name HN   )(resid   96 and  name HA#   ) 3.0 0.7 1.0
assign (resid   97 and  name HN   )(resid   93 and  name HB#   ) 4.0 1.0 1.0
assign (resid   97 and  name HA1  )(resid   93 and  name HD2   ) 4.0 1.0 1.5
!assign (resid   97 and  name HA2  )(resid   93 and  name HB1   ) 3.5 1.0 1.5
assign (resid   97 and  name HA2  )(resid   93 and  name HD1   ) 4.0 1.0 1.5
assign (resid   97 and  name HA2  )(resid   93 and  name HE#   ) 4.0 1.0 1.5
assign (resid   97 and  name HA2  )(resid   98 and  name HG#   ) 4.0 1.0 1.5
!Q98
!intra
!assign (resid   98 and  name HN   )(resid   98 and  name HA    ) 3.0 1.0 1.0
!assign (resid   98 and  name HN   )(resid   98 and  name HG#   ) 4.0 1.0 1.0
!assign (resid   98 and  name HN   )(resid   98 and  name HB#   ) 2.5 0.7 1.2
!assign (resid   98 and  name HA   )(resid   98 and  name HB#   ) 3.5 2.2 1.5
!assign (resid   98 and  name HA   )(resid   98 and  name HG1   ) 3.5 2.2 1.5
!assign (resid   98 and  name HA   )(resid   98 and  name HG2   ) 3.5 2.2 1.5
!assign (resid   98 and  name HB1  )(resid   98 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   98 and  name HG1  )(resid   98 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   98 and  name HG1  )(resid   98 and  name HG2   ) 3.5 2.2 1.5
assign (resid   98 and  name HG#  )(resid   98 and  name HE2#  ) 3.5 2.2 1.5
!inter
assign (resid   98 and  name HN   )(resid   99 and  name HN    ) 4.0 1.0 1.0
assign (resid   98 and  name HN   )(resid   19 and  name HA    ) 4.0 1.0 1.0
assign (resid   98 and  name HN   )(resid   97 and  name HA#   ) 2.5 0.7 1.0
assign (resid   98 and  name HA   )(resid   91 and  name HG1*  ) 4.0 1.0 1.9
assign (resid   98 and  name HA   )(resid   93 and  name HG#   ) 4.0 1.0 2.0
assign (resid   98 and  name HA   )(resid   99 and  name HB1   ) 4.0 1.0 1.5
assign (resid   98 and  name HA   )(resid   99 and  name HG    ) 4.0 1.0 1.5
assign (resid   98 and  name HA   )(resid   99 and  name HD1*  ) 4.0 1.0 1.9
assign (resid   98 and  name HA   )(resid   99 and  name HD2*  ) 4.0 1.0 1.9
assign (resid   98 and  name HB1  )(resid   20 and  name HB1   ) 4.0 1.0 1.9
assign (resid   98 and  name HB1  )(resid   99 and  name HN    ) 3.5 2.2 1.5
assign (resid   98 and  name HB1  )(resid  100 and  name HG2*  ) 4.0 1.0 2.0
assign (resid   98 and  name HB2  )(resid   97 and  name HA1   ) 4.0 1.0 1.5
assign (resid   98 and  name HB2  )(resid   99 and  name HN    ) 3.5 2.2 1.5
assign (resid   98 and  name HB2  )(resid  100 and  name HG2*  ) 3.5 1.5 1.5
assign (resid   98 and  name HG1  )(resid  100 and  name HG2*  ) 3.5 1.5 1.5
assign (resid   98 and  name HG2  )(resid  100 and  name HG2*  ) 4.0 1.0 2.0
!L99
!intra
!assign (resid   99 and  name HN   )(resid   91 and  name HN    ) 2.5 0.7 1.0
!assign (resid   99 and  name HN   )(resid   99 and  name HB#   ) 3.0 1.0 1.2
!assign (resid   99 and  name HN   )(resid   99 and  name HG    ) 3.0 1.0 1.0
!assign (resid   99 and  name HN   )(resid   99 and  name HD1*  ) 4.0 1.0 1.0
!assign (resid   99 and  name HN   )(resid   99 and  name HD2*  ) 4.0 1.0 1.0
!assign (resid   99 and  name HA   )(resid   99 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   99 and  name HB1  )(resid   99 and  name HB2   ) 3.5 2.2 1.5
!assign (resid   99 and  name HB1  )(resid   99 and  name HG    ) 3.5 2.2 1.5
!assign (resid   99 and  name HB1  )(resid   99 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   99 and  name HB1  )(resid   99 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   99 and  name HB2  )(resid   99 and  name HG    ) 3.5 2.2 1.5
!assign (resid   99 and  name HB2  )(resid   99 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   99 and  name HB2  )(resid   99 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   99 and  name HG   )(resid   99 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   99 and  name HG   )(resid   99 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid   99 and  name HD1* )(resid   99 and  name HD2*  ) 3.5 2.2 1.5
!inter
assign (resid   99 and  name HN   )(resid   90 and  name HA    ) 4.0 1.0 1.0
assign (resid   99 and  name HN   )(resid   98 and  name HA    ) 2.5 0.7 0.7
assign (resid   99 and  name HN   )(resid   98 and  name HG#   ) 3.0 1.0 1.0
assign (resid   99 and  name HA   )(resid  100 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid   99 and  name HB1  )(resid   17 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid   99 and  name HB1  )(resid   98 and  name HB2   ) 4.0 1.0 1.5
assign (resid   99 and  name HB2  )(resid   17 and  name HD1*  ) 3.5 2.2 1.5
assign (resid   99 and  name HB2  )(resid   91 and  name HG1*  ) 3.5 1.5 1.5
!assign (resid   99 and  name HB2  )(resid   98 and  name HB2   ) 4.0 1.0 1.5
!assign (resid   99 and  name HD1* )(resid   79 and  name HB1   ) 4.0 1.0 1.5
assign (resid   99 and  name HD1* )(resid   79 and  name HG1   ) 4.0 1.0 1.5
!assign (resid   99 and  name HD1* )(resid   90 and  name HB1   ) 3.5 2.2 1.5
assign (resid   99 and  name HD2* )(resid   53 and  name HE1   ) 4.0 1.0 1.5
!assign (resid   99 and  name HD2* )(resid   81 and  name HG    ) 4.0 1.0 1.9
!assign (resid   99 and  name HD2* )(resid   98 and  name HB2   ) 3.5 1.5 1.5
!V100
!intra
!assign (resid  100 and  name HN   )(resid  100 and  name HA    ) 3.0 1.0 1.0
!assign (resid  100 and  name HA   )(resid  100 and  name HB    ) 3.5 2.2 1.5
!assign (resid  100 and  name HA   )(resid  100 and  name HG1*  ) 3.5 2.2 1.5
!assign (resid  100 and  name HA   )(resid  100 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid  100 and  name HB   )(resid  100 and  name HN    ) 3.5 2.2 1.5
!assign (resid  100 and  name HB   )(resid  100 and  name HG1*  ) 3.5 2.2 1.5
!assign (resid  100 and  name HB   )(resid  100 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid  100 and  name HG1* )(resid  100 and  name HN    ) 3.5 1.5 1.5
!assign (resid  100 and  name HG1* )(resid  100 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid  100 and  name HG2* )(resid  100 and  name HN    ) 3.5 2.2 1.5
!inter
assign (resid  100 and  name HN   )(resid   19 and  name HN    ) 4.0 1.0 1.5
assign (resid  100 and  name HN   )(resid  101 and  name HN    ) 4.0 1.0 1.0
assign (resid  100 and  name HN   )(resid   18 and  name HN    ) 2.5 0.7 0.7  !Strong
assign (resid  100 and  name HN   )(resid   17 and  name HA    ) 4.0 1.0 1.0
assign (resid  100 and  name HN   )(resid   99 and  name HA    ) 2.5 0.7 0.7
assign (resid  100 and  name HN   )(resid   99 and  name HB#   ) 3.5 1.2 1.2
assign (resid  100 and  name HN   )(resid   99 and  name HG    ) 4.0 1.0 1.0
assign (resid  100 and  name HN   )(resid   99 and  name HD1*  ) 4.0 1.0 2.0
assign (resid  100 and  name HN   )(resid   99 and  name HD2*  ) 4.0 1.0 1.0
assign (resid  100 and  name HA   )(resid   90 and  name HG1   ) 3.5 2.2 1.5
assign (resid  100 and  name HA   )(resid   90 and  name HG2   ) 3.5 1.5 1.5
assign (resid  100 and  name HA   )(resid   90 and  name HD2   ) 4.0 1.0 2.0
assign (resid  100 and  name HA   )(resid   98 and  name HG2   ) 3.5 1.5 1.5
assign (resid  100 and  name HB   )(resid   18 and  name HN    ) 3.5 1.0 1.5
assign (resid  100 and  name HG1* )(resid   18 and  name HN    ) 4.0 1.0 1.5
assign (resid  100 and  name HG1* )(resid   88 and  name HB#   ) 3.5 2.2 1.5
!assign (resid  100 and  name HG1* )(resid   89 and  name HA    ) 4.0 1.0 1.5
!assign (resid  100 and  name HG1* )(resid   90 and  name HN    ) 4.0 1.0 1.5
assign (resid  100 and  name HG1* )(resid   90 and  name HA    ) 4.0 1.0 2.0
!assign (resid  100 and  name HG1* )(resid   98 and  name HG2   ) 4.0 1.0 1.5
assign (resid  100 and  name HG1* )(resid  101 and  name HA    ) 4.0 1.0 1.5
assign (resid  100 and  name HG2* )(resid   18 and  name HN    ) 4.0 1.0 1.5
!assign (resid  100 and  name HG2* )(resid   88 and  name HB#   ) 3.5 2.2 1.5
assign (resid  100 and  name HG2* )(resid  101 and  name HN    ) 4.0 1.0 1.5
!L101
!intra
!assign (resid  101 and  name HN   )(resid  101 and  name HA    ) 3.0 1.0 1.0
!assign (resid  101 and  name HN   )(resid  101 and  name HB#   ) 2.5 0.5 1.0
!assign (resid  101 and  name HN   )(resid  101 and  name HG    ) 4.0 1.0 1.0
!assign (resid  101 and  name HN   )(resid  101 and  name HD1*  ) 4.0 1.0 1.0
!assign (resid  101 and  name HA   )(resid  101 and  name HB1   ) 3.5 2.2 1.5
!assign (resid  101 and  name HA   )(resid  101 and  name HB2   ) 3.5 2.2 1.5
!assign (resid  101 and  name HA   )(resid  101 and  name HG    ) 3.5 2.2 1.5
!assign (resid  101 and  name HA   )(resid  101 and  name HD1*  ) 3.5 1.5 1.5
!assign (resid  101 and  name HA   )(resid  101 and  name HD2*  ) 3.5 1.5 1.5
!assign (resid  101 and  name HB1  )(resid  101 and  name HB2   ) 3.5 2.2 1.5
!assign (resid  101 and  name HB1  )(resid  101 and  name HG    ) 3.5 2.2 1.5
!assign (resid  101 and  name HB1  )(resid  101 and  name HD1*  ) 3.5 1.5 1.5
!assign (resid  101 and  name HB1  )(resid  101 and  name HD2*  ) 3.5 1.5 1.5
!assign (resid  101 and  name HB2  )(resid  101 and  name HG    ) 3.5 2.2 1.5
!assign (resid  101 and  name HB2  )(resid  101 and  name HD1*  ) 3.5 1.5 1.5
!assign (resid  101 and  name HB2  )(resid  101 and  name HD2*  ) 3.5 1.5 1.5
!assign (resid  101 and  name HG   )(resid  101 and  name HD1*  ) 3.5 2.2 1.5
!assign (resid  101 and  name HG   )(resid  101 and  name HD2*  ) 3.5 2.2 1.5
!assign (resid  101 and  name HD1* )(resid  101 and  name HD2*  ) 3.5 2.2 1.5
!inter
assign (resid  101 and  name HN   )(resid   89 and  name HN    ) 3.0 0.5 0.7  !Strong
assign (resid  101 and  name HN   )(resid   90 and  name HA    ) 3.5 0.8 0.5
assign (resid  101 and  name HN   )(resid   17 and  name HA    ) 4.0 1.0 1.0
assign (resid  101 and  name HN   )(resid   89 and  name HA    ) 4.0 1.0 1.0
assign (resid  101 and  name HN   )(resid  100 and  name HA    ) 2.5 0.7 0.5
assign (resid  101 and  name HN   )(resid   89 and  name HB#   ) 3.5 0.5 1.5
assign (resid  101 and  name HN   )(resid  100 and  name HB    ) 4.0 1.0 1.0
assign (resid  101 and  name HN   )(resid  100 and  name HG1*  ) 4.0 1.5 1.0
assign (resid  101 and  name HN   )(resid   81 and  name HD2*  ) 3.5 1.0 1.5
assign (resid  101 and  name HA   )(resid   15 and  name HB2   ) 4.0 1.0 1.5
assign (resid  101 and  name HB1  )(resid   17 and  name HA    ) 4.0 1.0 1.5
assign (resid  101 and  name HB1  )(resid   81 and  name HG    ) 3.5 1.5 1.5
assign (resid  101 and  name HB2  )(resid   17 and  name HD1*  ) 3.5 2.2 1.5
assign (resid  101 and  name HG   )(resid   15 and  name HB1   ) 3.5 2.2 1.5
assign (resid  101 and  name HG   )(resid   15 and  name HB2   ) 3.5 2.2 1.5
!assign (resid  101 and  name HD1* )(resid   17 and  name HN    ) 4.0 1.0 1.5
assign (resid  101 and  name HD1* )(resid   17 and  name HA    ) 4.0 1.0 1.5
assign (resid  101 and  name HD1* )(resid   30 and  name HD2*  ) 4.0 1.0 2.0
assign (resid  101 and  name HD1* )(resid   68 and  name HD1*  ) 4.0 1.0 2.0
!assign (resid  101 and  name HD1* )(resid   89 and  name HA    ) 4.0 1.0 1.5
assign (resid  101 and  name HD1* )(resid   89 and  name HB1   ) 4.0 1.0 1.5
!assign (resid  101 and  name HD1* )(resid   99 and  name HD2*  ) 3.5 2.2 2.5
assign (resid  101 and  name HD2* )(resid   16 and  name HN    ) 4.0 1.0 1.5
assign (resid  101 and  name HD2* )(resid   68 and  name HB    ) 3.5 1.5 1.5
assign (resid  101 and  name HD2* )(resid   81 and  name HB1   ) 4.0 1.0 2.0
assign (resid  101 and  name HD2* )(resid  102 and  name HN    ) 3.5 1.0 1.5
!R102
!intra
!assign (resid  102 and  name HA   )(resid  102 and  name HN    ) 3.5 2.2 1.5
!assign (resid  102 and  name HA   )(resid  102 and  name HB1   ) 3.5 2.2 1.5
!assign (resid  102 and  name HA   )(resid  102 and  name HB2   ) 3.5 2.2 1.5
!assign (resid  102 and  name HA   )(resid  102 and  name HG#   ) 3.5 2.2 1.5
!assign (resid  102 and  name HA   )(resid  102 and  name HD#   ) 3.5 2.2 1.5
!assign (resid  102 and  name HB1  )(resid  102 and  name HN    ) 3.5 2.2 1.5
!assign (resid  102 and  name HB1  )(resid  102 and  name HB2   ) 3.5 2.2 1.5
!assign (resid  102 and  name HB1  )(resid  102 and  name HD#   ) 3.5 2.2 1.5
!assign (resid  102 and  name HB2  )(resid  102 and  name HN    ) 3.5 1.5 1.5
!assign (resid  102 and  name HB2  )(resid  102 and  name HD#   ) 3.5 2.2 1.5
!assign (resid  102 and  name HG1  )(resid  102 and  name HN    ) 3.5 1.0 1.5
!assign (resid  102 and  name HG1  )(resid  102 and  name HD#   ) 3.5 2.2 1.5
!assign (resid  102 and  name HG2  )(resid  102 and  name HN    ) 3.5 1.0 1.5
!assign (resid  102 and  name HG2  )(resid  102 and  name HD#   ) 3.5 2.2 1.5
!assign (resid  102 and  name HD#  )(resid  102 and  name HN    ) 4.0 1.0 1.5
!inter
assign (resid  102 and  name HN   )(resid  103 and  name HN    ) 4.0 1.0 1.0
assign (resid  102 and  name HN   )(resid  101 and  name HA    ) 2.5 0.7 0.5
assign (resid  102 and  name HN   )(resid   17 and  name HA    ) 3.5 1.0 1.0
assign (resid  102 and  name HN   )(resid   15 and  name HA    ) 4.0 1.0 1.0
assign (resid  102 and  name HN   )(resid   16 and  name HB    ) 4.0 1.0 1.0
assign (resid  102 and  name HN   )(resid   15 and  name HB#   ) 4.0 1.0 1.0
assign (resid  102 and  name HN   )(resid  101 and  name HB#   ) 4.0 1.0 1.0
assign (resid  102 and  name HN   )(resid  101 and  name HG    ) 3.0 1.0 1.2
!assign (resid  102 and  name HN   )(resid   17 and  name HA    ) 4.0 1.0 1.0 - reduntant
assign (resid  102 and  name HN   )(resid  100 and  name HG1*  ) 4.0 1.0 1.5
assign (resid  102 and  name HN   )(resid  101 and  name HD1*  ) 4.0 1.2 1.5
assign (resid  102 and  name HA   )(resid   15 and  name HA    ) 4.0 1.0 1.5
!assign (resid  102 and  name HA   )(resid   15 and  name HB2   ) 3.5 2.2 1.5
assign (resid  102 and  name HA   )(resid   16 and  name HN    ) 4.0 1.0 1.5
assign (resid  102 and  name HA   )(resid   88 and  name HB#   ) 4.0 1.0 1.5
assign (resid  102 and  name HA   )(resid  100 and  name HG1*  ) 4.0 1.0 2.0
!assign (resid  102 and  name HA   )(resid  101 and  name HD1*  ) 4.0 1.0 1.5
assign (resid  102 and  name HA   )(resid  101 and  name HD2*  ) 4.0 1.0 1.5
assign (resid  102 and  name HA   )(resid  103 and  name HB1   ) 4.0 1.0 1.7
assign (resid  102 and  name HA   )(resid  103 and  name HB2   ) 4.0 1.0 1.5
assign (resid  102 and  name HB1  )(resid  100 and  name HG1*  ) 4.0 1.0 2.0
assign (resid  102 and  name HB1  )(resid  103 and  name HN    ) 3.5 1.5 1.5
!assign (resid  102 and  name HB2  )(resid   15 and  name HA    ) 4.0 1.0 1.5
assign (resid  102 and  name HB2  )(resid   88 and  name HA    ) 3.5 1.0 1.5
assign (resid  102 and  name HB2  )(resid  100 and  name HG1*  ) 3.5 1.5 1.5
assign (resid  102 and  name HB2  )(resid  103 and  name HN    ) 3.5 2.2 1.5
!assign (resid  102 and  name HG1  )(resid   15 and  name HA    ) 4.0 1.0 1.5
assign (resid  102 and  name HG1  )(resid  100 and  name HG1*  ) 3.5 2.2 1.5
assign (resid  102 and  name HG1  )(resid  103 and  name HN    ) 4.0 1.0 1.5
!assign (resid  102 and  name HG1  )(resid   15 and  name HA    ) 4.0 1.0 1.5 - reduntant
!assign (resid  102 and  name HG1  )(resid   88 and  name HA    ) 4.0 1.0 1.5 - reduntant
!assign (resid  102 and  name HD#  )(resid   15 and  name HA    ) 4.0 1.0 1.5
!assign (resid  102 and  name HD#  )(resid   88 and  name HA    ) 4.0 1.0 1.5
assign (resid  102 and  name HD#  )(resid  100 and  name HG1*  ) 4.0 1.0 2.0
assign (resid  102 and  name HD#  )(resid  103 and  name HN    ) 4.0 1.0 1.5
!R103
!intra
!assign (resid  103 and  name HN   )(resid  103 and  name HA    ) 2.5 0.5 1.0
!assign (resid  103 and  name HN   )(resid  103 and  name HB#   ) 3.0 1.0 1.2
!assign (resid  103 and  name HA   )(resid  103 and  name HB1   ) 3.5 2.2 1.5
!assign (resid  103 and  name HA   )(resid  103 and  name HB2   ) 3.5 2.2 1.5
!assign (resid  103 and  name HA   )(resid  103 and  name HG#   ) 3.5 2.2 1.5
!assign (resid  103 and  name HA   )(resid  103 and  name HD1   ) 4.0 1.0 1.5
!assign (resid  103 and  name HA   )(resid  103 and  name HD2   ) 4.0 1.0 1.5
!assign (resid  103 and  name HB1  )(resid  103 and  name HB2   ) 3.5 2.2 1.5
!assign (resid  103 and  name HB1  )(resid  103 and  name HG#   ) 3.5 2.2 1.5
!assign (resid  103 and  name HB1  )(resid  103 and  name HD1   ) 3.5 2.2 1.5
!assign (resid  103 and  name HB1  )(resid  103 and  name HD2   ) 3.5 2.2 1.5
!assign (resid  103 and  name HB2  )(resid  103 and  name HG#   ) 3.5 2.2 1.5
!assign (resid  103 and  name HB2  )(resid  103 and  name HD1   ) 3.5 1.5 1.5
!assign (resid  103 and  name HB2  )(resid  103 and  name HD2   ) 3.5 1.5 1.5
!assign (resid  103 and  name HG#  )(resid  103 and  name HN    ) 3.5 2.2 1.5
!assign (resid  103 and  name HG#  )(resid  103 and  name HD1   ) 3.5 2.2 1.5
!assign (resid  103 and  name HG#  )(resid  103 and  name HD2   ) 3.5 2.2 1.5
!assign (resid  103 and  name HD1  )(resid  103 and  name HD2   ) 3.5 2.2 1.5
!inter
assign (resid  103 and  name HN   )(resid  104 and  name HN    ) 4.0 1.0 1.0
assign (resid  103 and  name HN   )(resid   16 and  name HN    ) 4.0 1.0 1.0
!assign (resid  103 and  name HN   )(resid   16 and  name HA    ) 4.0 1.0 1.0
assign (resid  103 and  name HN   )(resid  102 and  name HA    ) 2.5 0.7 0.5
assign (resid  103 and  name HN   )(resid   15 and  name HA    ) 4.0 1.0 1.0
assign (resid  103 and  name HN   )(resid   87 and  name HA#   ) 4.0 1.0 1.0
assign (resid  103 and  name HA   )(resid   15 and  name HN    ) 4.0 1.0 1.5
assign (resid  103 and  name HA   )(resid   16 and  name HN    ) 3.5 1.5 1.5
assign (resid  103 and  name HA   )(resid  102 and  name HA    ) 4.0 1.0 1.5
assign (resid  103 and  name HA   )(resid  104 and  name HA    ) 4.0 1.0 1.5
assign (resid  103 and  name HA   )(resid  104 and  name HB*   ) 3.5 2.2 1.5
!assign (resid  103 and  name HB1  )(resid   87 and  name HA2   ) 3.5 1.0 1.5
assign (resid  103 and  name HB1  )(resid  104 and  name HN    ) 3.5 1.5 1.5
!assign (resid  103 and  name HB2  )(resid   87 and  name HA2   ) 4.0 1.0 1.5
assign (resid  103 and  name HB2  )(resid  104 and  name HN    ) 4.0 1.0 1.5
assign (resid  103 and  name HG#  )(resid   15 and  name HA    ) 4.0 1.0 1.5
assign (resid  103 and  name HD1  )(resid   87 and  name HA2   ) 3.0 1.0 1.5
!assign (resid  103 and  name HD1  )(resid   88 and  name HN    ) 3.5 1.0 1.5
!assign (resid  103 and  name HD2  )(resid   88 and  name HN    ) 4.0 1.0 1.5
!A104
!intra
!assign (resid  104 and  name HN   )(resid  104 and  name HA    ) 3.0 1.0 1.0
!assign (resid  104 and  name HN   )(resid  104 and  name HB*   ) 2.5 0.7 1.5
!assign (resid  104 and  name HA   )(resid  104 and  name HB*   ) 3.5 2.2 1.5
!inter
assign (resid  104 and  name HN   )(resid   14 and  name HN    ) 4.0 1.0 1.0
assign (resid  104 and  name HN   )(resid   15 and  name HA    ) 2.5 0.7 1.0
assign (resid  104 and  name HN   )(resid  103 and  name HA    ) 2.5 0.7 0.8
assign (resid  104 and  name HN   )(resid   14 and  name HG#   ) 4.0 1.0 1.5
assign (resid  104 and  name HN   )(resid   14 and  name HB#   ) 3.5 1.0 1.0
assign (resid  104 and  name HN   )(resid   16 and  name HG2*  ) 4.0 1.0 1.5
assign (resid  104 and  name HA   )(resid   15 and  name HA    ) 4.0 1.0 1.5
assign (resid  104 and  name HB*  )(resid   14 and  name HG2   ) 3.5 2.2 1.5
assign (resid  104 and  name HB*  )(resid   15 and  name HN    ) 4.0 1.0 1.5
assign (resid  104 and  name HB*  )(resid   16 and  name HN    ) 4.0 1.0 1.5
!assign (resid  104 and  name HB*  )(resid  103 and  name HG#   ) 3.5 1.0 1.5
assign (resid  104 and  name HB*  )(resid  105 and  name HN    ) 4.0 1.0 1.5
assign (resid  104 and  name HN   )(resid   15 and  name HB#   ) 4.0 1.0 1.0
!T105
!intra
!assign (resid  105 and  name HA   )(resid  105 and  name HN    ) 4.0 1.0 1.5
!assign (resid  105 and  name HA   )(resid  105 and  name HB    ) 3.5 2.2 1.5
!assign (resid  105 and  name HA   )(resid  105 and  name HG2*  ) 3.5 2.2 1.5
!assign (resid  105 and  name HB   )(resid  105 and  name HN    ) 4.0 1.0 1.5
!assign (resid  105 and  name HB   )(resid  105 and  name HG2*  ) 3.5 2.2 1.5
!inter
assign (resid  105 and  name HN   )(resid  104 and  name HA    ) 2.5 0.7 0.5
!hydrogen bonds
assign (resid   15 and  name N    )(resid   28 and  name O    ) 3.3 0.8 0.2
assign (resid   15 and  name HN   )(resid   28 and  name O    ) 2.3 0.8 0.2
!assign (resid   15 and  name NE1  )(resid   11 and  name O    ) 3.3 0.8 0.7
!assign (resid   15 and  name HE1  )(resid   11 and  name O    ) 2.3 0.8 0.7
assign (resid   16 and  name N    )(resid  102 and  name O    ) 3.3 0.8 0.2
assign (resid   16 and  name HN   )(resid  102 and  name O    ) 2.3 0.8 0.2
assign (resid   17 and  name N    )(resid   26 and  name O    ) 3.3 0.8 0.2
assign (resid   17 and  name HN   )(resid   26 and  name O    ) 2.3 0.8 0.2
assign (resid   28 and  name N    )(resid   15 and  name O    ) 3.3 0.8 0.2
assign (resid   28 and  name HN   )(resid   15 and  name O    ) 2.3 0.8 0.2
!assign (resid   30 and  name N    )(resid   13 and  name O    ) 3.3 0.8 0.5
!assign (resid   30 and  name HN   )(resid   13 and  name O    ) 2.3 0.8 0.5
assign (resid   31 and  name N    )(resid   42 and  name O    ) 3.3 0.8 0.2
assign (resid   31 and  name HN   )(resid   42 and  name O    ) 2.3 0.8 0.2
assign (resid   41 and  name N    )(resid   61 and  name O    ) 3.3 0.8 0.2
assign (resid   41 and  name HN   )(resid   61 and  name O    ) 2.3 0.8 0.2
assign (resid   43 and  name N    )(resid   59 and  name O    ) 3.3 0.8 0.2
assign (resid   43 and  name HN   )(resid   59 and  name O    ) 2.3 0.8 0.2
assign (resid   44 and  name N    )(resid   29 and  name O    ) 3.3 0.8 0.2
assign (resid   44 and  name HN   )(resid   29 and  name O    ) 2.6 0.8 0.2
assign (resid   61 and  name N    )(resid   41 and  name O    ) 3.3 0.8 0.2
assign (resid   61 and  name HN   )(resid   41 and  name O    ) 2.3 0.8 0.2
!assign (resid   61 and  name NE1  )(resid   31 and  name O    ) 3.3 0.8 0.2
!assign (resid   61 and  name HE1  )(resid   31 and  name O    ) 2.3 0.8 0.2
assign (resid   62 and  name N    )(resid   69 and  name O    ) 3.3 0.8 0.2
assign (resid   62 and  name HN   )(resid   69 and  name O    ) 2.3 0.8 0.2
assign (resid   68 and  name N    )(resid   81 and  name O    ) 3.3 0.8 0.2
assign (resid   68 and  name HN   )(resid   81 and  name O    ) 2.3 0.8 0.2
assign (resid   69 and  name N    )(resid   62 and  name O    ) 3.3 0.8 0.2
assign (resid   69 and  name HN   )(resid   62 and  name O    ) 2.3 0.8 0.2
assign (resid   70 and  name N    )(resid   79 and  name O    ) 3.3 0.8 0.2
assign (resid   70 and  name HN   )(resid   79 and  name O    ) 2.3 0.8 0.2
assign (resid   71 and  name N    )(resid   60 and  name O    ) 3.3 0.8 0.2
assign (resid   71 and  name HN   )(resid   60 and  name O    ) 2.3 0.8 0.2
assign (resid   81 and  name N    )(resid   68 and  name O    ) 3.3 0.8 0.2
assign (resid   81 and  name HN   )(resid   68 and  name O    ) 2.3 0.8 0.2
assign (resid  100 and  name N    )(resid   18 and  name O    ) 3.3 0.8 0.2
assign (resid  100 and  name HN   )(resid   18 and  name O    ) 2.3 0.8 0.2
assign (resid  101 and  name N    )(resid   89 and  name O    ) 3.3 0.8 0.2
assign (resid  101 and  name HN   )(resid   89 and  name O    ) 2.3 0.8 0.2
assign (resid  102 and  name N    )(resid   16 and  name O    ) 3.3 0.8 0.2
assign (resid  102 and  name HN   )(resid   16 and  name O    ) 2.3 0.8 0.5
set echo=true end
set wrnlev=5 end
!## DIHEs

set message=off echo=off end
!!
!! Phi restraints: minimum deviation = 30 degrees

  !!    7 
 assign (resid   6 and name c )   (resid   7 and name n )
        (resid   7 and name ca)   (resid   7 and name c )  1.0 -92.95 40.0 2
  !!    8 
 assign (resid   7 and name c )   (resid   8 and name n ) 
        (resid   8 and name ca)   (resid   8 and name c )  1.0 -59.49 35.0 2
  !!    9
 assign (resid   8 and name c )   (resid   9 and name n ) 
        (resid   9 and name ca)   (resid   9 and name c )  1.0 -64.01 80.0 2
  !!    10
 assign (resid   9 and name c )   (resid   10 and name n ) 
        (resid   10 and name ca)   (resid   10 and name c )  1.0 -69.41 30.0 2
  !!    15
 assign (resid   14 and name c )   (resid   15 and name n ) 
        (resid   15 and name ca)   (resid   15 and name c )  1.0 -124.48 50.0 2
  !!    16 
 assign (resid   15 and name c )   (resid   16 and name n ) 
        (resid   16 and name ca)   (resid   16 and name c )  1.0 -126.14 55.0 2
  !!    17 
 assign (resid   16 and name c )   (resid   17 and name n ) 
        (resid   17 and name ca)   (resid   17 and name c )  1.0 -123.49 35.0 2
  !!    18
 assign (resid   17 and name c )   (resid   18 and name n ) 
        (resid   18 and name ca)   (resid   18 and name c )  1.0 -139.34 60.0 2
  !!    19 
 assign (resid   18 and name c )   (resid   19 and name n ) 
        (resid   19 and name ca)   (resid   19 and name c )  1.0 -109.05 35.0 2
  !!    25 
 assign (resid   24 and name c )   (resid   25 and name n ) 
        (resid   25 and name ca)   (resid   25 and name c )  1.0 -107.85 30.0 2
  !!    26 
 assign (resid   25 and name c )   (resid   26 and name n ) 
        (resid   26 and name ca)   (resid   26 and name c )  1.0 -126.67 30.0 2
  !!    27 
 assign (resid   26 and name c )   (resid   27 and name n ) 
        (resid   27 and name ca)   (resid   27 and name c )  1.0 -86.56 30.0 2
  !!    28 
 assign (resid   27 and name c )   (resid   28 and name n ) 
        (resid   28 and name ca)   (resid   28 and name c )  1.0 -119.83 30.0 2
  !!    29
 assign (resid   28 and name c )   (resid   29 and name n ) 
        (resid   29 and name ca)   (resid   29 and name c )  1.0 -127.02 30.0 2
  !!    35 
 assign (resid   34 and name c )   (resid   35 and name n ) 
        (resid   35 and name ca)   (resid   35 and name c )  1.0 -87.70 60.0 2
  !!    36 
 assign (resid   35 and name c )   (resid   36 and name n ) 
        (resid   36 and name ca)   (resid   36 and name c )  1.0 -61.29 30.0 2
  !!    37
 assign (resid   36 and name c )   (resid   37 and name n ) 
        (resid   37 and name ca)   (resid   37 and name c )  1.0 -65.22 30.0 2
  !!    41
 assign (resid   40 and name c )   (resid   41 and name n ) 
        (resid   41 and name ca)   (resid   41 and name c )  1.0 -105.02 30.0 2
  !!    42 
 assign (resid   41 and name c )   (resid   42 and name n ) 
        (resid   42 and name ca)   (resid   42 and name c )  1.0 -118.05 60.0 2
  !!    43 
 assign (resid   42 and name c )   (resid   43 and name n ) 
        (resid   43 and name ca)   (resid   43 and name c )  1.0 -130.53 35.0 2
  !!    44 
 assign (resid   43 and name c )   (resid   44 and name n ) 
        (resid   44 and name ca)   (resid   44 and name c )  1.0 -126.83 45.0 2
  !!    47
 assign (resid   46 and name c )   (resid   47 and name n ) 
        (resid   47 and name ca)   (resid   47 and name c )  1.0 -62.55 30.0 2
  !!    48
 assign (resid   47 and name c )   (resid   48 and name n ) 
        (resid   48 and name ca)   (resid   48 and name c )  1.0 -68.37 30.0 2
  !!    50
 assign (resid   49 and name c )   (resid   50 and name n ) 
        (resid   50 and name ca)   (resid   50 and name c )  1.0 -71.12 45.0 2
  !!    53 
 assign (resid   52 and name c )   (resid   53 and name n ) 
        (resid   53 and name ca)   (resid   53 and name c )  1.0 -92.98 40.0 2
  !! 60
assign (resid   59 and name c )   (resid   60 and name n ) 
       (resid   60 and name ca)   (resid   60 and name c )  1.0 -138.69 50.0 2
  !! 61
assign (resid   60 and name c )   (resid   61 and name n ) 
       (resid   61 and name ca)   (resid   61 and name c )  1.0 -130.40 50.0 2
  !! 62
assign (resid   61 and name c )   (resid   62 and name n ) 
       (resid   62 and name ca)   (resid   62 and name c )  1.0 -130.44 50.0 2
  !! 64
assign (resid   63 and name c )   (resid   64 and name n ) 
       (resid   64 and name ca)   (resid   64 and name c )  1.0 -103.97 50.0 2
  !! 68
assign (resid   67 and name c )   (resid   68 and name n ) 
       (resid   68 and name ca)   (resid   68 and name c )  1.0 -130.19 50.0 2
  !! 69
assign (resid   68 and name c )   (resid   69 and name n ) 
       (resid   69 and name ca)   (resid   69 and name c )  1.0 -113.57 50.0 2
  !! 71
assign (resid   70 and name c )   (resid   71 and name n ) 
       (resid   71 and name ca)   (resid   71 and name c )  1.0 -112.24 50.0 2
  !! 72
assign (resid   71 and name c )   (resid   72 and name n ) 
       (resid   72 and name ca)   (resid   72 and name c )  1.0 -89.08 50.0 2
  !! 73
!assign (resid   72 and name c )   (resid   73 and name n ) 
!       (resid   73 and name ca)   (resid   73 and name c )  1.0 -59.37 50.0 2
  !! 76
!assign (resid   75 and name c )   (resid   76 and name n ) 
!       (resid   76 and name ca)   (resid   76 and name c )  1.0 -70.93 70.0 2
  !! 77
assign (resid   76 and name c )   (resid   77 and name n ) 
       (resid   77 and name ca)   (resid   77 and name c )  1.0 -70.69 50.0 2
  !! 78
assign (resid   77 and name c )   (resid   78 and name n ) 
       (resid   78 and name ca)   (resid   78 and name c )  1.0 -106.19 50.0 2
  !! 79
assign (resid   78 and name c )   (resid   79 and name n ) 
       (resid   79 and name ca)   (resid   79 and name c )  1.0 -144.45 50.0 2
  !! 80
assign (resid   79 and name c )   (resid   80 and name n ) 
       (resid   80 and name ca)   (resid   80 and name c )  1.0 -116.15 50.0 2
  !! 81
assign (resid   80 and name c )   (resid   81 and name n )
       (resid   81 and name ca)   (resid   81 and name c )  1.0 -114.18 50.0 2
  !! 83
assign (resid   82 and name c )   (resid   83 and name n ) 
       (resid   83 and name ca)   (resid   83 and name c )  1.0 -74.35 50.0 2
  !! 88
assign (resid   87 and name c )   (resid   88 and name n ) 
       (resid   88 and name ca)   (resid   88 and name c )  1.0 -108.92 50.0 2
  !! 89
assign (resid   88 and name c )   (resid   89 and name n ) 
       (resid   89 and name ca)   (resid   89 and name c )  1.0 -116.46 50.0 2
  !! 90
assign (resid   89 and name c )   (resid   90 and name n ) 
       (resid   90 and name ca)   (resid   90 and name c )  1.0 -132.74 50.0 2
  !! 91
assign (resid   90 and name c )   (resid   91 and name n ) 
       (resid   91 and name ca)   (resid   91 and name c )  1.0 -145.98 50.0 2
  !! 92
assign (resid   91 and name c )   (resid   92 and name n ) 
       (resid   92 and name ca)   (resid   92 and name c )  1.0 -103.39 50.0 2
  !! 98
!assign (resid   97 and name c )   (resid   98 and name n ) 
!       (resid   98 and name ca)   (resid   98 and name c )  1.0 -105.41 60.0 2
  !! 99
assign (resid   98 and name c )   (resid   99 and name n ) 
       (resid   99 and name ca)   (resid   99 and name c )  1.0 -99.99 50.0 2
  !! 100
assign (resid   99 and name c )   (resid   100 and name n ) 
       (resid  100 and name ca)   (resid   100 and name c )  1.0 -121.55 50.0 2
  !! 101
assign (resid   100 and name c )   (resid   101 and name n ) 
       (resid   101 and name ca)   (resid   101 and name c )  1.0 -120.86 50.0 2
  !! 102
assign (resid   101 and name c )   (resid   102 and name n ) 
       (resid   102 and name ca)   (resid   102 and name c )  1.0 -124.47 50.0 2
  !! 105
assign (resid   104 and name c )   (resid   105 and name n ) 
       (resid   105 and name ca)   (resid   105 and name c )  1.0 -83.49 50.0 2
 
set message=on echo=on end

set echo=false end
set wrnlev=0 end
!
!NH Residual Dipolar Couplings
!
assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 9    and name N   )
       ( resid 9    and name HN  )  -0.6484  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 10   and name N   )
       ( resid 10   and name HN  )  -17.6686 0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 11   and name N   )
       ( resid 11   and name HN  )  12.7246  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 12   and name N   )
       ( resid 12   and name HN  )  8.5101   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 13   and name N   )
       ( resid 13   and name HN  )  3.3230   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 14   and name N   )
       ( resid 14   and name HN  )  1.7020   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 15   and name N   )
       ( resid 15   and name HN  )  -2.0262  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 16   and name N   )
       ( resid 16   and name HN  )  -13.7783 0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 17   and name N   )
       ( resid 17   and name HN  )  -22.0452 0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 18   and name N   )
       ( resid 18   and name HN  )  -24.5578 0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 19   and name N   )
       ( resid 19   and name HN  )  -25.5303 0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 20   and name N   )
       ( resid 20   and name HN  )  -15.6424 0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 21   and name N   )
       ( resid 21   and name HN  )  5.1061   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 22   and name N   )
       ( resid 22   and name HN  )  0.1621   0.2000

!assign ( resid 600  and name OO  )
!       ( resid 600  and name Z   )
!       ( resid 600  and name X   )
!       ( resid 600  and name Y   )
!       ( resid 24   and name N   )
!       ( resid 24   and name HN  )  -0.5673  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 25   and name N   )
       ( resid 25   and name HN  )  -26.1787 0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 27   and name N   )
       ( resid 27   and name HN  )  -19.2085 0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 28   and name N   )
       ( resid 28   and name HN  )  2.8367  0.2000

!assign ( resid 600  and name OO  )
!       ( resid 600  and name Z   )
!       ( resid 600  and name X   )
!       ( resid 600  and name Y   )
!       ( resid 29   and name N   )
!       ( resid 29   and name HN  )  -0.4052  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 30   and name N   )
       ( resid 30   and name HN  )  2.8367   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 31   and name N   )
       ( resid 31   and name HN  )  -0.6484  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 32   and name N   )
       ( resid 32   and name HN  )  -16.2908  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 33   and name N   )
       ( resid 33   and name HN  )  2.6746   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 34   and name N   )
       ( resid 34   and name HN  )  18.8033  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 35   and name N   )
       ( resid 35   and name HN  )  -6.1597  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 36   and name N   )
       ( resid 36   and name HN  )  2.9988   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 37   and name N   )
       ( resid 37   and name HN  )  -17.0202  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 38   and name N   )
       ( resid 38   and name HN  )  -5.6734   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 39   and name N   )
       ( resid 39   and name HN  )  12.7246   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 40   and name N   )
       ( resid 40   and name HN  )  0.9726   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 41   and name N   )
       ( resid 41   and name HN  )  26.3408  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 42   and name N   )
       ( resid 42   and name HN  )  19.6948   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 43   and name N   )
       ( resid 43   and name HN  )  4.1335   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 44   and name N   )
       ( resid 44   and name HN  )  -0.7294   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 45   and name N   )
       ( resid 45   and name HN  )  6.1597   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 46   and name N   )
       ( resid 46   and name HN  )  3.6472   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 47   and name N   )
       ( resid 47   and name HN  )  12.8057  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 48   and name N   )
       ( resid 48   and name HN  )  -6.4028  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 49   and name N   )
       ( resid 49   and name HN  )  -0.8105  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 50   and name N   )
       ( resid 50   and name HN  )  22.9368  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 51   and name N   )
       ( resid 51   and name HN  )  -18.2360  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 52   and name N   )
       ( resid 52   and name HN  )  0.0810   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 53   and name N   )
       ( resid 53   and name HN  )  14.7509  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 54   and name N   )
       ( resid 54   and name HN  )  -24.2336  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 56   and name N   )
       ( resid 56   and name HN  )  -2.7557  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 57   and name N   )
       ( resid 57   and name HN  )  -0.3242  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 59   and name N   )
       ( resid 59   and name HN  )  -17.2634  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 60   and name N   )
       ( resid 60   and name HN  )  13.2920  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 61   and name N   )
       ( resid 61   and name HN  )  19.7759  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 62   and name N   )
       ( resid 62   and name HN  )  23.7473  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 64   and name N   )
       ( resid 64   and name HN  )  15.0751  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 67   and name N   )
       ( resid 67   and name HN  )  25.2061  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 68   and name N   )
       ( resid 68   and name HN  )  24.2336  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 69   and name N   )
       ( resid 69   and name HN  )  21.4779  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 70   and name N   )
       ( resid 70   and name HN  )  11.7521  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 71   and name N   )
       ( resid 71   and name HN  )  -6.5649  0.2000

!assign ( resid 600  and name OO  )
!       ( resid 600  and name Z   )
!       ( resid 600  and name X   )
!       ( resid 600  and name Y   )
!       ( resid 72   and name N   )
!       ( resid 72   and name HN  )  -27.7187  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 73   and name N   )
       ( resid 73   and name HN  )  -4.9440  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 74   and name N   )
       ( resid 74   and name HN  )  14.5888  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 75   and name N   )
       ( resid 75   and name HN  )  -17.9118  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 76   and name N   )
       ( resid 76   and name HN  )  -11.7521  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 77   and name N   )
       ( resid 77   and name HN  )  -22.2884  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 78   and name N   )
       ( resid 78   and name HN  )  1.7831    0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 79   and name N   )
       ( resid 79   and name HN  )  21.2348   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 80   and name N   )
       ( resid 80   and name HN  )  15.0751   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 81   and name N   )
       ( resid 81   and name HN  )  22.2884   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 82   and name N   )
       ( resid 82   and name HN  )  18.5601   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 83   and name N   )
       ( resid 83   and name HN  )  1.8641    0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 84   and name N   )
       ( resid 84   and name HN  )  -25.0440  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 85   and name N   )
       ( resid 85   and name HN  )  0.7294    0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 86   and name N   )
       ( resid 86   and name HN  )  -21.4779  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 88   and name N   )
       ( resid 88   and name HN  )  -15.1561  0.2000

!assign ( resid 600  and name OO  )
!       ( resid 600  and name Z   )
!       ( resid 600  and name X   )
!       ( resid 600  and name Y   )
!       ( resid 89   and name N   )
!       ( resid 89   and name HN  )  -30.7175  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 90   and name N   )
       ( resid 90   and name HN  )  -22.6126  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 91   and name N   )
       ( resid 91   and name HN  )  -17.7497  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 92   and name N   )
       ( resid 92   and name HN  )  -15.6424  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 93   and name N   )
       ( resid 93   and name HN  )  2.3504    0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 96   and name N   )
       ( resid 96   and name HN  )  8.8343    0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 97   and name N   )
       ( resid 97   and name HN  )  -5.5113   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 98   and name N   )
       ( resid 98   and name HN  )  -2.9178   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 99   and name N   )
       ( resid 99   and name HN  )  -22.9368  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 100  and name N   )
       ( resid 100  and name HN  )  -20.5053  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 101  and name N   )
       ( resid 101  and name HN  )  -27.3134  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 102  and name N   )
       ( resid 102  and name HN  )  -20.7485  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 103  and name N   )
       ( resid 103  and name HN  )  -21.5590  0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 104  and name N   )
       ( resid 104  and name HN  )  19.6138   0.2000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 105  and name N   )
       ( resid 105  and name HN  )  10.5363   0.2000
set echo=true end
set wrnlev=5 end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   SER   1           H1       SER   1  18.249  23.797  -3.476
    2    H2   SER   1           H2       SER   1  16.819  22.891  -3.334
    3    H3   SER   1           H3       SER   1  17.099  23.829  -4.722
    4    HA   SER   1           HA       SER   1  17.521  21.579  -5.306
    5    HB2  SER   1           HB3      SER   1  20.314  22.476  -4.849
    6    HB3  SER   1           HB2      SER   1  19.528  21.962  -6.338
    7    HG   SER   1           HG       SER   1  19.709  24.094  -6.613
    8    H    SER   2           H        SER   2  18.337  22.396  -2.114
    9    HA   SER   2           HA       SER   2  19.825  19.884  -1.624
   10    HB2  SER   2           HB3      SER   2  19.489  22.445  -0.247
   11    HB3  SER   2           HB2      SER   2  19.331  21.068   0.841
   12    HG   SER   2           HG       SER   2  21.541  22.091   0.014
   13    H    LEU   3           H        LEU   3  16.707  20.499  -2.132
   14    HA   LEU   3           HA       LEU   3  15.218  19.637   0.075
   15    HB2  LEU   3           HB3      LEU   3  14.736  18.807  -2.802
   16    HB3  LEU   3           HB2      LEU   3  13.533  18.879  -1.514
   17    HG   LEU   3           HG       LEU   3  14.790  21.412  -1.561
   18   HD11  LEU   3          HD11      LEU   3  14.423  22.132  -3.878
   19   HD12  LEU   3          HD12      LEU   3  13.927  20.499  -4.324
   20   HD13  LEU   3          HD13      LEU   3  15.593  20.814  -3.836
   21   HD21  LEU   3          HD21      LEU   3  12.106  20.526  -2.671
   22   HD22  LEU   3          HD22      LEU   3  12.533  22.167  -2.187
   23   HD23  LEU   3          HD23      LEU   3  12.434  20.888  -0.976
   24    H    ILE   4           H        ILE   4  14.821  17.645   1.028
   25    HA   ILE   4           HA       ILE   4  16.730  15.509   0.459
   26    HB   ILE   4           HB       ILE   4  14.438  15.783   2.416
   27   HG12  ILE   4          HG13      ILE   4  17.365  15.398   3.024
   28   HG13  ILE   4          HG12      ILE   4  16.740  16.999   2.630
   29   HG21  ILE   4          HG21      ILE   4  16.046  13.411   1.606
   30   HG22  ILE   4          HG22      ILE   4  14.408  13.491   2.254
   31   HG23  ILE   4          HG23      ILE   4  15.792  13.645   3.336
   32   HD11  ILE   4          HD11      ILE   4  15.570  17.174   4.588
   33   HD12  ILE   4          HD12      ILE   4  16.765  16.005   5.150
   34   HD13  ILE   4          HD13      ILE   4  15.175  15.456   4.623
   35    H    LEU   5           H        LEU   5  16.369  14.191  -1.264
   36    HA   LEU   5           HA       LEU   5  13.646  13.742  -2.264
   37    HB2  LEU   5           HB3      LEU   5  16.409  12.945  -3.151
   38    HB3  LEU   5           HB2      LEU   5  14.996  12.138  -3.834
   39    HG   LEU   5           HG       LEU   5  14.067  14.322  -4.506
   40   HD11  LEU   5          HD11      LEU   5  15.753  16.279  -4.374
   41   HD12  LEU   5          HD12      LEU   5  16.570  15.317  -3.143
   42   HD13  LEU   5          HD13      LEU   5  14.904  15.838  -2.893
   43   HD21  LEU   5          HD21      LEU   5  15.199  14.038  -6.433
   44   HD22  LEU   5          HD22      LEU   5  16.371  13.039  -5.574
   45   HD23  LEU   5          HD23      LEU   5  16.633  14.777  -5.721
   46    H    LEU   6           H        LEU   6  16.160  11.265  -1.823
   47    HA   LEU   6           HA       LEU   6  14.405   9.141  -1.292
   48    HB2  LEU   6           HB3      LEU   6  17.215   9.600  -0.246
   49    HB3  LEU   6           HB2      LEU   6  16.358   8.062  -0.141
   50    HG   LEU   6           HG       LEU   6  16.240   9.143  -2.836
   51   HD11  LEU   6          HD11      LEU   6  18.972   8.645  -1.613
   52   HD12  LEU   6          HD12      LEU   6  18.389  10.166  -2.286
   53   HD13  LEU   6          HD13      LEU   6  18.660   8.781  -3.343
   54   HD21  LEU   6          HD21      LEU   6  17.513   6.624  -1.721
   55   HD22  LEU   6          HD22      LEU   6  17.002   6.893  -3.387
   56   HD23  LEU   6          HD23      LEU   6  15.800   6.787  -2.101
   57    H    SER   7           H        SER   7  12.727   9.854   0.125
   58    HA   SER   7           HA       SER   7  13.504  10.679   2.862
   59    HB2  SER   7           HB3      SER   7  11.710  11.972   1.951
   60    HB3  SER   7           HB2      SER   7  10.857  10.532   1.402
   61    HG   SER   7           HG       SER   7  11.330  11.384   4.069
   62    H    ALA   8           H        ALA   8  10.584   8.857   2.405
   63    HA   ALA   8           HA       ALA   8  11.098   7.045   4.507
   64    HB1  ALA   8           HB1      ALA   8   9.311   5.620   3.369
   65    HB2  ALA   8           HB2      ALA   8   9.286   6.836   2.093
   66    HB3  ALA   8           HB3      ALA   8   8.843   7.278   3.741
   67    H    SER   9           H        SER   9  12.239   5.148   4.627
   68    HA   SER   9           HA       SER   9  13.068   3.800   2.116
   69    HB2  SER   9           HB3      SER   9  15.420   3.615   3.204
   70    HB3  SER   9           HB2      SER   9  14.989   5.129   2.415
   71    HG   SER   9           HG       SER   9  14.117   5.187   4.931
   72    H    ASP  10           H        ASP  10  13.243   3.747   5.685
   73    HA   ASP  10           HA       ASP  10  13.771   0.982   5.987
   74    HB2  ASP  10           HB3      ASP  10  12.771   3.162   7.671
   75    HB3  ASP  10           HB2      ASP  10  12.100   1.592   8.115
   76    H    LEU  11           H        LEU  11  11.021   2.504   4.694
   77    HA   LEU  11           HA       LEU  11   9.086   0.458   5.484
   78    HB2  LEU  11           HB3      LEU  11   8.863   2.447   3.209
   79    HB3  LEU  11           HB2      LEU  11   7.545   1.625   4.044
   80    HG   LEU  11           HG       LEU  11   9.454   3.634   5.278
   81   HD11  LEU  11          HD11      LEU  11   6.492   3.998   5.137
   82   HD12  LEU  11          HD12      LEU  11   7.419   4.254   3.659
   83   HD13  LEU  11          HD13      LEU  11   7.774   5.208   5.100
   84   HD21  LEU  11          HD21      LEU  11   7.593   3.394   7.133
   85   HD22  LEU  11          HD22      LEU  11   8.914   2.228   7.062
   86   HD23  LEU  11          HD23      LEU  11   7.335   1.817   6.390
   87    H    ALA  12           H        ALA  12  11.401   0.922   2.940
   88    HA   ALA  12           HA       ALA  12  10.367  -0.667   0.867
   89    HB1  ALA  12           HB1      ALA  12  13.224  -1.130   1.491
   90    HB2  ALA  12           HB2      ALA  12  12.760   0.562   1.315
   91    HB3  ALA  12           HB3      ALA  12  12.475  -0.572  -0.005
   92    H    GLY  13           H        GLY  13  10.699  -2.947   0.369
   93    HA2  GLY  13           HA3      GLY  13  11.794  -5.037   1.586
   94    HA3  GLY  13           HA2      GLY  13  10.604  -4.627   2.816
   95    H    GLN  14           H        GLN  14   9.663  -6.765   2.380
   96    HA   GLN  14           HA       GLN  14   8.009  -6.808  -0.115
   97    HB2  GLN  14           HB3      GLN  14   9.556  -8.902   1.311
   98    HB3  GLN  14           HB2      GLN  14   7.947  -9.379   0.770
   99    HG2  GLN  14           HG3      GLN  14   8.456  -8.745  -1.511
  100    HG3  GLN  14           HG2      GLN  14  10.003  -8.054  -1.019
  101   HE21  GLN  14          HE22      GLN  14   8.266 -11.110  -1.522
  102   HE22  GLN  14          HE21      GLN  14   9.642 -12.101  -1.463
  103    H    TRP  15           H        TRP  15   5.786  -7.305   0.187
  104    HA   TRP  15           HA       TRP  15   4.853  -7.734   2.966
  105    HB2  TRP  15           HB3      TRP  15   3.919  -5.435   1.220
  106    HB3  TRP  15           HB2      TRP  15   3.184  -5.906   2.746
  107    HD1  TRP  15           HD1      TRP  15   6.649  -4.743   1.420
  108    HE1  TRP  15           HE1      TRP  15   7.812  -3.436   3.309
  109    HE3  TRP  15           HE3      TRP  15   3.200  -5.309   5.153
  110    HZ2  TRP  15           HZ2      TRP  15   7.349  -2.720   6.036
  111    HZ3  TRP  15           HZ3      TRP  15   3.590  -4.302   7.383
  112    HH2  TRP  15           HH2      TRP  15   5.657  -3.008   7.830
  113    H    THR  16           H        THR  16   2.379  -8.041   2.907
  114    HA   THR  16           HA       THR  16   1.447  -9.177   0.313
  115    HB   THR  16           HB       THR  16   0.523 -11.102   1.921
  116    HG1  THR  16           HG1      THR  16   2.942 -10.211   3.095
  117   HG21  THR  16          HG21      THR  16   3.156 -10.839   0.504
  118   HG22  THR  16          HG22      THR  16   1.742 -11.791   0.053
  119   HG23  THR  16          HG23      THR  16   2.777 -12.322   1.378
  120    H    LEU  17           H        LEU  17  -0.926  -9.591   0.386
  121    HA   LEU  17           HA       LEU  17  -2.293  -7.812   2.380
  122    HB2  LEU  17           HB3      LEU  17  -2.291  -7.651  -0.425
  123    HB3  LEU  17           HB2      LEU  17  -3.846  -8.373  -0.012
  124    HG   LEU  17           HG       LEU  17  -4.144  -6.536   1.700
  125   HD11  LEU  17          HD11      LEU  17  -1.441  -6.062   1.070
  126   HD12  LEU  17          HD12      LEU  17  -2.474  -5.080   2.108
  127   HD13  LEU  17          HD13      LEU  17  -2.328  -4.696   0.392
  128   HD21  LEU  17          HD21      LEU  17  -5.370  -6.254  -0.303
  129   HD22  LEU  17          HD22      LEU  17  -3.912  -5.973  -1.255
  130   HD23  LEU  17          HD23      LEU  17  -4.487  -4.736  -0.137
  131    H    GLN  18           H        GLN  18  -4.283  -8.609   3.260
  132    HA   GLN  18           HA       GLN  18  -4.954 -11.443   2.603
  133    HB2  GLN  18           HB3      GLN  18  -3.632 -10.686   4.920
  134    HB3  GLN  18           HB2      GLN  18  -5.323 -10.726   5.422
  135    HG2  GLN  18           HG3      GLN  18  -5.536 -13.007   4.466
  136    HG3  GLN  18           HG2      GLN  18  -3.826 -12.969   4.035
  137   HE21  GLN  18          HE22      GLN  18  -2.822 -11.663   6.400
  138   HE22  GLN  18          HE21      GLN  18  -3.029 -12.721   7.711
  139    H    GLN  19           H        GLN  19  -7.014 -11.397   1.902
  140    HA   GLN  19           HA       GLN  19  -8.861  -9.302   2.939
  141    HB2  GLN  19           HB3      GLN  19  -8.425  -9.993   0.393
  142    HB3  GLN  19           HB2      GLN  19  -9.639 -11.214   0.773
  143    HG2  GLN  19           HG3      GLN  19  -9.928  -8.211   1.019
  144    HG3  GLN  19           HG2      GLN  19 -10.802  -9.278  -0.078
  145   HE21  GLN  19          HE22      GLN  19 -12.745 -10.163   0.688
  146   HE22  GLN  19          HE21      GLN  19 -13.265 -10.083   2.302
  147    H    ASP  20           H        ASP  20 -10.037  -9.988   4.710
  148    HA   ASP  20           HA       ASP  20 -10.424 -12.802   5.282
  149    HB2  ASP  20           HB3      ASP  20 -10.576 -10.451   6.753
  150    HB3  ASP  20           HB2      ASP  20 -12.253 -10.989   6.660
  151    H    GLU  21           H        GLU  21 -12.837 -13.515   5.782
  152    HA   GLU  21           HA       GLU  21 -14.881 -14.124   4.825
  153    HB2  GLU  21           HB3      GLU  21 -14.986 -11.464   5.276
  154    HB3  GLU  21           HB2      GLU  21 -15.203 -11.473   3.525
  155    HG2  GLU  21           HG3      GLU  21 -17.398 -11.639   4.463
  156    HG3  GLU  21           HG2      GLU  21 -16.991 -13.253   3.881
  157    H    ALA  22           H        ALA  22 -12.212 -13.526   2.990
  158    HA   ALA  22           HA       ALA  22 -13.447 -14.758   0.627
  159    HB1  ALA  22           HB1      ALA  22 -13.763 -12.270   0.348
  160    HB2  ALA  22           HB2      ALA  22 -12.802 -13.025  -0.924
  161    HB3  ALA  22           HB3      ALA  22 -12.006 -12.109   0.356
  162    HA   PRO  23           HA       PRO  23  -9.207 -16.334   1.822
  163    HB2  PRO  23           HB2      PRO  23 -10.248 -18.389  -0.093
  164    HB3  PRO  23           HB3      PRO  23  -9.361 -18.611   1.429
  165    HG2  PRO  23           HG3      PRO  23 -11.984 -19.008   1.296
  166    HG3  PRO  23           HG2      PRO  23 -11.230 -18.279   2.725
  167    HD2  PRO  23           HD3      PRO  23 -12.889 -16.995   0.612
  168    HD3  PRO  23           HD2      PRO  23 -12.689 -16.541   2.319
  169    H    ALA  24           H        ALA  24  -7.806 -14.994   0.718
  170    HA   ALA  24           HA       ALA  24  -6.870 -15.743  -1.884
  171    HB1  ALA  24           HB1      ALA  24  -8.739 -13.370  -1.720
  172    HB2  ALA  24           HB2      ALA  24  -8.821 -14.742  -2.824
  173    HB3  ALA  24           HB3      ALA  24  -7.547 -13.535  -3.009
  174    H    ILE  25           H        ILE  25  -4.745 -15.199  -1.736
  175    HA   ILE  25           HA       ILE  25  -3.999 -12.808  -0.095
  176    HB   ILE  25           HB       ILE  25  -3.146 -14.998   0.723
  177   HG12  ILE  25          HG13      ILE  25  -0.895 -13.357  -0.463
  178   HG13  ILE  25          HG12      ILE  25  -1.850 -12.805   0.914
  179   HG21  ILE  25          HG21      ILE  25  -2.114 -16.504  -0.632
  180   HG22  ILE  25          HG22      ILE  25  -1.217 -15.252  -1.493
  181   HG23  ILE  25          HG23      ILE  25  -2.886 -15.607  -1.939
  182   HD11  ILE  25          HD11      ILE  25  -0.786 -15.569   1.100
  183   HD12  ILE  25          HD12      ILE  25  -0.916 -14.326   2.344
  184   HD13  ILE  25          HD13      ILE  25   0.410 -14.275   1.181
  185    H    CYS  26           H        CYS  26  -2.100 -11.581  -0.913
  186    HA   CYS  26           HA       CYS  26  -1.492 -11.953  -3.788
  187    HB2  CYS  26           HB3      CYS  26  -2.651  -9.394  -2.645
  188    HB3  CYS  26           HB2      CYS  26  -2.001  -9.569  -4.274
  189    H    HIS  27           H        HIS  27   0.658 -11.639  -4.068
  190    HA   HIS  27           HA       HIS  27   2.304 -10.625  -1.896
  191    HB2  HIS  27           HB3      HIS  27   2.708 -12.069  -4.366
  192    HB3  HIS  27           HB2      HIS  27   3.834 -10.714  -4.275
  193    HD1  HIS  27           HD1      HIS  27   5.969 -11.453  -3.236
  194    HD2  HIS  27           HD2      HIS  27   2.688 -13.332  -1.474
  195    HE1  HIS  27           HE1      HIS  27   6.890 -12.920  -1.386
  196    HE2  HIS  27           HE2      HIS  27   4.902 -14.069  -0.308
  197    H    LEU  28           H        LEU  28   2.979  -8.551  -1.620
  198    HA   LEU  28           HA       LEU  28   2.529  -6.613  -3.859
  199    HB2  LEU  28           HB3      LEU  28   1.566  -6.646  -1.104
  200    HB3  LEU  28           HB2      LEU  28   2.457  -5.173  -1.461
  201    HG   LEU  28           HG       LEU  28   0.022  -4.967  -1.967
  202   HD11  LEU  28          HD11      LEU  28   2.134  -4.083  -3.487
  203   HD12  LEU  28          HD12      LEU  28   0.455  -3.605  -3.730
  204   HD13  LEU  28          HD13      LEU  28   1.146  -4.911  -4.690
  205   HD21  LEU  28          HD21      LEU  28  -1.104  -6.450  -3.280
  206   HD22  LEU  28          HD22      LEU  28   0.216  -7.537  -2.854
  207   HD23  LEU  28          HD23      LEU  28   0.254  -6.659  -4.384
  208    H    GLU  29           H        GLU  29   4.114  -4.941  -4.056
  209    HA   GLU  29           HA       GLU  29   6.591  -5.325  -2.418
  210    HB2  GLU  29           HB3      GLU  29   6.227  -5.694  -5.253
  211    HB3  GLU  29           HB2      GLU  29   7.320  -4.339  -4.973
  212    HG2  GLU  29           HG3      GLU  29   8.762  -5.704  -3.591
  213    HG3  GLU  29           HG2      GLU  29   7.615  -7.043  -3.637
  214    H    LEU  30           H        LEU  30   6.831  -3.510  -1.250
  215    HA   LEU  30           HA       LEU  30   5.761  -0.947  -2.233
  216    HB2  LEU  30           HB3      LEU  30   6.703  -2.055   0.344
  217    HB3  LEU  30           HB2      LEU  30   7.082  -0.353   0.083
  218    HG   LEU  30           HG       LEU  30   4.743   0.155  -0.347
  219   HD11  LEU  30          HD11      LEU  30   3.655  -1.565  -1.379
  220   HD12  LEU  30          HD12      LEU  30   3.227  -2.013   0.272
  221   HD13  LEU  30          HD13      LEU  30   4.589  -2.795  -0.530
  222   HD21  LEU  30          HD21      LEU  30   4.776  -1.661   2.070
  223   HD22  LEU  30          HD22      LEU  30   3.886  -0.154   1.854
  224   HD23  LEU  30          HD23      LEU  30   5.638  -0.123   2.052
  225    H    ARG  31           H        ARG  31   7.072  -0.090  -3.828
  226    HA   ARG  31           HA       ARG  31   9.962  -0.404  -3.789
  227    HB2  ARG  31           HB3      ARG  31   7.938   0.756  -5.556
  228    HB3  ARG  31           HB2      ARG  31   9.421   1.710  -5.502
  229    HG2  ARG  31           HG3      ARG  31  10.748  -0.294  -6.015
  230    HG3  ARG  31           HG2      ARG  31   9.282  -1.274  -6.030
  231    HD2  ARG  31           HD3      ARG  31   9.896  -0.690  -8.323
  232    HD3  ARG  31           HD2      ARG  31   8.399   0.132  -7.886
  233    HE   ARG  31           HE       ARG  31  10.427   1.943  -7.251
  234   HH11  ARG  31          HH22      ARG  31   9.344   0.166  -9.999
  235   HH12  ARG  31          HH21      ARG  31   9.857   1.362 -11.141
  236   HH21  ARG  31          HH11      ARG  31  11.104   3.516  -8.728
  237   HH22  ARG  31          HH12      ARG  31  10.853   3.259 -10.422
  238    H    ASP  32           H        ASP  32  11.490   1.422  -3.610
  239    HA   ASP  32           HA       ASP  32  10.538   3.466  -1.645
  240    HB2  ASP  32           HB3      ASP  32  12.993   3.641  -1.071
  241    HB3  ASP  32           HB2      ASP  32  12.270   2.076  -0.699
  242    H    SER  33           H        SER  33  10.743   3.339  -4.784
  243    HA   SER  33           HA       SER  33  12.598   5.513  -5.390
  244    HB2  SER  33           HB3      SER  33  10.336   4.637  -7.179
  245    HB3  SER  33           HB2      SER  33  11.925   5.249  -7.633
  246    HG   SER  33           HG       SER  33  12.741   3.313  -7.380
  247    H    GLU  34           H        GLU  34  11.926   7.671  -6.056
  248    HA   GLU  34           HA       GLU  34   9.534   8.576  -4.585
  249    HB2  GLU  34           HB3      GLU  34  10.390  10.865  -5.427
  250    HB3  GLU  34           HB2      GLU  34  11.398  10.004  -4.265
  251    HG2  GLU  34           HG3      GLU  34  12.934   9.320  -5.920
  252    HG3  GLU  34           HG2      GLU  34  11.798   9.642  -7.231
  253    H    VAL  35           H        VAL  35   7.749   9.590  -5.580
  254    HA   VAL  35           HA       VAL  35   7.668   9.570  -8.565
  255    HB   VAL  35           HB       VAL  35   5.585   8.373  -6.712
  256   HG11  VAL  35          HG11      VAL  35   4.878   7.771  -9.313
  257   HG12  VAL  35          HG12      VAL  35   5.440   9.438  -9.444
  258   HG13  VAL  35          HG13      VAL  35   4.138   9.031  -8.325
  259   HG21  VAL  35          HG21      VAL  35   6.090   6.297  -7.941
  260   HG22  VAL  35          HG22      VAL  35   7.547   6.929  -7.173
  261   HG23  VAL  35          HG23      VAL  35   7.293   7.152  -8.905
  262    H    ALA  36           H        ALA  36   7.363  11.709  -9.009
  263    HA   ALA  36           HA       ALA  36   5.889  13.439  -7.164
  264    HB1  ALA  36           HB1      ALA  36   7.741  13.778  -9.339
  265    HB2  ALA  36           HB2      ALA  36   7.215  14.966  -8.146
  266    HB3  ALA  36           HB3      ALA  36   6.306  14.755  -9.642
  267    H    GLU  37           H        GLU  37   5.221  11.701 -10.140
  268    HA   GLU  37           HA       GLU  37   2.964  13.131 -11.065
  269    HB2  GLU  37           HB3      GLU  37   4.057  11.165 -12.214
  270    HB3  GLU  37           HB2      GLU  37   3.250  10.112 -11.053
  271    HG2  GLU  37           HG3      GLU  37   1.874  10.199 -13.036
  272    HG3  GLU  37           HG2      GLU  37   1.055  11.128 -11.781
  273    H    ALA  38           H        ALA  38   3.283  10.781  -8.456
  274    HA   ALA  38           HA       ALA  38   0.442  11.325  -7.683
  275    HB1  ALA  38           HB1      ALA  38   0.137   9.115  -7.197
  276    HB2  ALA  38           HB2      ALA  38   1.774   8.933  -6.570
  277    HB3  ALA  38           HB3      ALA  38   1.484   8.881  -8.308
  278    H    SER  39           H        SER  39   3.559  12.036  -6.937
  279    HA   SER  39           HA       SER  39   4.572  12.909  -5.021
  280    HB2  SER  39           HB3      SER  39   2.237  14.100  -5.048
  281    HB3  SER  39           HB2      SER  39   1.876  13.028  -3.699
  282    HG   SER  39           HG       SER  39   4.328  14.145  -3.452
  283    H    GLY  40           H        GLY  40   4.572  10.135  -5.217
  284    HA2  GLY  40           HA3      GLY  40   4.752   9.400  -2.384
  285    HA3  GLY  40           HA2      GLY  40   3.533   8.502  -3.286
  286    H    TYR  41           H        TYR  41   4.658   6.513  -3.128
  287    HA   TYR  41           HA       TYR  41   7.212   6.367  -4.675
  288    HB2  TYR  41           HB3      TYR  41   6.272   4.570  -2.425
  289    HB3  TYR  41           HB2      TYR  41   7.820   4.466  -3.264
  290    HD1  TYR  41           HD1      TYR  41   5.705   6.836  -1.268
  291    HD2  TYR  41           HD2      TYR  41   9.657   5.700  -2.502
  292    HE1  TYR  41           HE1      TYR  41   6.674   8.523   0.269
  293    HE2  TYR  41           HE2      TYR  41  10.625   7.382  -0.960
  294    HH   TYR  41           HH       TYR  41   9.920   9.489   0.134
  295    H    ASP  42           H        ASP  42   7.458   4.521  -6.050
  296    HA   ASP  42           HA       ASP  42   5.120   3.757  -7.468
  297    HB2  ASP  42           HB3      ASP  42   7.363   3.711  -8.466
  298    HB3  ASP  42           HB2      ASP  42   7.820   2.386  -7.398
  299    H    LEU  43           H        LEU  43   4.336   1.562  -7.785
  300    HA   LEU  43           HA       LEU  43   4.462  -0.159  -5.335
  301    HB2  LEU  43           HB3      LEU  43   2.346   1.144  -5.291
  302    HB3  LEU  43           HB2      LEU  43   1.949   0.532  -6.892
  303    HG   LEU  43           HG       LEU  43   1.919  -1.775  -6.020
  304   HD11  LEU  43          HD11      LEU  43   2.925  -0.380  -3.577
  305   HD12  LEU  43          HD12      LEU  43   3.364  -1.958  -4.230
  306   HD13  LEU  43          HD13      LEU  43   1.848  -1.758  -3.351
  307   HD21  LEU  43          HD21      LEU  43  -0.014  -1.391  -4.343
  308   HD22  LEU  43          HD22      LEU  43  -0.197  -0.762  -5.980
  309   HD23  LEU  43          HD23      LEU  43   0.239   0.326  -4.663
  310    H    GLY  44           H        GLY  44   5.902  -1.580  -6.567
  311    HA2  GLY  44           HA3      GLY  44   4.905  -2.739  -9.065
  312    HA3  GLY  44           HA2      GLY  44   6.389  -3.197  -8.228
  313    H    GLY  45           H        GLY  45   5.276  -5.378  -8.970
  314    HA2  GLY  45           HA3      GLY  45   4.725  -7.413  -7.801
  315    HA3  GLY  45           HA2      GLY  45   3.925  -6.460  -6.560
  316    H    ASP  46           H        ASP  46   2.263  -8.256  -7.101
  317    HA   ASP  46           HA       ASP  46   0.715  -7.837  -9.536
  318    HB2  ASP  46           HB3      ASP  46   1.006  -9.919  -7.622
  319    HB3  ASP  46           HB2      ASP  46  -0.675  -9.396  -7.550
  320    H    THR  47           H        THR  47  -0.109  -5.784  -9.422
  321    HA   THR  47           HA       THR  47  -1.621  -4.974  -6.998
  322    HB   THR  47           HB       THR  47  -1.806  -2.776  -8.179
  323    HG1  THR  47           HG1      THR  47  -1.569  -3.975 -10.287
  324   HG21  THR  47          HG21      THR  47   0.673  -2.276  -8.176
  325   HG22  THR  47          HG22      THR  47   0.948  -3.998  -7.915
  326   HG23  THR  47          HG23      THR  47   0.076  -3.052  -6.709
  327    H    ALA  48           H        ALA  48  -1.971  -6.456  -9.956
  328    HA   ALA  48           HA       ALA  48  -4.535  -5.549 -10.829
  329    HB1  ALA  48           HB1      ALA  48  -2.776  -7.827 -11.369
  330    HB2  ALA  48           HB2      ALA  48  -3.829  -6.938 -12.469
  331    HB3  ALA  48           HB3      ALA  48  -4.485  -8.247 -11.485
  332    H    CYS  49           H        CYS  49  -3.672  -8.233  -8.619
  333    HA   CYS  49           HA       CYS  49  -6.266  -9.223  -8.173
  334    HB2  CYS  49           HB3      CYS  49  -5.042 -10.618  -6.911
  335    HB3  CYS  49           HB2      CYS  49  -3.665  -9.525  -7.019
  336    H    LEU  50           H        LEU  50  -5.197  -6.128  -7.512
  337    HA   LEU  50           HA       LEU  50  -6.895  -5.779  -5.110
  338    HB2  LEU  50           HB3      LEU  50  -5.439  -3.608  -6.626
  339    HB3  LEU  50           HB2      LEU  50  -5.987  -3.578  -4.954
  340    HG   LEU  50           HG       LEU  50  -3.881  -5.484  -6.007
  341   HD11  LEU  50          HD11      LEU  50  -2.328  -3.991  -4.668
  342   HD12  LEU  50          HD12      LEU  50  -3.648  -2.822  -4.588
  343   HD13  LEU  50          HD13      LEU  50  -2.960  -3.272  -6.147
  344   HD21  LEU  50          HD21      LEU  50  -4.917  -4.786  -3.251
  345   HD22  LEU  50          HD22      LEU  50  -3.402  -5.647  -3.514
  346   HD23  LEU  50          HD23      LEU  50  -4.924  -6.369  -4.030
  347    H    THR  51           H        THR  51  -7.235  -5.715  -8.466
  348    HA   THR  51           HA       THR  51  -9.070  -3.565  -8.854
  349    HB   THR  51           HB       THR  51  -9.894  -5.018 -10.795
  350    HG1  THR  51           HG1      THR  51  -8.318  -6.765  -9.384
  351   HG21  THR  51          HG21      THR  51  -6.921  -4.513 -10.498
  352   HG22  THR  51          HG22      THR  51  -8.118  -3.345 -11.057
  353   HG23  THR  51          HG23      THR  51  -7.763  -4.775 -12.026
  354    H    ARG  52           H        ARG  52  -9.403  -5.985  -6.718
  355    HA   ARG  52           HA       ARG  52 -12.371  -6.179  -7.061
  356    HB2  ARG  52           HB3      ARG  52 -11.962  -8.153  -5.356
  357    HB3  ARG  52           HB2      ARG  52 -11.684  -8.400  -7.079
  358    HG2  ARG  52           HG3      ARG  52  -9.298  -7.983  -6.793
  359    HG3  ARG  52           HG2      ARG  52  -9.539  -7.621  -5.083
  360    HD2  ARG  52           HD3      ARG  52  -9.545  -9.811  -4.540
  361    HD3  ARG  52           HD2      ARG  52 -10.705 -10.188  -5.812
  362    HE   ARG  52           HE       ARG  52  -7.795 -10.438  -6.011
  363   HH11  ARG  52          HH22      ARG  52 -10.816 -10.033  -7.621
  364   HH12  ARG  52          HH21      ARG  52 -10.259 -10.703  -9.118
  365   HH21  ARG  52          HH11      ARG  52  -7.049 -11.313  -7.956
  366   HH22  ARG  52          HH12      ARG  52  -8.126 -11.428  -9.308
  367    H    TRP  53           H        TRP  53  -9.826  -4.916  -5.182
  368    HA   TRP  53           HA       TRP  53 -11.719  -4.350  -2.923
  369    HB2  TRP  53           HB3      TRP  53  -8.704  -4.328  -2.724
  370    HB3  TRP  53           HB2      TRP  53  -9.881  -4.371  -1.413
  371    HD1  TRP  53           HD1      TRP  53 -11.745  -6.671  -2.587
  372    HE1  TRP  53           HE1      TRP  53 -10.900  -9.106  -2.555
  373    HE3  TRP  53           HE3      TRP  53  -6.717  -5.855  -2.241
  374    HZ2  TRP  53           HZ2      TRP  53  -8.423 -10.521  -2.403
  375    HZ3  TRP  53           HZ3      TRP  53  -5.136  -7.766  -2.151
  376    HH2  TRP  53           HH2      TRP  53  -5.985 -10.094  -2.233
  377    H    LEU  54           H        LEU  54 -10.101  -3.068  -5.542
  378    HA   LEU  54           HA       LEU  54 -10.364  -0.308  -4.448
  379    HB2  LEU  54           HB3      LEU  54  -8.046  -1.457  -6.022
  380    HB3  LEU  54           HB2      LEU  54  -8.251   0.262  -5.733
  381    HG   LEU  54           HG       LEU  54  -8.104  -1.795  -3.506
  382   HD11  LEU  54          HD11      LEU  54  -5.834  -1.550  -3.362
  383   HD12  LEU  54          HD12      LEU  54  -5.870   0.103  -3.971
  384   HD13  LEU  54          HD13      LEU  54  -5.991  -1.251  -5.090
  385   HD21  LEU  54          HD21      LEU  54  -7.262   0.734  -2.642
  386   HD22  LEU  54          HD22      LEU  54  -8.790  -0.053  -2.251
  387   HD23  LEU  54          HD23      LEU  54  -8.689   1.052  -3.621
  388    HA   PRO  55           HA       PRO  55 -12.423   0.212  -8.362
  389    HB2  PRO  55           HB2      PRO  55 -12.258   2.893  -8.773
  390    HB3  PRO  55           HB3      PRO  55 -13.289   2.177  -7.520
  391    HG2  PRO  55           HG3      PRO  55 -10.674   3.538  -7.269
  392    HG3  PRO  55           HG2      PRO  55 -12.050   3.516  -6.158
  393    HD2  PRO  55           HD3      PRO  55  -9.734   1.988  -5.875
  394    HD3  PRO  55           HD2      PRO  55 -11.275   1.671  -5.061
  395    H    SER  56           H        SER  56  -9.095   0.974  -8.073
  396    HA   SER  56           HA       SER  56  -8.723   0.573 -10.970
  397    HB2  SER  56           HB3      SER  56  -8.649   2.836 -11.299
  398    HB3  SER  56           HB2      SER  56  -8.350   3.174  -9.597
  399    HG   SER  56           HG       SER  56  -6.193   2.354  -9.980
  400    H    GLU  57           H        GLU  57  -6.456   0.087 -11.471
  401    HA   GLU  57           HA       GLU  57  -5.195  -1.424  -9.362
  402    HB2  GLU  57           HB3      GLU  57  -5.140  -1.912 -11.869
  403    HB3  GLU  57           HB2      GLU  57  -3.922  -0.646 -11.981
  404    HG2  GLU  57           HG3      GLU  57  -2.557  -1.854 -10.283
  405    HG3  GLU  57           HG2      GLU  57  -3.751  -3.152 -10.287
  406    HA   PRO  58           HA       PRO  58  -3.012   2.320  -7.939
  407    HB2  PRO  58           HB2      PRO  58  -1.629   1.081  -5.878
  408    HB3  PRO  58           HB3      PRO  58  -3.224   1.823  -5.742
  409    HG2  PRO  58           HG3      PRO  58  -2.481  -0.998  -5.840
  410    HG3  PRO  58           HG2      PRO  58  -3.928  -0.225  -5.205
  411    HD2  PRO  58           HD3      PRO  58  -3.758  -1.654  -7.605
  412    HD3  PRO  58           HD2      PRO  58  -5.085  -0.580  -7.134
  413    H    ARG  59           H        ARG  59  -1.277   3.005  -9.040
  414    HA   ARG  59           HA       ARG  59   0.968   1.121  -9.560
  415    HB2  ARG  59           HB3      ARG  59  -0.247   3.332 -11.014
  416    HB3  ARG  59           HB2      ARG  59   1.495   3.554 -10.846
  417    HG2  ARG  59           HG3      ARG  59   0.230   0.972 -11.801
  418    HG3  ARG  59           HG2      ARG  59   0.800   2.237 -12.892
  419    HD2  ARG  59           HD3      ARG  59   2.936   1.560 -12.665
  420    HD3  ARG  59           HD2      ARG  59   2.821   1.622 -10.906
  421    HE   ARG  59           HE       ARG  59   1.488  -0.722 -11.942
  422   HH11  ARG  59          HH22      ARG  59   4.543   0.718 -11.250
  423   HH12  ARG  59          HH21      ARG  59   5.348  -0.794 -10.997
  424   HH21  ARG  59          HH11      ARG  59   2.522  -2.706 -11.616
  425   HH22  ARG  59          HH12      ARG  59   4.205  -2.733 -11.205
  426    H    ALA  60           H        ALA  60   0.052   3.437  -7.344
  427    HA   ALA  60           HA       ALA  60   2.818   3.708  -6.386
  428    HB1  ALA  60           HB1      ALA  60   2.935   6.079  -6.464
  429    HB2  ALA  60           HB2      ALA  60   1.221   6.229  -6.848
  430    HB3  ALA  60           HB3      ALA  60   2.343   5.608  -8.057
  431    H    TRP  61           H        TRP  61   2.833   4.867  -4.246
  432    HA   TRP  61           HA       TRP  61   0.222   4.945  -2.845
  433    HB2  TRP  61           HB3      TRP  61   1.134   3.556  -0.974
  434    HB3  TRP  61           HB2      TRP  61   0.941   2.648  -2.469
  435    HD1  TRP  61           HD1      TRP  61   3.378   2.810  -4.054
  436    HE1  TRP  61           HE1      TRP  61   5.745   2.272  -3.200
  437    HE3  TRP  61           HE3      TRP  61   2.642   3.342   0.962
  438    HZ2  TRP  61           HZ2      TRP  61   7.141   2.081  -0.713
  439    HZ3  TRP  61           HZ3      TRP  61   4.501   2.965   2.555
  440    HH2  TRP  61           HH2      TRP  61   6.752   2.338   1.723
  441    H    ARG  62           H        ARG  62   0.394   6.178  -0.822
  442    HA   ARG  62           HA       ARG  62   2.930   7.750  -0.572
  443    HB2  ARG  62           HB3      ARG  62   1.445   9.201  -1.720
  444    HB3  ARG  62           HB2      ARG  62   0.090   8.745  -0.690
  445    HG2  ARG  62           HG3      ARG  62   0.937   9.933   1.164
  446    HG3  ARG  62           HG2      ARG  62   2.561  10.014   0.479
  447    HD2  ARG  62           HD3      ARG  62   2.071  11.841  -0.789
  448    HD3  ARG  62           HD2      ARG  62   0.453  11.255  -1.180
  449    HE   ARG  62           HE       ARG  62   0.698  12.095   1.597
  450   HH11  ARG  62          HH22      ARG  62   0.197  13.054  -1.676
  451   HH12  ARG  62          HH21      ARG  62  -0.681  14.489  -1.261
  452   HH21  ARG  62          HH11      ARG  62  -0.447  13.960   2.159
  453   HH22  ARG  62          HH12      ARG  62  -1.046  15.001   0.911
  454    HA   PRO  63           HA       PRO  63   2.065   6.102   3.641
  455    HB2  PRO  63           HB2      PRO  63   4.573   7.461   4.346
  456    HB3  PRO  63           HB3      PRO  63   4.146   5.750   4.493
  457    HG2  PRO  63           HG3      PRO  63   5.897   6.767   2.660
  458    HG3  PRO  63           HG2      PRO  63   5.029   5.238   2.489
  459    HD2  PRO  63           HD3      PRO  63   4.600   7.791   1.074
  460    HD3  PRO  63           HD2      PRO  63   4.120   6.146   0.609
  461    H    THR  64           H        THR  64   0.689   7.273   4.946
  462    HA   THR  64           HA       THR  64   1.076  10.222   5.122
  463    HB   THR  64           HB       THR  64  -1.293   9.717   6.391
  464    HG1  THR  64           HG1      THR  64  -0.691   7.616   4.655
  465   HG21  THR  64          HG21      THR  64  -0.915  11.330   4.560
  466   HG22  THR  64          HG22      THR  64  -2.359  10.365   4.262
  467   HG23  THR  64          HG23      THR  64  -0.863  10.001   3.403
  468    HA   PRO  65           HA       PRO  65   2.481   9.922   9.301
  469    HB2  PRO  65           HB2      PRO  65   1.226  12.067  10.491
  470    HB3  PRO  65           HB3      PRO  65   2.643  12.205   9.434
  471    HG2  PRO  65           HG3      PRO  65  -0.224  12.685   8.829
  472    HG3  PRO  65           HG2      PRO  65   1.214  13.541   8.251
  473    HD2  PRO  65           HD3      PRO  65  -0.142  11.718   6.729
  474    HD3  PRO  65           HD2      PRO  65   1.597  12.028   6.546
  475    H    ALA  66           H        ALA  66  -0.147   8.529   8.597
  476    HA   ALA  66           HA       ALA  66  -0.839   7.752  11.297
  477    HB1  ALA  66           HB1      ALA  66  -2.647   9.631   9.791
  478    HB2  ALA  66           HB2      ALA  66  -2.174   9.675  11.490
  479    HB3  ALA  66           HB3      ALA  66  -3.323   8.463  10.925
  480    H    GLY  67           H        GLY  67  -0.191   6.755   8.474
  481    HA2  GLY  67           HA3      GLY  67  -1.188   4.263   8.390
  482    HA3  GLY  67           HA2      GLY  67  -2.604   5.164   7.854
  483    H    ILE  68           H        ILE  68  -1.692   3.425   6.036
  484    HA   ILE  68           HA       ILE  68   0.131   4.911   4.205
  485    HB   ILE  68           HB       ILE  68  -0.874   2.146   3.645
  486   HG12  ILE  68          HG13      ILE  68   0.980   2.983   5.857
  487   HG13  ILE  68          HG12      ILE  68  -0.248   1.720   5.853
  488   HG21  ILE  68          HG21      ILE  68   1.918   3.246   3.375
  489   HG22  ILE  68          HG22      ILE  68   0.675   3.627   2.182
  490   HG23  ILE  68          HG23      ILE  68   1.148   1.950   2.457
  491   HD11  ILE  68          HD11      ILE  68   2.509   1.660   4.645
  492   HD12  ILE  68          HD12      ILE  68   1.248   0.574   4.063
  493   HD13  ILE  68          HD13      ILE  68   1.763   0.504   5.748
  494    H    ALA  69           H        ALA  69  -0.533   5.417   2.084
  495    HA   ALA  69           HA       ALA  69  -3.454   5.063   1.514
  496    HB1  ALA  69           HB1      ALA  69  -1.879   7.476   1.733
  497    HB2  ALA  69           HB2      ALA  69  -3.616   7.308   1.477
  498    HB3  ALA  69           HB3      ALA  69  -2.518   7.315   0.098
  499    H    LEU  70           H        LEU  70  -3.987   4.487  -0.595
  500    HA   LEU  70           HA       LEU  70  -1.682   3.739  -2.348
  501    HB2  LEU  70           HB3      LEU  70  -4.506   2.712  -2.142
  502    HB3  LEU  70           HB2      LEU  70  -3.430   2.267  -3.457
  503    HG   LEU  70           HG       LEU  70  -2.264   1.991  -0.758
  504   HD11  LEU  70          HD11      LEU  70  -4.421   1.197  -0.125
  505   HD12  LEU  70          HD12      LEU  70  -3.485  -0.250  -0.498
  506   HD13  LEU  70          HD13      LEU  70  -4.651   0.371  -1.666
  507   HD21  LEU  70          HD21      LEU  70  -1.323   0.002  -1.739
  508   HD22  LEU  70          HD22      LEU  70  -1.260   1.260  -2.974
  509   HD23  LEU  70          HD23      LEU  70  -2.509   0.017  -3.045
  510    H    LEU  71           H        LEU  71  -1.475   4.796  -4.291
  511    HA   LEU  71           HA       LEU  71  -3.721   6.594  -5.130
  512    HB2  LEU  71           HB3      LEU  71  -0.741   6.827  -5.646
  513    HB3  LEU  71           HB2      LEU  71  -1.966   7.951  -6.233
  514    HG   LEU  71           HG       LEU  71  -1.881   7.339  -3.302
  515   HD11  LEU  71          HD11      LEU  71  -0.303   9.462  -3.272
  516   HD12  LEU  71          HD12      LEU  71   0.168   8.870  -4.865
  517   HD13  LEU  71          HD13      LEU  71   0.380   7.846  -3.445
  518   HD21  LEU  71          HD21      LEU  71  -3.010   9.353  -3.117
  519   HD22  LEU  71          HD22      LEU  71  -3.509   8.893  -4.745
  520   HD23  LEU  71          HD23      LEU  71  -2.202  10.055  -4.518
  521    H    GLU  72           H        GLU  72  -3.673   6.993  -7.588
  522    HA   GLU  72           HA       GLU  72  -3.133   4.401  -8.992
  523    HB2  GLU  72           HB3      GLU  72  -4.952   5.449 -10.600
  524    HB3  GLU  72           HB2      GLU  72  -5.440   4.608  -9.129
  525    HG2  GLU  72           HG3      GLU  72  -5.683   6.691  -7.933
  526    HG3  GLU  72           HG2      GLU  72  -4.980   7.598  -9.272
  527    H    ARG  73           H        ARG  73  -1.443   6.972  -8.643
  528    HA   ARG  73           HA       ARG  73   0.201   7.931 -10.022
  529    HB2  ARG  73           HB3      ARG  73  -0.447   5.740 -11.489
  530    HB3  ARG  73           HB2      ARG  73  -1.005   7.014 -12.573
  531    HG2  ARG  73           HG3      ARG  73   1.297   8.123 -12.092
  532    HG3  ARG  73           HG2      ARG  73   1.774   6.527 -11.517
  533    HD2  ARG  73           HD3      ARG  73   0.626   5.808 -13.843
  534    HD3  ARG  73           HD2      ARG  73   1.149   7.435 -14.280
  535    HE   ARG  73           HE       ARG  73   2.892   5.151 -13.837
  536   HH11  ARG  73          HH22      ARG  73   2.530   8.573 -13.630
  537   HH12  ARG  73          HH21      ARG  73   4.226   8.895 -13.769
  538   HH21  ARG  73          HH11      ARG  73   5.109   5.551 -14.019
  539   HH22  ARG  73          HH12      ARG  73   5.686   7.184 -13.989
  540    H    GLY  74           H        GLY  74  -2.359   9.133  -9.289
  541    HA2  GLY  74           HA3      GLY  74  -2.336  11.305 -11.287
  542    HA3  GLY  74           HA2      GLY  74  -3.880  10.486 -11.053
  543    H    GLY  75           H        GLY  75  -2.589  10.163  -8.134
  544    HA2  GLY  75           HA3      GLY  75  -2.390  11.646  -6.230
  545    HA3  GLY  75           HA2      GLY  75  -3.205  12.903  -7.158
  546    H    LEU  76           H        LEU  76  -4.955  10.260  -7.859
  547    HA   LEU  76           HA       LEU  76  -7.059  10.994  -5.950
  548    HB2  LEU  76           HB3      LEU  76  -6.863   9.154  -8.321
  549    HB3  LEU  76           HB2      LEU  76  -8.220   9.001  -7.204
  550    HG   LEU  76           HG       LEU  76  -8.785  11.367  -7.535
  551   HD11  LEU  76          HD11      LEU  76  -7.539  12.511  -9.493
  552   HD12  LEU  76          HD12      LEU  76  -6.290  11.294  -9.231
  553   HD13  LEU  76          HD13      LEU  76  -6.705  12.421  -7.940
  554   HD21  LEU  76          HD21      LEU  76  -9.560   9.502  -9.133
  555   HD22  LEU  76          HD22      LEU  76  -8.362  10.134 -10.264
  556   HD23  LEU  76          HD23      LEU  76  -9.693  11.158  -9.725
  557    H    THR  77           H        THR  77  -6.531  10.253  -3.893
  558    HA   THR  77           HA       THR  77  -5.203   7.813  -3.295
  559    HB   THR  77           HB       THR  77  -7.254   8.691  -1.357
  560    HG1  THR  77           HG1      THR  77  -6.814  10.718  -1.540
  561   HG21  THR  77          HG21      THR  77  -4.257   8.615  -1.052
  562   HG22  THR  77          HG22      THR  77  -5.221   7.138  -1.027
  563   HG23  THR  77          HG23      THR  77  -5.492   8.388   0.187
  564    H    LEU  78           H        LEU  78  -5.899   5.743  -3.381
  565    HA   LEU  78           HA       LEU  78  -8.726   5.243  -4.091
  566    HB2  LEU  78           HB3      LEU  78  -6.502   3.208  -3.837
  567    HB3  LEU  78           HB2      LEU  78  -8.024   3.022  -4.692
  568    HG   LEU  78           HG       LEU  78  -5.983   5.129  -5.457
  569   HD11  LEU  78          HD11      LEU  78  -4.709   3.514  -6.351
  570   HD12  LEU  78          HD12      LEU  78  -6.059   3.082  -7.397
  571   HD13  LEU  78          HD13      LEU  78  -5.854   2.271  -5.847
  572   HD21  LEU  78          HD21      LEU  78  -7.250   4.924  -7.648
  573   HD22  LEU  78          HD22      LEU  78  -8.179   5.611  -6.318
  574   HD23  LEU  78          HD23      LEU  78  -8.424   3.929  -6.790
  575    H    MET  79           H        MET  79  -6.412   4.395  -1.510
  576    HA   MET  79           HA       MET  79  -8.692   3.972   0.304
  577    HB2  MET  79           HB3      MET  79  -8.313   1.777  -0.874
  578    HB3  MET  79           HB2      MET  79  -6.713   1.724  -0.145
  579    HG2  MET  79           HG3      MET  79  -8.140   0.458   1.303
  580    HG3  MET  79           HG2      MET  79  -7.878   2.002   2.112
  581    HE1  MET  79           HE1      MET  79 -10.132   0.003  -0.296
  582    HE2  MET  79           HE2      MET  79 -11.690   0.175   0.523
  583    HE3  MET  79           HE3      MET  79 -10.328  -0.567   1.358
  584    H    LEU  80           H        LEU  80  -8.132   4.290   2.438
  585    HA   LEU  80           HA       LEU  80  -5.297   5.069   2.951
  586    HB2  LEU  80           HB3      LEU  80  -6.894   6.860   3.367
  587    HB3  LEU  80           HB2      LEU  80  -7.882   5.797   4.365
  588    HG   LEU  80           HG       LEU  80  -6.110   5.638   6.033
  589   HD11  LEU  80          HD11      LEU  80  -4.110   7.292   5.605
  590   HD12  LEU  80          HD12      LEU  80  -4.537   7.068   3.909
  591   HD13  LEU  80          HD13      LEU  80  -4.071   5.680   4.892
  592   HD21  LEU  80          HD21      LEU  80  -6.175   8.562   5.348
  593   HD22  LEU  80          HD22      LEU  80  -6.340   7.785   6.922
  594   HD23  LEU  80          HD23      LEU  80  -7.674   7.735   5.771
  595    H    LEU  81           H        LEU  81  -4.296   3.202   3.660
  596    HA   LEU  81           HA       LEU  81  -5.679   1.310   5.420
  597    HB2  LEU  81           HB3      LEU  81  -3.083   1.446   4.010
  598    HB3  LEU  81           HB2      LEU  81  -3.031   0.621   5.567
  599    HG   LEU  81           HG       LEU  81  -4.856  -0.857   4.880
  600   HD11  LEU  81          HD11      LEU  81  -6.292   0.143   3.413
  601   HD12  LEU  81          HD12      LEU  81  -5.231  -0.570   2.198
  602   HD13  LEU  81          HD13      LEU  81  -5.018   1.114   2.676
  603   HD21  LEU  81          HD21      LEU  81  -2.680  -1.684   4.313
  604   HD22  LEU  81          HD22      LEU  81  -2.552  -0.594   2.933
  605   HD23  LEU  81          HD23      LEU  81  -3.684  -1.945   2.887
  606    H    GLY  82           H        GLY  82  -5.821   1.605   7.610
  607    HA2  GLY  82           HA3      GLY  82  -4.136   3.699   8.841
  608    HA3  GLY  82           HA2      GLY  82  -5.539   2.938   9.580
  609    H    ARG  83           H        ARG  83  -2.488   3.268  10.219
  610    HA   ARG  83           HA       ARG  83  -1.473   0.577  10.482
  611    HB2  ARG  83           HB3      ARG  83  -0.033   2.606  10.519
  612    HB3  ARG  83           HB2      ARG  83  -0.752   3.066  12.059
  613    HG2  ARG  83           HG3      ARG  83   0.105   0.327  12.208
  614    HG3  ARG  83           HG2      ARG  83   1.443   1.316  11.626
  615    HD2  ARG  83           HD3      ARG  83  -0.214   1.917  14.094
  616    HD3  ARG  83           HD2      ARG  83   1.396   1.198  14.105
  617    HE   ARG  83           HE       ARG  83   1.253   3.752  12.682
  618   HH11  ARG  83          HH22      ARG  83   1.687   2.085  15.669
  619   HH12  ARG  83          HH21      ARG  83   2.588   3.367  16.406
  620   HH21  ARG  83          HH11      ARG  83   2.428   5.436  13.628
  621   HH22  ARG  83          HH12      ARG  83   3.009   5.264  15.251
  622    H    GLN  84           H        GLN  84  -2.337  -0.933  11.831
  623    HA   GLN  84           HA       GLN  84  -3.909  -0.027  14.170
  624    HB2  GLN  84           HB3      GLN  84  -5.056  -1.655  12.874
  625    HB3  GLN  84           HB2      GLN  84  -3.602  -2.617  12.648
  626    HG2  GLN  84           HG3      GLN  84  -5.349  -3.465  14.334
  627    HG3  GLN  84           HG2      GLN  84  -3.665  -3.450  14.842
  628   HE21  GLN  84          HE22      GLN  84  -3.831  -2.954  17.070
  629   HE22  GLN  84          HE21      GLN  84  -4.632  -1.589  17.681
  630    H    GLY  85           H        GLY  85  -0.938  -1.592  13.241
  631    HA2  GLY  85           HA3      GLY  85   0.214  -1.246  15.872
  632    HA3  GLY  85           HA2      GLY  85  -0.135  -2.945  15.542
  633    H    GLU  86           H        GLU  86   2.305  -0.800  15.422
  634    HA   GLU  86           HA       GLU  86   3.703  -0.532  13.200
  635    HB2  GLU  86           HB3      GLU  86   5.761  -1.569  14.363
  636    HB3  GLU  86           HB2      GLU  86   4.935  -0.247  15.190
  637    HG2  GLU  86           HG3      GLU  86   3.926  -2.984  15.760
  638    HG3  GLU  86           HG2      GLU  86   5.520  -2.591  16.403
  639    H    GLY  87           H        GLY  87   3.138  -1.784  11.408
  640    HA2  GLY  87           HA3      GLY  87   3.963  -3.524   9.932
  641    HA3  GLY  87           HA2      GLY  87   4.320  -4.512  11.341
  642    H    ASP  88           H        ASP  88   1.319  -2.893  11.410
  643    HA   ASP  88           HA       ASP  88  -0.153  -5.138  10.188
  644    HB2  ASP  88           HB3      ASP  88  -0.091  -6.075  12.345
  645    HB3  ASP  88           HB2      ASP  88  -0.190  -4.504  13.136
  646    H    TYR  89           H        TYR  89  -1.133  -3.780   8.748
  647    HA   TYR  89           HA       TYR  89  -2.636  -1.428   9.829
  648    HB2  TYR  89           HB3      TYR  89  -1.825  -1.992   6.971
  649    HB3  TYR  89           HB2      TYR  89  -2.538  -0.517   7.563
  650    HD1  TYR  89           HD1      TYR  89   0.465  -2.729   8.249
  651    HD2  TYR  89           HD2      TYR  89  -1.131   1.270   8.047
  652    HE1  TYR  89           HE1      TYR  89   2.696  -1.799   8.748
  653    HE2  TYR  89           HE2      TYR  89   1.118   2.182   8.535
  654    HH   TYR  89           HH       TYR  89   3.226   1.716   9.009
  655    H    ARG  90           H        ARG  90  -4.843  -1.332   9.414
  656    HA   ARG  90           HA       ARG  90  -6.031  -3.453   7.703
  657    HB2  ARG  90           HB3      ARG  90  -7.401  -2.839  10.287
  658    HB3  ARG  90           HB2      ARG  90  -7.396  -4.332   9.351
  659    HG2  ARG  90           HG3      ARG  90  -5.082  -4.787  10.063
  660    HG3  ARG  90           HG2      ARG  90  -5.055  -3.278  10.960
  661    HD2  ARG  90           HD3      ARG  90  -5.549  -5.000  12.551
  662    HD3  ARG  90           HD2      ARG  90  -7.058  -4.135  12.260
  663    HE   ARG  90           HE       ARG  90  -6.986  -6.273  10.420
  664   HH11  ARG  90          HH22      ARG  90  -7.009  -5.709  13.821
  665   HH12  ARG  90          HH21      ARG  90  -7.836  -7.185  14.195
  666   HH21  ARG  90          HH11      ARG  90  -8.067  -8.203  10.888
  667   HH22  ARG  90          HH12      ARG  90  -8.435  -8.596  12.535
  668    H    VAL  91           H        VAL  91  -8.112  -2.888   6.896
  669    HA   VAL  91           HA       VAL  91  -9.090  -0.151   7.496
  670    HB   VAL  91           HB       VAL  91  -7.441  -0.280   5.453
  671   HG11  VAL  91          HG11      VAL  91  -8.341  -1.037   3.410
  672   HG12  VAL  91          HG12      VAL  91  -9.988  -1.062   4.038
  673   HG13  VAL  91          HG13      VAL  91  -8.828  -2.284   4.558
  674   HG21  VAL  91          HG21      VAL  91  -8.916   1.391   4.242
  675   HG22  VAL  91          HG22      VAL  91  -8.673   1.728   5.955
  676   HG23  VAL  91          HG23      VAL  91 -10.185   1.006   5.405
  677    H    GLN  92           H        GLN  92 -11.320   0.062   7.181
  678    HA   GLN  92           HA       GLN  92 -12.764  -2.493   6.737
  679    HB2  GLN  92           HB3      GLN  92 -14.706  -1.305   7.668
  680    HB3  GLN  92           HB2      GLN  92 -13.317  -1.144   8.745
  681    HG2  GLN  92           HG3      GLN  92 -12.895   1.031   7.241
  682    HG3  GLN  92           HG2      GLN  92 -14.644   0.916   7.044
  683   HE21  GLN  92          HE22      GLN  92 -15.808   1.970   8.651
  684   HE22  GLN  92          HE21      GLN  92 -15.252   2.269  10.226
  685    H    LYS  93           H        LYS  93 -13.820  -2.874   4.849
  686    HA   LYS  93           HA       LYS  93 -14.500  -0.541   3.101
  687    HB2  LYS  93           HB3      LYS  93 -13.885  -2.031   1.142
  688    HB3  LYS  93           HB2      LYS  93 -12.521  -1.482   2.115
  689    HG2  LYS  93           HG3      LYS  93 -12.195  -3.575   3.090
  690    HG3  LYS  93           HG2      LYS  93 -13.860  -4.081   2.800
  691    HD2  LYS  93           HD3      LYS  93 -12.145  -3.486   0.424
  692    HD3  LYS  93           HD2      LYS  93 -11.863  -4.995   1.293
  693    HE2  LYS  93           HE3      LYS  93 -14.222  -5.612   1.038
  694    HE3  LYS  93           HE2      LYS  93 -14.551  -4.083   0.225
  695    HZ1  LYS  93           HZ1      LYS  93 -12.994  -4.712  -1.512
  696    HZ2  LYS  93           HZ2      LYS  93 -14.229  -5.865  -1.365
  697    HZ3  LYS  93           HZ3      LYS  93 -12.687  -6.189  -0.729
  698    H    GLY  94           H        GLY  94 -16.344  -0.901   1.732
  699    HA2  GLY  94           HA3      GLY  94 -18.493  -2.304   2.894
  700    HA3  GLY  94           HA2      GLY  94 -18.445  -1.809   1.201
  701    H    ASP  95           H        ASP  95 -19.687  -4.012   1.185
  702    HA   ASP  95           HA       ASP  95 -19.628  -6.183   0.276
  703    HB2  ASP  95           HB3      ASP  95 -17.343  -5.082  -0.698
  704    HB3  ASP  95           HB2      ASP  95 -16.669  -6.372   0.298
  705    H    GLY  96           H        GLY  96 -17.394  -5.350   2.878
  706    HA2  GLY  96           HA3      GLY  96 -17.436  -6.422   5.033
  707    HA3  GLY  96           HA2      GLY  96 -18.246  -7.806   4.301
  708    H    GLY  97           H        GLY  97 -15.257  -6.137   3.315
  709    HA2  GLY  97           HA3      GLY  97 -13.782  -8.713   3.733
  710    HA3  GLY  97           HA2      GLY  97 -13.513  -7.694   2.320
  711    H    GLN  98           H        GLN  98 -12.014  -8.528   5.002
  712    HA   GLN  98           HA       GLN  98 -11.114  -5.785   5.761
  713    HB2  GLN  98           HB3      GLN  98 -11.839  -7.780   7.414
  714    HB3  GLN  98           HB2      GLN  98 -10.142  -8.203   7.205
  715    HG2  GLN  98           HG3      GLN  98  -9.469  -5.928   7.862
  716    HG3  GLN  98           HG2      GLN  98 -11.167  -5.488   8.078
  717   HE21  GLN  98          HE22      GLN  98 -11.237  -8.593   9.038
  718   HE22  GLN  98          HE21      GLN  98 -10.860  -8.428  10.684
  719    H    LEU  99           H        LEU  99  -9.288  -5.092   4.838
  720    HA   LEU  99           HA       LEU  99  -7.447  -7.047   3.606
  721    HB2  LEU  99           HB3      LEU  99  -6.913  -4.102   3.647
  722    HB3  LEU  99           HB2      LEU  99  -6.590  -5.276   2.379
  723    HG   LEU  99           HG       LEU  99  -9.315  -4.234   3.172
  724   HD11  LEU  99          HD11      LEU  99  -7.456  -2.941   1.680
  725   HD12  LEU  99          HD12      LEU  99  -9.191  -2.795   1.401
  726   HD13  LEU  99          HD13      LEU  99  -8.235  -3.914   0.432
  727   HD21  LEU  99          HD21      LEU  99  -9.632  -5.508   0.788
  728   HD22  LEU  99          HD22      LEU  99  -9.932  -6.276   2.347
  729   HD23  LEU  99          HD23      LEU  99  -8.389  -6.517   1.527
  730    H    VAL 100           H        VAL 100  -5.279  -7.256   4.278
  731    HA   VAL 100           HA       VAL 100  -4.473  -5.796   6.746
  732    HB   VAL 100           HB       VAL 100  -4.253  -8.804   6.448
  733   HG11  VAL 100          HG11      VAL 100  -2.899  -8.697   8.243
  734   HG12  VAL 100          HG12      VAL 100  -4.087  -7.739   9.126
  735   HG13  VAL 100          HG13      VAL 100  -2.904  -6.940   8.090
  736   HG21  VAL 100          HG21      VAL 100  -6.558  -8.441   6.782
  737   HG22  VAL 100          HG22      VAL 100  -6.280  -7.032   7.806
  738   HG23  VAL 100          HG23      VAL 100  -5.946  -8.650   8.423
  739    H    LEU 101           H        LEU 101  -2.583  -4.829   6.141
  740    HA   LEU 101           HA       LEU 101  -0.789  -6.236   4.215
  741    HB2  LEU 101           HB3      LEU 101  -1.422  -3.817   3.847
  742    HB3  LEU 101           HB2      LEU 101  -0.563  -3.440   5.325
  743    HG   LEU 101           HG       LEU 101   1.140  -5.048   3.695
  744   HD11  LEU 101          HD11      LEU 101  -0.151  -4.246   1.783
  745   HD12  LEU 101          HD12      LEU 101   1.400  -3.408   1.818
  746   HD13  LEU 101          HD13      LEU 101  -0.058  -2.591   2.382
  747   HD21  LEU 101          HD21      LEU 101   1.252  -2.117   4.468
  748   HD22  LEU 101          HD22      LEU 101   2.619  -3.106   3.955
  749   HD23  LEU 101          HD23      LEU 101   1.805  -3.450   5.481
  750    H    ARG 102           H        ARG 102   0.831  -7.481   5.149
  751    HA   ARG 102           HA       ARG 102   2.188  -6.380   7.554
  752    HB2  ARG 102           HB3      ARG 102   0.516  -8.091   8.286
  753    HB3  ARG 102           HB2      ARG 102   1.301  -9.266   7.232
  754    HG2  ARG 102           HG3      ARG 102   3.406  -9.001   8.473
  755    HG3  ARG 102           HG2      ARG 102   2.651  -7.790   9.512
  756    HD2  ARG 102           HD3      ARG 102   1.319  -9.356  10.602
  757    HD3  ARG 102           HD2      ARG 102   1.370 -10.490   9.252
  758    HE   ARG 102           HE       ARG 102   3.293 -11.426  10.227
  759   HH11  ARG 102          HH22      ARG 102   2.786  -8.178  11.273
  760   HH12  ARG 102          HH21      ARG 102   4.115  -8.188  12.383
  761   HH21  ARG 102          HH11      ARG 102   5.028 -11.457  11.674
  762   HH22  ARG 102          HH12      ARG 102   5.384 -10.045  12.612
  763    H    ARG 103           H        ARG 103   4.375  -6.582   7.389
  764    HA   ARG 103           HA       ARG 103   5.730  -7.068   5.032
  765    HB2  ARG 103           HB3      ARG 103   7.446  -8.073   7.034
  766    HB3  ARG 103           HB2      ARG 103   7.408  -6.433   6.390
  767    HG2  ARG 103           HG3      ARG 103   5.802  -5.748   8.074
  768    HG3  ARG 103           HG2      ARG 103   5.638  -7.407   8.653
  769    HD2  ARG 103           HD3      ARG 103   8.366  -6.176   8.597
  770    HD3  ARG 103           HD2      ARG 103   7.255  -5.709   9.884
  771    HE   ARG 103           HE       ARG 103   7.387  -8.589   9.574
  772   HH11  ARG 103          HH22      ARG 103   8.933  -5.781  10.842
  773   HH12  ARG 103          HH21      ARG 103   9.739  -6.636  12.115
  774   HH21  ARG 103          HH11      ARG 103   8.431  -9.723  11.228
  775   HH22  ARG 103          HH12      ARG 103   9.455  -8.868  12.332
  776    H    ALA 104           H        ALA 104   6.119  -8.851   3.810
  777    HA   ALA 104           HA       ALA 104   4.982 -11.372   4.289
  778    HB1  ALA 104           HB1      ALA 104   6.156 -10.378   2.155
  779    HB2  ALA 104           HB2      ALA 104   6.159 -12.122   2.416
  780    HB3  ALA 104           HB3      ALA 104   7.589 -11.170   2.810
  781    H    THR 105           H        THR 105   5.367 -12.229   6.344
  782    HA   THR 105           HA       THR 105   7.981 -12.294   7.559
  783    HB   THR 105           HB       THR 105   6.321 -14.396   8.578
  784    HG1  THR 105           HG1      THR 105   5.049 -11.996   7.840
  785   HG21  THR 105          HG21      THR 105   6.879 -11.604   9.621
  786   HG22  THR 105          HG22      THR 105   7.943 -12.995   9.836
  787   HG23  THR 105          HG23      THR 105   6.343 -12.986  10.578
  788    HA   PRO 106           HA       PRO 106   8.183 -16.737   5.897
  789    HB2  PRO 106           HB2      PRO 106   6.232 -17.662   4.242
  790    HB3  PRO 106           HB3      PRO 106   6.090 -17.696   6.008
  791    HG2  PRO 106           HG3      PRO 106   4.737 -15.977   4.054
  792    HG3  PRO 106           HG2      PRO 106   4.257 -16.417   5.698
  793    HD2  PRO 106           HD3      PRO 106   5.488 -13.974   4.833
  794    HD3  PRO 106           HD2      PRO 106   5.060 -14.443   6.492
  Start of MODEL    2
    1    H1   SER   1           H        SER   1  25.781  20.375  -4.507
    2    H2   SER   1           H2       SER   1  25.086  18.826  -4.600
    3    H3   SER   1           1HT      SER   1  24.482  20.091  -5.559
    4    HA   SER   1           HA       SER   1  23.701  19.332  -2.972
    5    HB2  SER   1           HB3      SER   1  24.815  22.141  -3.224
    6    HB3  SER   1           HB2      SER   1  23.871  21.536  -1.866
    7    HG   SER   1           HG       SER   1  25.609  19.809  -1.882
    8    H    SER   2           H        SER   2  22.336  19.112  -5.210
    9    HA   SER   2           HA       SER   2  20.783  21.578  -5.720
   10    HB2  SER   2           HB3      SER   2  21.240  20.415  -7.723
   11    HB3  SER   2           HB2      SER   2  20.899  18.848  -6.997
   12    HG   SER   2           HG       SER   2  19.213  19.746  -8.383
   13    H    LEU   3           H        LEU   3  19.427  18.316  -5.649
   14    HA   LEU   3           HA       LEU   3  17.267  19.311  -3.899
   15    HB2  LEU   3           HB3      LEU   3  17.613  16.595  -5.204
   16    HB3  LEU   3           HB2      LEU   3  16.148  17.205  -4.436
   17    HG   LEU   3           HG       LEU   3  16.904  19.186  -6.289
   18   HD11  LEU   3          HD11      LEU   3  18.369  17.395  -7.289
   19   HD12  LEU   3          HD12      LEU   3  17.125  17.996  -8.386
   20   HD13  LEU   3          HD13      LEU   3  16.913  16.443  -7.579
   21   HD21  LEU   3          HD21      LEU   3  14.609  18.565  -5.666
   22   HD22  LEU   3          HD22      LEU   3  14.806  16.998  -6.451
   23   HD23  LEU   3          HD23      LEU   3  14.807  18.474  -7.416
   24    H    ILE   4           H        ILE   4  17.854  19.307  -1.762
   25    HA   ILE   4           HA       ILE   4  19.491  17.071  -0.712
   26    HB   ILE   4           HB       ILE   4  18.459  19.581   0.651
   27   HG12  ILE   4          HG13      ILE   4  21.282  18.949  -0.246
   28   HG13  ILE   4          HG12      ILE   4  20.144  19.835  -1.262
   29   HG21  ILE   4          HG21      ILE   4  19.021  18.440   2.524
   30   HG22  ILE   4          HG22      ILE   4  20.693  18.650   2.005
   31   HG23  ILE   4          HG23      ILE   4  19.824  17.167   1.606
   32   HD11  ILE   4          HD11      ILE   4  20.227  21.710   0.047
   33   HD12  ILE   4          HD12      ILE   4  21.798  21.051   0.503
   34   HD13  ILE   4          HD13      ILE   4  20.396  20.786   1.539
   35    H    LEU   5           H        LEU   5  16.637  16.743  -1.569
   36    HA   LEU   5           HA       LEU   5  15.263  16.247   1.007
   37    HB2  LEU   5           HB3      LEU   5  14.172  15.616  -1.735
   38    HB3  LEU   5           HB2      LEU   5  13.281  15.976  -0.256
   39    HG   LEU   5           HG       LEU   5  14.942  17.905  -1.898
   40   HD11  LEU   5          HD11      LEU   5  12.614  17.366  -2.678
   41   HD12  LEU   5          HD12      LEU   5  12.832  19.057  -2.227
   42   HD13  LEU   5          HD13      LEU   5  12.010  17.951  -1.127
   43   HD21  LEU   5          HD21      LEU   5  13.721  18.128   0.857
   44   HD22  LEU   5          HD22      LEU   5  14.013  19.556  -0.136
   45   HD23  LEU   5          HD23      LEU   5  15.363  18.530   0.352
   46    H    LEU   6           H        LEU   6  15.449  14.283   1.961
   47    HA   LEU   6           HA       LEU   6  16.489  12.009   0.366
   48    HB2  LEU   6           HB3      LEU   6  16.001  12.270   3.349
   49    HB3  LEU   6           HB2      LEU   6  16.801  10.914   2.553
   50    HG   LEU   6           HG       LEU   6  18.178  13.109   1.576
   51   HD11  LEU   6          HD11      LEU   6  16.920  14.436   3.362
   52   HD12  LEU   6          HD12      LEU   6  18.677  14.557   3.411
   53   HD13  LEU   6          HD13      LEU   6  17.833  13.512   4.554
   54   HD21  LEU   6          HD21      LEU   6  19.938  12.341   3.252
   55   HD22  LEU   6          HD22      LEU   6  19.269  11.071   2.228
   56   HD23  LEU   6          HD23      LEU   6  18.721  11.239   3.896
   57    H    SER   7           H        SER   7  15.337  10.044   0.168
   58    HA   SER   7           HA       SER   7  12.409  10.305   0.568
   59    HB2  SER   7           HB3      SER   7  13.648   7.912  -0.724
   60    HB3  SER   7           HB2      SER   7  12.149   8.747  -1.120
   61    HG   SER   7           HG       SER   7  14.621  10.055  -1.407
   62    H    ALA   8           H        ALA   8  11.709   7.616   0.807
   63    HA   ALA   8           HA       ALA   8  12.472   7.123   3.615
   64    HB1  ALA   8           HB1      ALA   8  10.615   5.647   3.699
   65    HB2  ALA   8           HB2      ALA   8  10.598   5.437   1.949
   66    HB3  ALA   8           HB3      ALA   8  10.081   6.967   2.658
   67    H    SER   9           H        SER   9  13.028   4.833   4.256
   68    HA   SER   9           HA       SER   9  14.345   3.257   2.112
   69    HB2  SER   9           HB3      SER   9  16.126   3.221   4.316
   70    HB3  SER   9           HB2      SER   9  16.412   3.897   2.716
   71    HG   SER   9           HG       SER   9  15.595   5.850   3.430
   72    H    ASP  10           H        ASP  10  13.885   3.407   5.667
   73    HA   ASP  10           HA       ASP  10  13.995   0.620   6.138
   74    HB2  ASP  10           HB3      ASP  10  12.495   2.832   7.553
   75    HB3  ASP  10           HB2      ASP  10  12.521   1.172   8.147
   76    H    LEU  11           H        LEU  11  11.615   2.467   4.506
   77    HA   LEU  11           HA       LEU  11   9.615   0.254   4.751
   78    HB2  LEU  11           HB3      LEU  11   9.391   3.139   4.670
   79    HB3  LEU  11           HB2      LEU  11   8.482   2.420   3.347
   80    HG   LEU  11           HG       LEU  11   8.262   1.513   6.227
   81   HD11  LEU  11          HD11      LEU  11   6.391   3.282   4.620
   82   HD12  LEU  11          HD12      LEU  11   7.452   3.846   5.911
   83   HD13  LEU  11          HD13      LEU  11   6.136   2.731   6.276
   84   HD21  LEU  11          HD21      LEU  11   6.005   0.985   4.503
   85   HD22  LEU  11          HD22      LEU  11   7.001  -0.160   5.399
   86   HD23  LEU  11          HD23      LEU  11   7.477   0.342   3.776
   87    H    ALA  12           H        ALA  12  10.422  -1.166   3.184
   88    HA   ALA  12           HA       ALA  12  10.620  -0.098   0.395
   89    HB1  ALA  12           HB1      ALA  12  12.686  -1.197   1.492
   90    HB2  ALA  12           HB2      ALA  12  12.211  -1.785  -0.102
   91    HB3  ALA  12           HB3      ALA  12  11.796  -2.712   1.340
   92    H    GLY  13           H        GLY  13  10.664  -3.309  -0.001
   93    HA2  GLY  13           HA3      GLY  13   7.694  -3.521  -0.077
   94    HA3  GLY  13           HA2      GLY  13   8.701  -4.091  -1.402
   95    H    GLN  14           H        GLN  14   6.860  -5.678   0.258
   96    HA   GLN  14           HA       GLN  14   7.781  -8.105   0.516
   97    HB2  GLN  14           HB3      GLN  14   8.709  -8.348   2.869
   98    HB3  GLN  14           HB2      GLN  14   9.819  -7.632   1.722
   99    HG2  GLN  14           HG3      GLN  14   9.986  -5.801   3.044
  100    HG3  GLN  14           HG2      GLN  14   8.248  -5.531   2.882
  101   HE21  GLN  14          HE22      GLN  14  10.127  -8.148   4.516
  102   HE22  GLN  14          HE21      GLN  14   9.366  -7.946   6.021
  103    H    TRP  15           H        TRP  15   5.320  -7.438   0.403
  104    HA   TRP  15           HA       TRP  15   4.215  -7.995   3.091
  105    HB2  TRP  15           HB3      TRP  15   3.150  -5.762   1.337
  106    HB3  TRP  15           HB2      TRP  15   2.507  -6.257   2.897
  107    HD1  TRP  15           HD1      TRP  15   5.806  -4.887   1.432
  108    HE1  TRP  15           HE1      TRP  15   6.913  -3.391   3.213
  109    HE3  TRP  15           HE3      TRP  15   2.508  -5.522   5.263
  110    HZ2  TRP  15           HZ2      TRP  15   6.450  -2.562   5.915
  111    HZ3  TRP  15           HZ3      TRP  15   2.856  -4.368   7.426
  112    HH2  TRP  15           HH2      TRP  15   4.820  -2.889   7.758
  113    H    THR  16           H        THR  16   1.751  -8.337   2.854
  114    HA   THR  16           HA       THR  16   0.992  -9.470   0.207
  115    HB   THR  16           HB       THR  16  -0.017 -11.411   1.716
  116    HG1  THR  16           HG1      THR  16   0.711 -10.658   3.673
  117   HG21  THR  16          HG21      THR  16   2.352 -12.556   1.449
  118   HG22  THR  16          HG22      THR  16   2.717 -11.089   0.545
  119   HG23  THR  16          HG23      THR  16   1.395 -12.136   0.029
  120    H    LEU  17           H        LEU  17  -1.395  -9.789   0.115
  121    HA   LEU  17           HA       LEU  17  -2.819  -7.969   2.028
  122    HB2  LEU  17           HB3      LEU  17  -2.782  -7.926  -0.756
  123    HB3  LEU  17           HB2      LEU  17  -4.284  -8.771  -0.384
  124    HG   LEU  17           HG       LEU  17  -4.860  -6.917   1.212
  125   HD11  LEU  17          HD11      LEU  17  -3.195  -4.888   0.078
  126   HD12  LEU  17          HD12      LEU  17  -2.151  -6.185   0.660
  127   HD13  LEU  17          HD13      LEU  17  -3.287  -5.406   1.762
  128   HD21  LEU  17          HD21      LEU  17  -4.697  -5.236  -1.045
  129   HD22  LEU  17          HD22      LEU  17  -6.052  -6.269  -0.585
  130   HD23  LEU  17          HD23      LEU  17  -4.811  -6.878  -1.678
  131    H    GLN  18           H        GLN  18  -4.601  -8.787   3.136
  132    HA   GLN  18           HA       GLN  18  -5.496 -11.539   2.475
  133    HB2  GLN  18           HB3      GLN  18  -4.982 -10.891   5.350
  134    HB3  GLN  18           HB2      GLN  18  -4.963 -12.452   4.535
  135    HG2  GLN  18           HG3      GLN  18  -2.877 -11.736   3.337
  136    HG3  GLN  18           HG2      GLN  18  -2.863 -10.280   4.334
  137   HE21  GLN  18          HE22      GLN  18  -1.219 -13.024   4.193
  138   HE22  GLN  18          HE21      GLN  18  -1.057 -13.412   5.836
  139    H    GLN  19           H        GLN  19  -7.671 -11.501   2.390
  140    HA   GLN  19           HA       GLN  19  -9.118  -9.388   3.907
  141    HB2  GLN  19           HB3      GLN  19 -10.717 -11.107   2.152
  142    HB3  GLN  19           HB2      GLN  19 -10.615  -9.348   2.205
  143    HG2  GLN  19           HG3      GLN  19  -8.681 -11.235   0.833
  144    HG3  GLN  19           HG2      GLN  19  -9.795 -10.111   0.056
  145   HE21  GLN  19          HE22      GLN  19  -8.985  -8.256   2.532
  146   HE22  GLN  19          HE21      GLN  19  -7.558  -7.531   1.969
  147    H    ASP  20           H        ASP  20  -9.921 -10.049   5.885
  148    HA   ASP  20           HA       ASP  20 -10.521 -11.546   7.599
  149    HB2  ASP  20           HB3      ASP  20 -12.678 -11.234   6.648
  150    HB3  ASP  20           HB2      ASP  20 -12.304 -12.253   5.265
  151    H    GLU  21           H        GLU  21 -11.416 -14.184   5.552
  152    HA   GLU  21           HA       GLU  21  -9.308 -15.825   6.712
  153    HB2  GLU  21           HB3      GLU  21 -11.727 -16.275   5.133
  154    HB3  GLU  21           HB2      GLU  21 -10.382 -17.268   4.566
  155    HG2  GLU  21           HG3      GLU  21 -11.643 -18.427   6.336
  156    HG3  GLU  21           HG2      GLU  21  -9.999 -18.069   6.866
  157    H    ALA  22           H        ALA  22  -9.960 -14.342   3.583
  158    HA   ALA  22           HA       ALA  22  -8.361 -13.531   2.033
  159    HB1  ALA  22           HB1      ALA  22  -6.234 -15.385   3.043
  160    HB2  ALA  22           HB2      ALA  22  -6.656 -13.964   3.997
  161    HB3  ALA  22           HB3      ALA  22  -6.083 -13.778   2.340
  162    HA   PRO  23           HA       PRO  23  -9.595 -17.780   0.237
  163    HB2  PRO  23           HB2      PRO  23 -10.849 -15.859  -1.667
  164    HB3  PRO  23           HB3      PRO  23 -11.496 -17.368  -0.998
  165    HG2  PRO  23           HG3      PRO  23 -12.306 -14.935  -0.173
  166    HG3  PRO  23           HG2      PRO  23 -12.281 -16.357   0.879
  167    HD2  PRO  23           HD3      PRO  23 -10.517 -13.981   0.915
  168    HD3  PRO  23           HD2      PRO  23 -10.883 -15.143   2.207
  169    H    ALA  24           H        ALA  24  -8.485 -14.706  -1.131
  170    HA   ALA  24           HA       ALA  24  -6.739 -16.218  -3.040
  171    HB1  ALA  24           HB1      ALA  24  -6.806 -13.927  -4.287
  172    HB2  ALA  24           HB2      ALA  24  -8.248 -13.626  -3.317
  173    HB3  ALA  24           HB3      ALA  24  -8.200 -14.998  -4.423
  174    H    ILE  25           H        ILE  25  -4.586 -15.933  -2.679
  175    HA   ILE  25           HA       ILE  25  -3.762 -13.827  -0.743
  176    HB   ILE  25           HB       ILE  25  -2.503 -16.384  -1.723
  177   HG12  ILE  25          HG13      ILE  25  -2.849 -15.351   1.097
  178   HG13  ILE  25          HG12      ILE  25  -4.146 -16.202   0.258
  179   HG21  ILE  25          HG21      ILE  25  -0.586 -15.614  -0.131
  180   HG22  ILE  25          HG22      ILE  25  -1.206 -13.991  -0.431
  181   HG23  ILE  25          HG23      ILE  25  -0.622 -14.974  -1.775
  182   HD11  ILE  25          HD11      ILE  25  -1.484 -17.498   0.134
  183   HD12  ILE  25          HD12      ILE  25  -3.078 -18.216   0.371
  184   HD13  ILE  25          HD13      ILE  25  -2.239 -17.463   1.727
  185    H    CYS  26           H        CYS  26  -3.313 -11.935  -1.814
  186    HA   CYS  26           HA       CYS  26  -1.855 -12.077  -4.410
  187    HB2  CYS  26           HB3      CYS  26  -3.353  -9.849  -3.010
  188    HB3  CYS  26           HB2      CYS  26  -2.330  -9.564  -4.417
  189    H    HIS  27           H        HIS  27   0.306 -11.739  -4.397
  190    HA   HIS  27           HA       HIS  27   1.651 -10.884  -1.939
  191    HB2  HIS  27           HB3      HIS  27   3.512 -10.964  -4.059
  192    HB3  HIS  27           HB2      HIS  27   3.238 -12.214  -2.844
  193    HD1  HIS  27           HD1      HIS  27   1.476 -14.108  -3.470
  194    HD2  HIS  27           HD2      HIS  27   2.559 -11.600  -6.624
  195    HE1  HIS  27           HE1      HIS  27   0.705 -15.253  -5.596
  196    HE2  HIS  27           HE2      HIS  27   1.357 -13.736  -7.520
  197    H    LEU  28           H        LEU  28   2.350  -8.812  -1.551
  198    HA   LEU  28           HA       LEU  28   2.178  -6.853  -3.812
  199    HB2  LEU  28           HB3      LEU  28   1.007  -6.843  -1.132
  200    HB3  LEU  28           HB2      LEU  28   1.958  -5.400  -1.447
  201    HG   LEU  28           HG       LEU  28  -0.445  -5.171  -2.117
  202   HD11  LEU  28          HD11      LEU  28   0.359  -3.673  -3.585
  203   HD12  LEU  28          HD12      LEU  28   0.626  -4.959  -4.763
  204   HD13  LEU  28          HD13      LEU  28   1.898  -4.533  -3.618
  205   HD21  LEU  28          HD21      LEU  28  -0.198  -7.729  -3.036
  206   HD22  LEU  28          HD22      LEU  28  -0.036  -6.820  -4.539
  207   HD23  LEU  28          HD23      LEU  28  -1.473  -6.622  -3.539
  208    H    GLU  29           H        GLU  29   3.779  -5.198  -3.826
  209    HA   GLU  29           HA       GLU  29   6.036  -5.512  -1.918
  210    HB2  GLU  29           HB3      GLU  29   6.075  -6.245  -4.738
  211    HB3  GLU  29           HB2      GLU  29   7.251  -4.978  -4.388
  212    HG2  GLU  29           HG3      GLU  29   8.182  -6.321  -2.555
  213    HG3  GLU  29           HG2      GLU  29   6.991  -7.585  -2.863
  214    H    LEU  30           H        LEU  30   6.307  -3.549  -1.066
  215    HA   LEU  30           HA       LEU  30   5.356  -1.155  -2.481
  216    HB2  LEU  30           HB3      LEU  30   6.116  -1.911   0.268
  217    HB3  LEU  30           HB2      LEU  30   6.560  -0.270  -0.187
  218    HG   LEU  30           HG       LEU  30   4.247   0.211  -0.778
  219   HD11  LEU  30          HD11      LEU  30   2.681  -1.847   0.058
  220   HD12  LEU  30          HD12      LEU  30   4.053  -2.739  -0.600
  221   HD13  LEU  30          HD13      LEU  30   3.160  -1.614  -1.623
  222   HD21  LEU  30          HD21      LEU  30   3.955  -1.272   1.800
  223   HD22  LEU  30          HD22      LEU  30   3.488   0.382   1.405
  224   HD23  LEU  30          HD23      LEU  30   5.184  -0.007   1.711
  225    H    ARG  31           H        ARG  31   6.724   0.005  -3.784
  226    HA   ARG  31           HA       ARG  31   9.627  -0.551  -3.630
  227    HB2  ARG  31           HB3      ARG  31   7.764   0.399  -5.677
  228    HB3  ARG  31           HB2      ARG  31   9.239   1.365  -5.607
  229    HG2  ARG  31           HG3      ARG  31  10.594  -0.699  -5.755
  230    HG3  ARG  31           HG2      ARG  31   9.115  -1.656  -5.849
  231    HD2  ARG  31           HD3      ARG  31   9.048  -1.322  -8.071
  232    HD3  ARG  31           HD2      ARG  31   8.924   0.416  -7.796
  233    HE   ARG  31           HE       ARG  31  11.656  -0.615  -7.600
  234   HH11  ARG  31          HH22      ARG  31   9.130   0.617  -9.598
  235   HH12  ARG  31          HH21      ARG  31  10.202   1.196 -10.827
  236   HH21  ARG  31          HH11      ARG  31  13.073   0.133  -9.194
  237   HH22  ARG  31          HH12      ARG  31  12.436   0.921 -10.599
  238    H    ASP  32           H        ASP  32  11.173   1.057  -3.135
  239    HA   ASP  32           HA       ASP  32  10.111   3.320  -1.566
  240    HB2  ASP  32           HB3      ASP  32  12.334   3.571  -0.722
  241    HB3  ASP  32           HB2      ASP  32  12.049   1.833  -0.808
  242    H    SER  33           H        SER  33  10.206   3.045  -4.666
  243    HA   SER  33           HA       SER  33  11.977   5.222  -5.475
  244    HB2  SER  33           HB3      SER  33  11.662   3.906  -7.324
  245    HB3  SER  33           HB2      SER  33  10.066   3.375  -6.797
  246    HG   SER  33           HG       SER  33  10.760   5.386  -8.472
  247    H    GLU  34           H        GLU  34  11.479   7.345  -5.182
  248    HA   GLU  34           HA       GLU  34   8.903   8.179  -4.189
  249    HB2  GLU  34           HB3      GLU  34   9.800  10.459  -4.404
  250    HB3  GLU  34           HB2      GLU  34  11.002   9.393  -3.676
  251    HG2  GLU  34           HG3      GLU  34  11.680   9.043  -6.241
  252    HG3  GLU  34           HG2      GLU  34  10.978  10.655  -6.379
  253    H    VAL  35           H        VAL  35   7.358   9.548  -5.280
  254    HA   VAL  35           HA       VAL  35   7.554   9.598  -8.259
  255    HB   VAL  35           HB       VAL  35   5.054   8.766  -6.763
  256   HG11  VAL  35          HG11      VAL  35   5.795   8.531  -9.693
  257   HG12  VAL  35          HG12      VAL  35   4.827   9.846  -9.030
  258   HG13  VAL  35          HG13      VAL  35   4.227   8.190  -8.966
  259   HG21  VAL  35          HG21      VAL  35   5.568   6.485  -7.645
  260   HG22  VAL  35          HG22      VAL  35   6.765   7.042  -6.476
  261   HG23  VAL  35          HG23      VAL  35   7.130   7.082  -8.200
  262    H    ALA  36           H        ALA  36   7.470  11.747  -8.717
  263    HA   ALA  36           HA       ALA  36   6.191  13.652  -6.934
  264    HB1  ALA  36           HB1      ALA  36   8.163  14.284  -8.254
  265    HB2  ALA  36           HB2      ALA  36   6.792  15.308  -8.678
  266    HB3  ALA  36           HB3      ALA  36   7.274  13.990  -9.747
  267    H    GLU  37           H        GLU  37   5.224  11.912  -9.832
  268    HA   GLU  37           HA       GLU  37   3.003  13.605 -10.527
  269    HB2  GLU  37           HB3      GLU  37   4.001  11.841 -12.023
  270    HB3  GLU  37           HB2      GLU  37   3.264  10.617 -10.990
  271    HG2  GLU  37           HG3      GLU  37   1.784  11.005 -12.871
  272    HG3  GLU  37           HG2      GLU  37   1.027  11.687 -11.431
  273    H    ALA  38           H        ALA  38   3.272  10.666  -8.531
  274    HA   ALA  38           HA       ALA  38   0.465  11.015  -7.655
  275    HB1  ALA  38           HB1      ALA  38   1.862   8.903  -6.275
  276    HB2  ALA  38           HB2      ALA  38   2.164   8.776  -8.007
  277    HB3  ALA  38           HB3      ALA  38   0.509   8.774  -7.400
  278    H    SER  39           H        SER  39   3.543  11.991  -6.766
  279    HA   SER  39           HA       SER  39   4.348  13.067  -4.861
  280    HB2  SER  39           HB3      SER  39   1.578  13.201  -3.731
  281    HB3  SER  39           HB2      SER  39   2.848  14.422  -3.712
  282    HG   SER  39           HG       SER  39   0.951  14.609  -5.249
  283    H    GLY  40           H        GLY  40   4.588  10.341  -4.753
  284    HA2  GLY  40           HA3      GLY  40   4.548   9.860  -1.884
  285    HA3  GLY  40           HA2      GLY  40   3.384   8.858  -2.750
  286    H    TYR  41           H        TYR  41   4.242   6.869  -2.987
  287    HA   TYR  41           HA       TYR  41   7.034   6.630  -3.998
  288    HB2  TYR  41           HB3      TYR  41   5.678   5.059  -1.801
  289    HB3  TYR  41           HB2      TYR  41   7.185   4.552  -2.568
  290    HD1  TYR  41           HD1      TYR  41   5.578   7.334  -0.680
  291    HD2  TYR  41           HD2      TYR  41   9.237   5.551  -2.008
  292    HE1  TYR  41           HE1      TYR  41   6.856   8.905   0.748
  293    HE2  TYR  41           HE2      TYR  41  10.529   7.111  -0.572
  294    HH   TYR  41           HH       TYR  41   8.876   9.381   1.606
  295    H    ASP  42           H        ASP  42   7.385   4.824  -5.389
  296    HA   ASP  42           HA       ASP  42   5.130   4.126  -7.028
  297    HB2  ASP  42           HB3      ASP  42   7.779   4.210  -7.463
  298    HB3  ASP  42           HB2      ASP  42   7.605   2.481  -7.165
  299    H    LEU  43           H        LEU  43   4.665   1.842  -7.602
  300    HA   LEU  43           HA       LEU  43   4.698   0.011  -5.228
  301    HB2  LEU  43           HB3      LEU  43   2.415   1.005  -5.463
  302    HB3  LEU  43           HB2      LEU  43   2.352   0.411  -7.119
  303    HG   LEU  43           HG       LEU  43   2.741  -1.944  -6.115
  304   HD11  LEU  43          HD11      LEU  43   2.852  -2.213  -3.876
  305   HD12  LEU  43          HD12      LEU  43   1.412  -1.224  -3.640
  306   HD13  LEU  43          HD13      LEU  43   2.995  -0.459  -3.736
  307   HD21  LEU  43          HD21      LEU  43   0.248  -0.323  -5.652
  308   HD22  LEU  43          HD22      LEU  43   0.302  -2.072  -5.442
  309   HD23  LEU  43          HD23      LEU  43   0.615  -1.363  -7.026
  310    H    GLY  44           H        GLY  44   5.322  -2.039  -5.684
  311    HA2  GLY  44           HA3      GLY  44   5.394  -2.923  -8.533
  312    HA3  GLY  44           HA2      GLY  44   6.800  -3.135  -7.490
  313    H    GLY  45           H        GLY  45   5.017  -5.167  -8.788
  314    HA2  GLY  45           HA3      GLY  45   4.984  -7.398  -7.523
  315    HA3  GLY  45           HA2      GLY  45   3.992  -6.552  -6.346
  316    H    ASP  46           H        ASP  46   2.118  -7.816  -6.682
  317    HA   ASP  46           HA       ASP  46   0.998  -7.923  -9.410
  318    HB2  ASP  46           HB3      ASP  46   1.036  -9.912  -7.762
  319    HB3  ASP  46           HB2      ASP  46  -0.253  -9.062  -6.907
  320    H    THR  47           H        THR  47   0.425  -5.730  -9.650
  321    HA   THR  47           HA       THR  47  -1.499  -4.573  -7.700
  322    HB   THR  47           HB       THR  47  -1.045  -2.495  -8.671
  323    HG1  THR  47           HG1      THR  47   0.081  -3.526 -10.999
  324   HG21  THR  47          HG21      THR  47   1.442  -4.057  -9.408
  325   HG22  THR  47          HG22      THR  47   1.045  -3.546  -7.767
  326   HG23  THR  47          HG23      THR  47   1.347  -2.341  -9.019
  327    H    ALA  48           H        ALA  48  -1.431  -6.529 -10.348
  328    HA   ALA  48           HA       ALA  48  -3.925  -5.537 -11.596
  329    HB1  ALA  48           HB1      ALA  48  -1.822  -6.755 -12.714
  330    HB2  ALA  48           HB2      ALA  48  -3.454  -6.957 -13.353
  331    HB3  ALA  48           HB3      ALA  48  -2.758  -8.194 -12.306
  332    H    CYS  49           H        CYS  49  -3.623  -6.766  -8.766
  333    HA   CYS  49           HA       CYS  49  -5.801  -8.808  -9.046
  334    HB2  CYS  49           HB3      CYS  49  -4.377 -10.165  -7.906
  335    HB3  CYS  49           HB2      CYS  49  -3.289  -8.829  -7.529
  336    H    LEU  50           H        LEU  50  -4.462  -6.106  -7.235
  337    HA   LEU  50           HA       LEU  50  -6.481  -5.825  -5.263
  338    HB2  LEU  50           HB3      LEU  50  -4.917  -3.625  -6.647
  339    HB3  LEU  50           HB2      LEU  50  -5.692  -3.514  -5.070
  340    HG   LEU  50           HG       LEU  50  -3.497  -5.481  -5.773
  341   HD11  LEU  50          HD11      LEU  50  -2.096  -4.038  -4.287
  342   HD12  LEU  50          HD12      LEU  50  -3.417  -2.871  -4.235
  343   HD13  LEU  50          HD13      LEU  50  -2.606  -3.218  -5.763
  344   HD21  LEU  50          HD21      LEU  50  -3.457  -5.443  -3.131
  345   HD22  LEU  50          HD22      LEU  50  -4.617  -6.459  -3.987
  346   HD23  LEU  50          HD23      LEU  50  -5.125  -4.908  -3.320
  347    H    THR  51           H        THR  51  -6.912  -5.786  -8.550
  348    HA   THR  51           HA       THR  51  -8.673  -3.540  -8.901
  349    HB   THR  51           HB       THR  51  -9.512  -5.544 -10.676
  350    HG1  THR  51           HG1      THR  51  -7.644  -6.695  -9.772
  351   HG21  THR  51          HG21      THR  51  -7.363  -3.426 -10.956
  352   HG22  THR  51          HG22      THR  51  -9.088  -3.200 -11.239
  353   HG23  THR  51          HG23      THR  51  -8.150  -4.251 -12.301
  354    H    ARG  52           H        ARG  52  -9.011  -6.377  -7.110
  355    HA   ARG  52           HA       ARG  52 -11.967  -6.451  -7.403
  356    HB2  ARG  52           HB3      ARG  52 -11.855  -8.486  -6.048
  357    HB3  ARG  52           HB2      ARG  52 -10.699  -8.598  -7.378
  358    HG2  ARG  52           HG3      ARG  52  -9.033  -7.541  -5.636
  359    HG3  ARG  52           HG2      ARG  52 -10.183  -8.164  -4.453
  360    HD2  ARG  52           HD3      ARG  52  -8.542  -9.887  -4.798
  361    HD3  ARG  52           HD2      ARG  52 -10.011 -10.409  -5.622
  362    HE   ARG  52           HE       ARG  52  -8.363  -8.956  -7.460
  363   HH11  ARG  52          HH22      ARG  52  -8.586 -11.908  -5.691
  364   HH12  ARG  52          HH21      ARG  52  -7.686 -12.826  -6.852
  365   HH21  ARG  52          HH11      ARG  52  -7.187 -10.135  -8.984
  366   HH22  ARG  52          HH12      ARG  52  -6.893 -11.822  -8.718
  367    H    TRP  53           H        TRP  53  -9.456  -5.361  -5.248
  368    HA   TRP  53           HA       TRP  53 -11.497  -4.752  -3.146
  369    HB2  TRP  53           HB3      TRP  53  -8.470  -4.806  -2.959
  370    HB3  TRP  53           HB2      TRP  53  -9.580  -4.496  -1.622
  371    HD1  TRP  53           HD1      TRP  53 -11.687  -6.650  -1.805
  372    HE1  TRP  53           HE1      TRP  53 -11.139  -9.160  -1.610
  373    HE3  TRP  53           HE3      TRP  53  -6.728  -6.570  -3.009
  374    HZ2  TRP  53           HZ2      TRP  53  -8.893 -10.906  -1.927
  375    HZ3  TRP  53           HZ3      TRP  53  -5.408  -8.670  -3.051
  376    HH2  TRP  53           HH2      TRP  53  -6.484 -10.834  -2.505
  377    H    LEU  54           H        LEU  54  -9.426  -3.355  -5.520
  378    HA   LEU  54           HA       LEU  54  -9.990  -0.623  -4.429
  379    HB2  LEU  54           HB3      LEU  54  -7.664  -1.684  -6.046
  380    HB3  LEU  54           HB2      LEU  54  -7.956   0.037  -5.847
  381    HG   LEU  54           HG       LEU  54  -7.601  -1.914  -3.548
  382   HD11  LEU  54          HD11      LEU  54  -5.368  -1.410  -3.464
  383   HD12  LEU  54          HD12      LEU  54  -5.604   0.213  -4.112
  384   HD13  LEU  54          HD13      LEU  54  -5.598  -1.175  -5.195
  385   HD21  LEU  54          HD21      LEU  54  -7.055   0.617  -2.626
  386   HD22  LEU  54          HD22      LEU  54  -8.599  -0.207  -2.426
  387   HD23  LEU  54          HD23      LEU  54  -8.370   0.927  -3.756
  388    HA   PRO  55           HA       PRO  55 -12.285  -0.042  -8.188
  389    HB2  PRO  55           HB2      PRO  55 -12.127   2.655  -8.546
  390    HB3  PRO  55           HB3      PRO  55 -13.111   1.907  -7.273
  391    HG2  PRO  55           HG3      PRO  55 -10.449   3.208  -7.090
  392    HG3  PRO  55           HG2      PRO  55 -11.803   3.240  -5.951
  393    HD2  PRO  55           HD3      PRO  55  -9.572   1.651  -5.638
  394    HD3  PRO  55           HD2      PRO  55 -11.155   1.292  -4.925
  395    H    SER  56           H        SER  56  -8.955   0.496  -8.075
  396    HA   SER  56           HA       SER  56  -8.706   0.195 -10.963
  397    HB2  SER  56           HB3      SER  56  -8.834   2.826  -9.966
  398    HB3  SER  56           HB2      SER  56  -7.128   2.524 -10.274
  399    HG   SER  56           HG       SER  56  -8.626   3.272 -12.069
  400    H    GLU  57           H        GLU  57  -6.303   0.139 -11.559
  401    HA   GLU  57           HA       GLU  57  -4.912  -1.455  -9.577
  402    HB2  GLU  57           HB3      GLU  57  -4.491  -2.171 -11.758
  403    HB3  GLU  57           HB2      GLU  57  -4.326  -0.531 -12.372
  404    HG2  GLU  57           HG3      GLU  57  -2.360  -1.518 -10.333
  405    HG3  GLU  57           HG2      GLU  57  -2.190  -2.038 -12.007
  406    HA   PRO  58           HA       PRO  58  -2.990   2.288  -7.851
  407    HB2  PRO  58           HB2      PRO  58  -1.561   1.119  -5.861
  408    HB3  PRO  58           HB3      PRO  58  -3.301   1.397  -5.754
  409    HG2  PRO  58           HG3      PRO  58  -1.822  -1.098  -6.342
  410    HG3  PRO  58           HG2      PRO  58  -3.311  -0.858  -5.433
  411    HD2  PRO  58           HD3      PRO  58  -3.205  -1.784  -8.035
  412    HD3  PRO  58           HD2      PRO  58  -4.625  -1.003  -7.309
  413    H    ARG  59           H        ARG  59  -1.267   3.251  -8.757
  414    HA   ARG  59           HA       ARG  59   1.114   1.610  -9.486
  415    HB2  ARG  59           HB3      ARG  59  -0.306   3.694 -10.800
  416    HB3  ARG  59           HB2      ARG  59   1.298   4.318 -10.413
  417    HG2  ARG  59           HG3      ARG  59   0.738   1.694 -11.830
  418    HG3  ARG  59           HG2      ARG  59   1.257   3.182 -12.621
  419    HD2  ARG  59           HD3      ARG  59   3.371   2.453 -12.275
  420    HD3  ARG  59           HD2      ARG  59   3.115   2.866 -10.581
  421    HE   ARG  59           HE       ARG  59   2.074   0.337 -10.718
  422   HH11  ARG  59          HH22      ARG  59   4.998   1.809 -11.802
  423   HH12  ARG  59          HH21      ARG  59   5.942   0.364 -11.640
  424   HH21  ARG  59          HH11      ARG  59   3.288  -1.557 -10.503
  425   HH22  ARG  59          HH12      ARG  59   4.973  -1.541 -10.905
  426    H    ALA  60           H        ALA  60   0.014   4.012  -7.255
  427    HA   ALA  60           HA       ALA  60   2.756   4.150  -6.134
  428    HB1  ALA  60           HB1      ALA  60   2.390   6.114  -7.697
  429    HB2  ALA  60           HB2      ALA  60   2.798   6.545  -6.036
  430    HB3  ALA  60           HB3      ALA  60   1.128   6.658  -6.592
  431    H    TRP  61           H        TRP  61   2.804   4.875  -3.929
  432    HA   TRP  61           HA       TRP  61   0.173   4.966  -2.511
  433    HB2  TRP  61           HB3      TRP  61   1.173   3.499  -0.732
  434    HB3  TRP  61           HB2      TRP  61   0.945   2.668  -2.269
  435    HD1  TRP  61           HD1      TRP  61   3.333   3.018  -3.925
  436    HE1  TRP  61           HE1      TRP  61   5.733   2.479  -3.189
  437    HE3  TRP  61           HE3      TRP  61   2.750   3.100   1.154
  438    HZ2  TRP  61           HZ2      TRP  61   7.214   2.103  -0.791
  439    HZ3  TRP  61           HZ3      TRP  61   4.682   2.618   2.634
  440    HH2  TRP  61           HH2      TRP  61   6.910   2.124   1.666
  441    H    ARG  62           H        ARG  62   0.212   6.321  -0.682
  442    HA   ARG  62           HA       ARG  62   2.764   7.825  -0.215
  443    HB2  ARG  62           HB3      ARG  62   1.068   9.717   0.411
  444    HB3  ARG  62           HB2      ARG  62   1.445   9.410  -1.284
  445    HG2  ARG  62           HG3      ARG  62  -0.574   8.236  -1.639
  446    HG3  ARG  62           HG2      ARG  62  -0.854   8.024   0.084
  447    HD2  ARG  62           HD3      ARG  62  -0.916  10.668  -1.397
  448    HD3  ARG  62           HD2      ARG  62  -2.328   9.776  -0.828
  449    HE   ARG  62           HE       ARG  62  -0.414  10.377   1.295
  450   HH11  ARG  62          HH22      ARG  62  -3.089  11.440  -0.602
  451   HH12  ARG  62          HH21      ARG  62  -3.654  12.569   0.584
  452   HH21  ARG  62          HH11      ARG  62  -1.134  11.846   2.856
  453   HH22  ARG  62          HH12      ARG  62  -2.545  12.800   2.543
  454    HA   PRO  63           HA       PRO  63   1.644   6.028   3.889
  455    HB2  PRO  63           HB2      PRO  63   4.272   7.041   4.709
  456    HB3  PRO  63           HB3      PRO  63   3.655   5.381   4.729
  457    HG2  PRO  63           HG3      PRO  63   5.554   6.303   3.005
  458    HG3  PRO  63           HG2      PRO  63   4.504   4.918   2.702
  459    HD2  PRO  63           HD3      PRO  63   4.408   7.624   1.512
  460    HD3  PRO  63           HD2      PRO  63   3.808   6.078   0.871
  461    H    THR  64           H        THR  64   0.584   7.186   5.483
  462    HA   THR  64           HA       THR  64   1.264  10.085   5.774
  463    HB   THR  64           HB       THR  64  -1.213   9.825   6.893
  464    HG1  THR  64           HG1      THR  64  -0.770   7.619   5.441
  465   HG21  THR  64          HG21      THR  64  -0.851  11.550   5.333
  466   HG22  THR  64          HG22      THR  64  -2.028  10.517   4.523
  467   HG23  THR  64          HG23      THR  64  -0.324  10.428   4.080
  468    HA   PRO  65           HA       PRO  65   2.396   9.279   9.967
  469    HB2  PRO  65           HB2      PRO  65   1.293  11.443  11.287
  470    HB3  PRO  65           HB3      PRO  65   2.795  11.503  10.347
  471    HG2  PRO  65           HG3      PRO  65   0.054  12.370   9.599
  472    HG3  PRO  65           HG2      PRO  65   1.622  13.097   9.205
  473    HD2  PRO  65           HD3      PRO  65   0.202  11.603   7.418
  474    HD3  PRO  65           HD2      PRO  65   1.976  11.686   7.403
  475    H    ALA  66           H        ALA  66  -0.295   8.209   9.020
  476    HA   ALA  66           HA       ALA  66  -1.213   7.268  11.578
  477    HB1  ALA  66           HB1      ALA  66  -2.790   8.768  12.137
  478    HB2  ALA  66           HB2      ALA  66  -3.536   8.626  10.546
  479    HB3  ALA  66           HB3      ALA  66  -2.236   9.788  10.809
  480    H    GLY  67           H        GLY  67  -0.627   6.505   8.646
  481    HA2  GLY  67           HA3      GLY  67  -2.055   4.208   8.355
  482    HA3  GLY  67           HA2      GLY  67  -3.210   5.398   7.783
  483    H    ILE  68           H        ILE  68  -2.323   3.455   6.051
  484    HA   ILE  68           HA       ILE  68  -0.328   4.830   4.293
  485    HB   ILE  68           HB       ILE  68  -1.193   1.947   4.555
  486   HG12  ILE  68          HG13      ILE  68   1.589   3.128   4.498
  487   HG13  ILE  68          HG12      ILE  68   0.655   3.027   5.991
  488   HG21  ILE  68          HG21      ILE  68   0.635   1.769   2.633
  489   HG22  ILE  68          HG22      ILE  68   0.064   3.395   2.259
  490   HG23  ILE  68          HG23      ILE  68  -1.063   2.038   2.246
  491   HD11  ILE  68          HD11      ILE  68   1.453   0.716   4.199
  492   HD12  ILE  68          HD12      ILE  68   0.380   0.568   5.590
  493   HD13  ILE  68          HD13      ILE  68   2.060   1.050   5.820
  494    H    ALA  69           H        ALA  69  -1.074   5.691   2.407
  495    HA   ALA  69           HA       ALA  69  -3.866   5.012   1.571
  496    HB1  ALA  69           HB1      ALA  69  -2.374   7.503   1.784
  497    HB2  ALA  69           HB2      ALA  69  -4.109   7.254   1.597
  498    HB3  ALA  69           HB3      ALA  69  -3.066   7.287   0.177
  499    H    LEU  70           H        LEU  70  -4.300   4.779  -0.690
  500    HA   LEU  70           HA       LEU  70  -1.900   4.028  -2.320
  501    HB2  LEU  70           HB3      LEU  70  -4.671   2.854  -2.232
  502    HB3  LEU  70           HB2      LEU  70  -3.538   2.511  -3.534
  503    HG   LEU  70           HG       LEU  70  -2.501   2.196  -0.767
  504   HD11  LEU  70          HD11      LEU  70  -4.558   0.344  -2.002
  505   HD12  LEU  70          HD12      LEU  70  -4.675   1.183  -0.457
  506   HD13  LEU  70          HD13      LEU  70  -3.503  -0.119  -0.665
  507   HD21  LEU  70          HD21      LEU  70  -2.348   0.296  -3.112
  508   HD22  LEU  70          HD22      LEU  70  -1.210   0.480  -1.777
  509   HD23  LEU  70          HD23      LEU  70  -1.324   1.727  -3.020
  510    H    LEU  71           H        LEU  71  -1.865   4.819  -4.459
  511    HA   LEU  71           HA       LEU  71  -4.061   6.743  -5.151
  512    HB2  LEU  71           HB3      LEU  71  -1.126   6.965  -5.889
  513    HB3  LEU  71           HB2      LEU  71  -2.380   8.149  -6.238
  514    HG   LEU  71           HG       LEU  71  -1.804   7.305  -3.397
  515   HD11  LEU  71          HD11      LEU  71  -0.463   9.615  -3.534
  516   HD12  LEU  71          HD12      LEU  71  -0.212   9.076  -5.192
  517   HD13  LEU  71          HD13      LEU  71   0.324   8.068  -3.849
  518   HD21  LEU  71          HD21      LEU  71  -3.723   8.953  -4.541
  519   HD22  LEU  71          HD22      LEU  71  -2.482  10.091  -4.023
  520   HD23  LEU  71          HD23      LEU  71  -3.216   8.996  -2.854
  521    H    GLU  72           H        GLU  72  -4.297   7.090  -7.519
  522    HA   GLU  72           HA       GLU  72  -3.829   4.539  -9.001
  523    HB2  GLU  72           HB3      GLU  72  -5.572   5.716 -10.586
  524    HB3  GLU  72           HB2      GLU  72  -6.123   4.951  -9.098
  525    HG2  GLU  72           HG3      GLU  72  -6.149   7.077  -7.937
  526    HG3  GLU  72           HG2      GLU  72  -5.401   7.885  -9.316
  527    H    ARG  73           H        ARG  73  -1.894   6.862  -8.623
  528    HA   ARG  73           HA       ARG  73  -0.171   7.690 -10.009
  529    HB2  ARG  73           HB3      ARG  73  -1.123   5.717 -11.592
  530    HB3  ARG  73           HB2      ARG  73  -1.599   7.117 -12.550
  531    HG2  ARG  73           HG3      ARG  73   0.820   7.950 -12.171
  532    HG3  ARG  73           HG2      ARG  73   1.170   6.290 -11.689
  533    HD2  ARG  73           HD3      ARG  73   1.642   6.329 -14.008
  534    HD3  ARG  73           HD2      ARG  73   0.035   5.606 -13.905
  535    HE   ARG  73           HE       ARG  73  -0.317   8.404 -14.190
  536   HH11  ARG  73          HH22      ARG  73   0.966   5.686 -15.876
  537   HH12  ARG  73          HH21      ARG  73   0.621   6.329 -17.447
  538   HH21  ARG  73          HH11      ARG  73  -0.775   9.260 -16.230
  539   HH22  ARG  73          HH12      ARG  73  -0.365   8.352 -17.647
  540    H    GLY  74           H        GLY  74  -2.604   9.116  -9.118
  541    HA2  GLY  74           HA3      GLY  74  -2.277  11.463 -10.859
  542    HA3  GLY  74           HA2      GLY  74  -3.904  10.786 -10.827
  543    H    GLY  75           H        GLY  75  -2.064  10.450  -7.931
  544    HA2  GLY  75           HA3      GLY  75  -2.167  11.574  -5.867
  545    HA3  GLY  75           HA2      GLY  75  -2.818  12.971  -6.722
  546    H    LEU  76           H        LEU  76  -4.743  10.461  -7.637
  547    HA   LEU  76           HA       LEU  76  -6.877  11.317  -5.816
  548    HB2  LEU  76           HB3      LEU  76  -6.698  10.058  -8.405
  549    HB3  LEU  76           HB2      LEU  76  -7.717   9.082  -7.346
  550    HG   LEU  76           HG       LEU  76  -8.035  12.073  -7.723
  551   HD11  LEU  76          HD11      LEU  76  -8.744  11.288  -9.787
  552   HD12  LEU  76          HD12      LEU  76 -10.233  11.108  -8.859
  553   HD13  LEU  76          HD13      LEU  76  -9.199   9.708  -9.148
  554   HD21  LEU  76          HD21      LEU  76  -8.990  10.267  -5.761
  555   HD22  LEU  76          HD22      LEU  76 -10.358  10.619  -6.817
  556   HD23  LEU  76          HD23      LEU  76  -9.501  11.935  -6.015
  557    H    THR  77           H        THR  77  -6.421  10.503  -3.758
  558    HA   THR  77           HA       THR  77  -5.317   7.991  -3.119
  559    HB   THR  77           HB       THR  77  -7.483   8.845  -1.318
  560    HG1  THR  77           HG1      THR  77  -6.319  10.777  -0.780
  561   HG21  THR  77          HG21      THR  77  -4.513   8.833  -0.815
  562   HG22  THR  77          HG22      THR  77  -5.438   7.332  -0.878
  563   HG23  THR  77          HG23      THR  77  -5.821   8.554   0.335
  564    H    LEU  78           H        LEU  78  -6.170   5.907  -2.968
  565    HA   LEU  78           HA       LEU  78  -8.951   5.560  -3.995
  566    HB2  LEU  78           HB3      LEU  78  -6.722   3.515  -3.793
  567    HB3  LEU  78           HB2      LEU  78  -8.284   3.287  -4.569
  568    HG   LEU  78           HG       LEU  78  -6.618   5.588  -5.490
  569   HD11  LEU  78          HD11      LEU  78  -5.400   4.094  -7.046
  570   HD12  LEU  78          HD12      LEU  78  -6.109   2.693  -6.243
  571   HD13  LEU  78          HD13      LEU  78  -4.994   3.743  -5.366
  572   HD21  LEU  78          HD21      LEU  78  -8.132   3.559  -7.123
  573   HD22  LEU  78          HD22      LEU  78  -7.802   5.251  -7.497
  574   HD23  LEU  78          HD23      LEU  78  -8.990   4.837  -6.263
  575    H    MET  79           H        MET  79  -6.692   4.250  -1.549
  576    HA   MET  79           HA       MET  79  -9.030   3.843   0.253
  577    HB2  MET  79           HB3      MET  79  -8.416   1.733  -1.090
  578    HB3  MET  79           HB2      MET  79  -6.954   1.687  -0.111
  579    HG2  MET  79           HG3      MET  79  -8.534   0.319   1.045
  580    HG3  MET  79           HG2      MET  79  -8.481   1.841   1.935
  581    HE1  MET  79           HE1      MET  79 -10.147  -0.406  -0.527
  582    HE2  MET  79           HE2      MET  79 -11.875  -0.114  -0.283
  583    HE3  MET  79           HE3      MET  79 -10.891  -0.750   1.032
  584    H    LEU  80           H        LEU  80  -8.556   4.428   2.315
  585    HA   LEU  80           HA       LEU  80  -5.736   5.092   2.955
  586    HB2  LEU  80           HB3      LEU  80  -7.401   6.857   3.331
  587    HB3  LEU  80           HB2      LEU  80  -8.324   5.782   4.376
  588    HG   LEU  80           HG       LEU  80  -6.430   5.670   5.955
  589   HD11  LEU  80          HD11      LEU  80  -4.462   5.935   4.741
  590   HD12  LEU  80          HD12      LEU  80  -4.631   7.541   5.450
  591   HD13  LEU  80          HD13      LEU  80  -5.115   7.260   3.777
  592   HD21  LEU  80          HD21      LEU  80  -6.790   8.593   5.373
  593   HD22  LEU  80          HD22      LEU  80  -6.818   7.753   6.924
  594   HD23  LEU  80          HD23      LEU  80  -8.193   7.624   5.827
  595    H    LEU  81           H        LEU  81  -4.801   3.136   3.573
  596    HA   LEU  81           HA       LEU  81  -6.197   1.283   5.349
  597    HB2  LEU  81           HB3      LEU  81  -3.626   1.352   3.894
  598    HB3  LEU  81           HB2      LEU  81  -3.549   0.552   5.462
  599    HG   LEU  81           HG       LEU  81  -5.444  -0.887   4.838
  600   HD11  LEU  81          HD11      LEU  81  -6.828   0.205   3.361
  601   HD12  LEU  81          HD12      LEU  81  -5.876  -0.712   2.192
  602   HD13  LEU  81          HD13      LEU  81  -5.487   0.979   2.513
  603   HD21  LEU  81          HD21      LEU  81  -2.853  -0.852   3.567
  604   HD22  LEU  81          HD22      LEU  81  -4.047  -1.524   2.457
  605   HD23  LEU  81          HD23      LEU  81  -3.822  -2.242   4.053
  606    H    GLY  82           H        GLY  82  -6.365   1.625   7.506
  607    HA2  GLY  82           HA3      GLY  82  -4.659   3.667   8.771
  608    HA3  GLY  82           HA2      GLY  82  -6.049   2.883   9.513
  609    H    ARG  83           H        ARG  83  -2.897   3.201   9.954
  610    HA   ARG  83           HA       ARG  83  -1.945   0.500  10.281
  611    HB2  ARG  83           HB3      ARG  83  -0.526   2.585  10.132
  612    HB3  ARG  83           HB2      ARG  83  -1.032   2.968  11.771
  613    HG2  ARG  83           HG3      ARG  83  -0.239   0.373  12.078
  614    HG3  ARG  83           HG2      ARG  83   0.857   0.902  10.803
  615    HD2  ARG  83           HD3      ARG  83   1.221   2.995  12.337
  616    HD3  ARG  83           HD2      ARG  83   0.588   1.948  13.608
  617    HE   ARG  83           HE       ARG  83   2.622   0.535  12.192
  618   HH11  ARG  83          HH22      ARG  83   2.116   3.217  14.299
  619   HH12  ARG  83          HH21      ARG  83   3.692   3.123  15.013
  620   HH21  ARG  83          HH11      ARG  83   4.685   0.401  13.112
  621   HH22  ARG  83          HH12      ARG  83   5.145   1.530  14.340
  622    H    GLN  84           H        GLN  84  -2.889  -0.904  11.713
  623    HA   GLN  84           HA       GLN  84  -4.156   0.181  14.163
  624    HB2  GLN  84           HB3      GLN  84  -4.250  -2.453  12.713
  625    HB3  GLN  84           HB2      GLN  84  -4.771  -2.344  14.397
  626    HG2  GLN  84           HG3      GLN  84  -5.793  -0.424  12.304
  627    HG3  GLN  84           HG2      GLN  84  -6.574  -1.977  12.586
  628   HE21  GLN  84          HE22      GLN  84  -8.185   0.132  13.157
  629   HE22  GLN  84          HE21      GLN  84  -8.296   0.404  14.828
  630    H    GLY  85           H        GLY  85  -1.293  -1.431  13.105
  631    HA2  GLY  85           HA3      GLY  85  -0.022  -1.185  15.664
  632    HA3  GLY  85           HA2      GLY  85  -0.513  -2.861  15.408
  633    H    GLU  86           H        GLU  86   2.112  -1.052  15.213
  634    HA   GLU  86           HA       GLU  86   3.441  -0.900  12.920
  635    HB2  GLU  86           HB3      GLU  86   5.467  -1.877  13.974
  636    HB3  GLU  86           HB2      GLU  86   4.603  -0.791  15.063
  637    HG2  GLU  86           HG3      GLU  86   4.518  -2.472  16.558
  638    HG3  GLU  86           HG2      GLU  86   3.430  -3.317  15.456
  639    H    GLY  87           H        GLY  87   2.697  -2.106  11.162
  640    HA2  GLY  87           HA3      GLY  87   3.282  -3.915   9.676
  641    HA3  GLY  87           HA2      GLY  87   3.658  -4.911  11.070
  642    H    ASP  88           H        ASP  88   0.748  -3.109  11.276
  643    HA   ASP  88           HA       ASP  88  -0.891  -5.333  10.217
  644    HB2  ASP  88           HB3      ASP  88  -0.782  -6.130  12.424
  645    HB3  ASP  88           HB2      ASP  88  -0.747  -4.506  13.111
  646    H    TYR  89           H        TYR  89  -1.630  -3.811   8.675
  647    HA   TYR  89           HA       TYR  89  -3.088  -1.435   9.723
  648    HB2  TYR  89           HB3      TYR  89  -2.366  -2.131   6.877
  649    HB3  TYR  89           HB2      TYR  89  -3.077  -0.634   7.408
  650    HD1  TYR  89           HD1      TYR  89  -0.059  -2.792   8.146
  651    HD2  TYR  89           HD2      TYR  89  -1.669   1.186   7.769
  652    HE1  TYR  89           HE1      TYR  89   2.185  -1.836   8.535
  653    HE2  TYR  89           HE2      TYR  89   0.589   2.127   8.151
  654    HH   TYR  89           HH       TYR  89   3.134   0.349   9.393
  655    H    ARG  90           H        ARG  90  -5.295  -1.270   9.402
  656    HA   ARG  90           HA       ARG  90  -6.624  -3.385   7.797
  657    HB2  ARG  90           HB3      ARG  90  -7.723  -2.679  10.511
  658    HB3  ARG  90           HB2      ARG  90  -8.021  -4.118   9.537
  659    HG2  ARG  90           HG3      ARG  90  -5.673  -4.831   9.901
  660    HG3  ARG  90           HG2      ARG  90  -5.417  -3.417  10.919
  661    HD2  ARG  90           HD3      ARG  90  -5.909  -5.368  12.315
  662    HD3  ARG  90           HD2      ARG  90  -7.219  -4.194  12.433
  663    HE   ARG  90           HE       ARG  90  -8.063  -5.861  10.409
  664   HH11  ARG  90          HH22      ARG  90  -6.853  -6.287  13.607
  665   HH12  ARG  90          HH21      ARG  90  -7.756  -7.736  13.900
  666   HH21  ARG  90          HH11      ARG  90  -9.250  -7.754  10.771
  667   HH22  ARG  90          HH12      ARG  90  -9.113  -8.566  12.296
  668    H    VAL  91           H        VAL  91  -8.753  -2.767   7.113
  669    HA   VAL  91           HA       VAL  91  -9.634  -0.013   7.747
  670    HB   VAL  91           HB       VAL  91  -8.052  -0.105   5.664
  671   HG11  VAL  91          HG11      VAL  91  -8.962  -0.889   3.647
  672   HG12  VAL  91          HG12      VAL  91 -10.610  -0.875   4.275
  673   HG13  VAL  91          HG13      VAL  91  -9.476  -2.118   4.802
  674   HG21  VAL  91          HG21      VAL  91  -9.458   1.615   4.541
  675   HG22  VAL  91          HG22      VAL  91  -9.396   1.854   6.287
  676   HG23  VAL  91          HG23      VAL  91 -10.824   1.131   5.547
  677    H    GLN  92           H        GLN  92 -11.868   0.300   7.327
  678    HA   GLN  92           HA       GLN  92 -13.380  -2.240   6.979
  679    HB2  GLN  92           HB3      GLN  92 -15.257  -1.042   7.970
  680    HB3  GLN  92           HB2      GLN  92 -13.832  -0.813   8.982
  681    HG2  GLN  92           HG3      GLN  92 -13.519   1.300   7.353
  682    HG3  GLN  92           HG2      GLN  92 -15.275   1.150   7.268
  683   HE21  GLN  92          HE22      GLN  92 -16.507   1.629   9.185
  684   HE22  GLN  92          HE21      GLN  92 -15.797   2.270  10.588
  685    H    LYS  93           H        LYS  93 -14.596  -2.593   5.177
  686    HA   LYS  93           HA       LYS  93 -15.026  -0.288   3.300
  687    HB2  LYS  93           HB3      LYS  93 -14.763  -1.818   1.437
  688    HB3  LYS  93           HB2      LYS  93 -13.342  -1.949   2.475
  689    HG2  LYS  93           HG3      LYS  93 -14.756  -3.850   3.648
  690    HG3  LYS  93           HG2      LYS  93 -15.601  -3.892   2.102
  691    HD2  LYS  93           HD3      LYS  93 -12.604  -4.152   2.461
  692    HD3  LYS  93           HD2      LYS  93 -13.702  -5.489   2.150
  693    HE2  LYS  93           HE3      LYS  93 -13.273  -5.097  -0.039
  694    HE3  LYS  93           HE2      LYS  93 -14.358  -3.721   0.139
  695    HZ1  LYS  93           HZ1      LYS  93 -12.208  -3.098  -0.812
  696    HZ2  LYS  93           HZ2      LYS  93 -11.424  -3.645   0.589
  697    HZ3  LYS  93           HZ3      LYS  93 -12.488  -2.324   0.674
  698    H    GLY  94           H        GLY  94 -16.385  -2.985   4.998
  699    HA2  GLY  94           HA3      GLY  94 -18.591  -3.776   5.135
  700    HA3  GLY  94           HA2      GLY  94 -19.062  -2.143   4.659
  701    H    ASP  95           H        ASP  95 -17.214  -4.588   2.840
  702    HA   ASP  95           HA       ASP  95 -19.478  -4.954   0.980
  703    HB2  ASP  95           HB3      ASP  95 -17.276  -3.152   0.443
  704    HB3  ASP  95           HB2      ASP  95 -17.280  -4.479  -0.720
  705    H    GLY  96           H        GLY  96 -15.939  -5.474   0.853
  706    HA2  GLY  96           HA3      GLY  96 -16.446  -8.305   0.144
  707    HA3  GLY  96           HA2      GLY  96 -14.888  -7.482   0.050
  708    H    GLY  97           H        GLY  97 -15.112  -6.337   2.740
  709    HA2  GLY  97           HA3      GLY  97 -15.587  -7.732   4.947
  710    HA3  GLY  97           HA2      GLY  97 -14.340  -8.768   4.254
  711    H    GLN  98           H        GLN  98 -12.818  -8.357   5.879
  712    HA   GLN  98           HA       GLN  98 -11.926  -5.534   6.257
  713    HB2  GLN  98           HB3      GLN  98 -12.471  -7.360   8.145
  714    HB3  GLN  98           HB2      GLN  98 -10.796  -7.808   7.831
  715    HG2  GLN  98           HG3      GLN  98 -10.063  -5.502   8.245
  716    HG3  GLN  98           HG2      GLN  98 -11.738  -5.008   8.521
  717   HE21  GLN  98          HE22      GLN  98 -11.245  -8.168   9.687
  718   HE22  GLN  98          HE21      GLN  98 -10.996  -7.786  11.321
  719    H    LEU  99           H        LEU  99 -10.100  -4.889   5.265
  720    HA   LEU  99           HA       LEU  99  -8.415  -6.883   3.892
  721    HB2  LEU  99           HB3      LEU  99  -7.999  -3.894   4.054
  722    HB3  LEU  99           HB2      LEU  99  -7.342  -5.001   2.864
  723    HG   LEU  99           HG       LEU  99 -10.303  -4.485   3.223
  724   HD11  LEU  99          HD11      LEU  99  -9.876  -2.506   2.210
  725   HD12  LEU  99          HD12      LEU  99  -9.519  -3.455   0.768
  726   HD13  LEU  99          HD13      LEU  99  -8.214  -2.964   1.846
  727   HD21  LEU  99          HD21      LEU  99  -8.629  -5.990   1.200
  728   HD22  LEU  99          HD22      LEU  99 -10.275  -5.475   0.849
  729   HD23  LEU  99          HD23      LEU  99  -9.969  -6.602   2.168
  730    H    VAL 100           H        VAL 100  -6.183  -7.204   4.402
  731    HA   VAL 100           HA       VAL 100  -5.158  -5.855   6.845
  732    HB   VAL 100           HB       VAL 100  -5.432  -8.847   6.485
  733   HG11  VAL 100          HG11      VAL 100  -3.310  -8.727   7.428
  734   HG12  VAL 100          HG12      VAL 100  -4.314  -8.692   8.878
  735   HG13  VAL 100          HG13      VAL 100  -3.643  -7.193   8.233
  736   HG21  VAL 100          HG21      VAL 100  -6.425  -6.872   8.564
  737   HG22  VAL 100          HG22      VAL 100  -6.589  -8.624   8.697
  738   HG23  VAL 100          HG23      VAL 100  -7.412  -7.756   7.401
  739    H    LEU 101           H        LEU 101  -3.268  -4.987   6.116
  740    HA   LEU 101           HA       LEU 101  -1.616  -6.486   4.134
  741    HB2  LEU 101           HB3      LEU 101  -2.115  -4.049   3.751
  742    HB3  LEU 101           HB2      LEU 101  -1.289  -3.698   5.250
  743    HG   LEU 101           HG       LEU 101   0.445  -5.329   3.713
  744   HD11  LEU 101          HD11      LEU 101  -0.838  -4.588   1.747
  745   HD12  LEU 101          HD12      LEU 101   0.749  -3.821   1.757
  746   HD13  LEU 101          HD13      LEU 101  -0.675  -2.910   2.262
  747   HD21  LEU 101          HD21      LEU 101   1.895  -3.342   3.910
  748   HD22  LEU 101          HD22      LEU 101   1.071  -3.662   5.438
  749   HD23  LEU 101          HD23      LEU 101   0.502  -2.370   4.381
  750    H    ARG 102           H        ARG 102   0.004  -7.776   5.005
  751    HA   ARG 102           HA       ARG 102   1.370  -6.797   7.473
  752    HB2  ARG 102           HB3      ARG 102  -0.364  -8.625   7.933
  753    HB3  ARG 102           HB2      ARG 102   0.687  -9.707   7.018
  754    HG2  ARG 102           HG3      ARG 102   2.449  -8.439   8.745
  755    HG3  ARG 102           HG2      ARG 102   1.008  -8.666   9.737
  756    HD2  ARG 102           HD3      ARG 102   0.967 -11.072   9.010
  757    HD3  ARG 102           HD2      ARG 102   2.512 -10.804   8.203
  758    HE   ARG 102           HE       ARG 102   2.118 -11.108  11.068
  759   HH11  ARG 102          HH22      ARG 102   3.991  -9.662   8.559
  760   HH12  ARG 102          HH21      ARG 102   5.423  -9.526   9.526
  761   HH21  ARG 102          HH11      ARG 102   3.976 -10.940  12.341
  762   HH22  ARG 102          HH12      ARG 102   5.414 -10.248  11.666
  763    H    ARG 103           H        ARG 103   3.543  -7.031   7.432
  764    HA   ARG 103           HA       ARG 103   5.060  -7.270   5.157
  765    HB2  ARG 103           HB3      ARG 103   5.867  -8.346   7.874
  766    HB3  ARG 103           HB2      ARG 103   6.962  -7.858   6.582
  767    HG2  ARG 103           HG3      ARG 103   6.175  -5.561   6.716
  768    HG3  ARG 103           HG2      ARG 103   4.960  -6.015   7.912
  769    HD2  ARG 103           HD3      ARG 103   7.960  -6.251   8.279
  770    HD3  ARG 103           HD2      ARG 103   6.938  -5.007   8.995
  771    HE   ARG 103           HE       ARG 103   5.747  -7.299   9.889
  772   HH11  ARG 103          HH22      ARG 103   9.004  -6.175   9.751
  773   HH12  ARG 103          HH21      ARG 103   9.502  -7.045  11.164
  774   HH21  ARG 103          HH11      ARG 103   6.382  -8.439  11.736
  775   HH22  ARG 103          HH12      ARG 103   8.019  -8.326  12.287
  776    H    ALA 104           H        ALA 104   5.746  -8.891   3.827
  777    HA   ALA 104           HA       ALA 104   4.491 -11.366   3.634
  778    HB1  ALA 104           HB1      ALA 104   7.199 -10.389   2.766
  779    HB2  ALA 104           HB2      ALA 104   5.799 -10.808   1.778
  780    HB3  ALA 104           HB3      ALA 104   6.763 -12.081   2.525
  781    H    THR 105           H        THR 105   4.308 -12.779   5.335
  782    HA   THR 105           HA       THR 105   6.115 -13.063   7.483
  783    HB   THR 105           HB       THR 105   5.039 -15.568   7.303
  784    HG1  THR 105           HG1      THR 105   3.344 -13.770   5.913
  785   HG21  THR 105          HG21      THR 105   3.040 -14.473   8.536
  786   HG22  THR 105          HG22      THR 105   3.920 -12.960   8.314
  787   HG23  THR 105          HG23      THR 105   4.648 -14.276   9.236
  788    HA   PRO 106           HA       PRO 106   9.774 -15.209   6.255
  789    HB2  PRO 106           HB2      PRO 106   8.739 -17.576   7.774
  790    HB3  PRO 106           HB3      PRO 106  10.340 -16.814   7.830
  791    HG2  PRO 106           HG3      PRO 106   8.452 -16.413   9.717
  792    HG3  PRO 106           HG2      PRO 106   9.671 -15.203   9.287
  793    HD2  PRO 106           HD3      PRO 106   6.778 -15.149   8.800
  794    HD3  PRO 106           HD2      PRO 106   7.960 -13.828   8.682
  Start of MODEL    3
    1    H1   SER   1           H        SER   1  10.217  23.983  -6.285
    2    H2   SER   1           H2       SER   1  10.627  22.943  -7.566
    3    H3   SER   1           1HT      SER   1   9.132  22.776  -6.776
    4    HA   SER   1           HA       SER   1  10.559  22.396  -4.676
    5    HB2  SER   1           HB3      SER   1  10.445  20.285  -6.847
    6    HB3  SER   1           HB2      SER   1  10.518  20.008  -5.110
    7    HG   SER   1           HG       SER   1   8.473  20.670  -4.903
    8    H    SER   2           H        SER   2  12.646  22.048  -3.971
    9    HA   SER   2           HA       SER   2  14.795  22.428  -5.965
   10    HB2  SER   2           HB3      SER   2  14.945  23.741  -3.920
   11    HB3  SER   2           HB2      SER   2  14.828  22.286  -2.935
   12    HG   SER   2           HG       SER   2  16.822  22.411  -4.889
   13    H    LEU   3           H        LEU   3  14.433  20.232  -3.153
   14    HA   LEU   3           HA       LEU   3  14.822  17.847  -4.724
   15    HB2  LEU   3           HB3      LEU   3  17.148  19.105  -4.608
   16    HB3  LEU   3           HB2      LEU   3  17.204  18.404  -2.991
   17    HG   LEU   3           HG       LEU   3  16.457  16.211  -4.315
   18   HD11  LEU   3          HD11      LEU   3  18.102  17.729  -6.361
   19   HD12  LEU   3          HD12      LEU   3  16.359  17.487  -6.481
   20   HD13  LEU   3          HD13      LEU   3  17.447  16.100  -6.525
   21   HD21  LEU   3          HD21      LEU   3  18.863  15.613  -4.459
   22   HD22  LEU   3          HD22      LEU   3  18.489  16.436  -2.944
   23   HD23  LEU   3          HD23      LEU   3  19.286  17.313  -4.250
   24    H    ILE   4           H        ILE   4  13.578  16.495  -3.524
   25    HA   ILE   4           HA       ILE   4  13.475  16.842  -0.586
   26    HB   ILE   4           HB       ILE   4  11.766  14.827  -1.005
   27   HG12  ILE   4          HG13      ILE   4  11.639  16.315  -3.635
   28   HG13  ILE   4          HG12      ILE   4  12.543  14.809  -3.463
   29   HG21  ILE   4          HG21      ILE   4  11.139  17.003  -0.101
   30   HG22  ILE   4          HG22      ILE   4  10.005  16.563  -1.377
   31   HG23  ILE   4          HG23      ILE   4  11.278  17.741  -1.696
   32   HD11  ILE   4          HD11      ILE   4   9.719  14.908  -2.466
   33   HD12  ILE   4          HD12      ILE   4  10.631  13.542  -3.108
   34   HD13  ILE   4          HD13      ILE   4   9.998  14.772  -4.202
   35    H    LEU   5           H        LEU   5  14.930  15.714   0.603
   36    HA   LEU   5           HA       LEU   5  16.130  13.251  -0.525
   37    HB2  LEU   5           HB3      LEU   5  16.773  14.803   2.003
   38    HB3  LEU   5           HB2      LEU   5  17.686  13.422   1.393
   39    HG   LEU   5           HG       LEU   5  17.227  15.597  -0.561
   40   HD11  LEU   5          HD11      LEU   5  18.818  15.957   1.973
   41   HD12  LEU   5          HD12      LEU   5  17.700  17.084   1.204
   42   HD13  LEU   5          HD13      LEU   5  19.285  16.788   0.490
   43   HD21  LEU   5          HD21      LEU   5  19.809  14.259   0.262
   44   HD22  LEU   5          HD22      LEU   5  19.390  14.957  -1.302
   45   HD23  LEU   5          HD23      LEU   5  18.643  13.447  -0.783
   46    H    LEU   6           H        LEU   6  13.405  13.932   1.157
   47    HA   LEU   6           HA       LEU   6  13.461  12.142   3.377
   48    HB2  LEU   6           HB3      LEU   6  11.671  13.878   2.816
   49    HB3  LEU   6           HB2      LEU   6  11.029  12.705   1.664
   50    HG   LEU   6           HG       LEU   6  11.245  11.099   3.809
   51   HD11  LEU   6          HD11      LEU   6  10.917  12.192   5.861
   52   HD12  LEU   6          HD12      LEU   6  10.403  13.692   5.088
   53   HD13  LEU   6          HD13      LEU   6  12.103  13.225   5.062
   54   HD21  LEU   6          HD21      LEU   6   8.824  11.742   4.293
   55   HD22  LEU   6          HD22      LEU   6   9.181  11.353   2.610
   56   HD23  LEU   6          HD23      LEU   6   9.023  13.037   3.112
   57    H    SER   7           H        SER   7  14.598  10.256   2.562
   58    HA   SER   7           HA       SER   7  13.195   8.653   0.500
   59    HB2  SER   7           HB3      SER   7  15.667   8.875   0.388
   60    HB3  SER   7           HB2      SER   7  15.795   8.117   1.972
   61    HG   SER   7           HG       SER   7  14.249   6.740   0.164
   62    H    ALA   8           H        ALA   8  11.758   7.116   1.112
   63    HA   ALA   8           HA       ALA   8  11.650   6.320   3.965
   64    HB1  ALA   8           HB1      ALA   8   9.766   5.774   1.651
   65    HB2  ALA   8           HB2      ALA   8   9.542   6.985   2.915
   66    HB3  ALA   8           HB3      ALA   8   9.486   5.268   3.317
   67    H    SER   9           H        SER   9  13.860   5.193   3.210
   68    HA   SER   9           HA       SER   9  13.379   2.586   1.916
   69    HB2  SER   9           HB3      SER   9  15.932   3.703   3.107
   70    HB3  SER   9           HB2      SER   9  15.795   2.295   2.060
   71    HG   SER   9           HG       SER   9  15.572   5.017   1.473
   72    H    ASP  10           H        ASP  10  12.849   3.740   4.934
   73    HA   ASP  10           HA       ASP  10  13.933   1.404   6.392
   74    HB2  ASP  10           HB3      ASP  10  12.262   3.709   7.438
   75    HB3  ASP  10           HB2      ASP  10  13.173   2.544   8.400
   76    H    LEU  11           H        LEU  11  10.946   2.596   5.054
   77    HA   LEU  11           HA       LEU  11   9.376   0.504   6.463
   78    HB2  LEU  11           HB3      LEU  11   8.495   2.686   4.545
   79    HB3  LEU  11           HB2      LEU  11   7.419   1.601   5.423
   80    HG   LEU  11           HG       LEU  11   9.379   3.528   6.711
   81   HD11  LEU  11          HD11      LEU  11   7.008   4.456   7.483
   82   HD12  LEU  11          HD12      LEU  11   6.486   3.711   5.973
   83   HD13  LEU  11          HD13      LEU  11   7.727   4.962   5.954
   84   HD21  LEU  11          HD21      LEU  11   9.099   1.898   8.335
   85   HD22  LEU  11          HD22      LEU  11   7.508   1.425   7.740
   86   HD23  LEU  11          HD23      LEU  11   7.692   2.903   8.680
   87    H    ALA  12           H        ALA  12  10.771   1.271   3.371
   88    HA   ALA  12           HA       ALA  12   9.319  -0.222   1.543
   89    HB1  ALA  12           HB1      ALA  12  11.195  -0.177   0.204
   90    HB2  ALA  12           HB2      ALA  12  12.270  -0.661   1.516
   91    HB3  ALA  12           HB3      ALA  12  11.701   1.005   1.413
   92    H    GLY  13           H        GLY  13   9.858  -2.471   0.678
   93    HA2  GLY  13           HA3      GLY  13  11.119  -4.586   1.682
   94    HA3  GLY  13           HA2      GLY  13   9.948  -4.348   2.973
   95    H    GLN  14           H        GLN  14   9.004  -6.423   2.465
   96    HA   GLN  14           HA       GLN  14   7.357  -6.415  -0.035
   97    HB2  GLN  14           HB3      GLN  14   8.040  -8.925   1.475
   98    HB3  GLN  14           HB2      GLN  14   7.632  -8.730  -0.231
   99    HG2  GLN  14           HG3      GLN  14   9.837  -7.328  -0.340
  100    HG3  GLN  14           HG2      GLN  14  10.238  -8.166   1.160
  101   HE21  GLN  14          HE22      GLN  14   9.699  -8.614  -2.309
  102   HE22  GLN  14          HE21      GLN  14  10.265 -10.213  -2.370
  103    H    TRP  15           H        TRP  15   5.153  -7.089   0.258
  104    HA   TRP  15           HA       TRP  15   4.272  -7.646   3.021
  105    HB2  TRP  15           HB3      TRP  15   3.221  -5.300   1.411
  106    HB3  TRP  15           HB2      TRP  15   2.530  -5.879   2.917
  107    HD1  TRP  15           HD1      TRP  15   5.924  -4.476   1.620
  108    HE1  TRP  15           HE1      TRP  15   7.042  -3.225   3.571
  109    HE3  TRP  15           HE3      TRP  15   2.547  -5.420   5.337
  110    HZ2  TRP  15           HZ2      TRP  15   6.575  -2.687   6.338
  111    HZ3  TRP  15           HZ3      TRP  15   2.913  -4.526   7.618
  112    HH2  TRP  15           HH2      TRP  15   4.918  -3.159   8.125
  113    H    THR  16           H        THR  16   1.746  -7.891   2.919
  114    HA   THR  16           HA       THR  16   0.872  -9.040   0.309
  115    HB   THR  16           HB       THR  16   0.098 -11.106   1.458
  116    HG1  THR  16           HG1      THR  16   1.227  -9.755   3.616
  117   HG21  THR  16          HG21      THR  16   3.063 -10.586   1.806
  118   HG22  THR  16          HG22      THR  16   2.286 -11.115   0.314
  119   HG23  THR  16          HG23      THR  16   2.300 -12.171   1.722
  120    H    LEU  17           H        LEU  17  -1.496  -9.498   0.377
  121    HA   LEU  17           HA       LEU  17  -2.899  -7.695   2.318
  122    HB2  LEU  17           HB3      LEU  17  -2.991  -7.734  -0.479
  123    HB3  LEU  17           HB2      LEU  17  -4.468  -8.560   0.014
  124    HG   LEU  17           HG       LEU  17  -4.875  -6.633   1.620
  125   HD11  LEU  17          HD11      LEU  17  -3.270  -4.781   0.039
  126   HD12  LEU  17          HD12      LEU  17  -2.269  -5.955   0.891
  127   HD13  LEU  17          HD13      LEU  17  -3.393  -4.938   1.791
  128   HD21  LEU  17          HD21      LEU  17  -6.205  -6.646  -0.336
  129   HD22  LEU  17          HD22      LEU  17  -4.829  -6.293  -1.378
  130   HD23  LEU  17          HD23      LEU  17  -5.482  -5.037  -0.328
  131    H    GLN  18           H        GLN  18  -4.405  -8.647   3.650
  132    HA   GLN  18           HA       GLN  18  -5.183 -11.480   3.071
  133    HB2  GLN  18           HB3      GLN  18  -3.711 -10.410   5.322
  134    HB3  GLN  18           HB2      GLN  18  -5.234 -11.115   5.862
  135    HG2  GLN  18           HG3      GLN  18  -4.719 -13.207   4.716
  136    HG3  GLN  18           HG2      GLN  18  -3.241 -12.510   4.053
  137   HE21  GLN  18          HE22      GLN  18  -1.443 -12.111   5.546
  138   HE22  GLN  18          HE21      GLN  18  -1.400 -12.842   7.079
  139    H    GLN  19           H        GLN  19  -7.335 -11.536   2.765
  140    HA   GLN  19           HA       GLN  19  -9.054  -9.665   4.360
  141    HB2  GLN  19           HB3      GLN  19 -10.663 -10.102   2.344
  142    HB3  GLN  19           HB2      GLN  19  -9.328  -8.972   2.134
  143    HG2  GLN  19           HG3      GLN  19  -8.826 -11.857   1.548
  144    HG3  GLN  19           HG2      GLN  19  -9.749 -10.915   0.378
  145   HE21  GLN  19          HE22      GLN  19  -6.703 -11.927   0.760
  146   HE22  GLN  19          HE21      GLN  19  -5.834 -10.581   0.200
  147    H    ASP  20           H        ASP  20  -9.585 -11.145   6.028
  148    HA   ASP  20           HA       ASP  20 -10.557 -13.057   7.006
  149    HB2  ASP  20           HB3      ASP  20 -12.565 -12.032   6.040
  150    HB3  ASP  20           HB2      ASP  20 -12.241 -12.814   4.493
  151    H    GLU  21           H        GLU  21  -8.434 -13.307   4.756
  152    HA   GLU  21           HA       GLU  21  -7.468 -15.008   3.426
  153    HB2  GLU  21           HB3      GLU  21  -7.092 -15.502   5.970
  154    HB3  GLU  21           HB2      GLU  21  -8.204 -16.841   5.686
  155    HG2  GLU  21           HG3      GLU  21  -6.609 -17.196   3.561
  156    HG3  GLU  21           HG2      GLU  21  -5.447 -16.412   4.632
  157    H    ALA  22           H        ALA  22  -9.847 -14.735   2.288
  158    HA   ALA  22           HA       ALA  22 -10.538 -17.514   1.640
  159    HB1  ALA  22           HB1      ALA  22 -12.275 -17.561   3.091
  160    HB2  ALA  22           HB2      ALA  22 -13.097 -16.592   1.876
  161    HB3  ALA  22           HB3      ALA  22 -12.325 -15.809   3.259
  162    HA   PRO  23           HA       PRO  23 -12.989 -14.466  -1.449
  163    HB2  PRO  23           HB2      PRO  23 -11.317 -12.085  -0.940
  164    HB3  PRO  23           HB3      PRO  23 -13.063 -12.198  -1.196
  165    HG2  PRO  23           HG3      PRO  23 -11.718 -11.874   1.249
  166    HG3  PRO  23           HG2      PRO  23 -13.440 -12.175   1.005
  167    HD2  PRO  23           HD3      PRO  23 -11.572 -13.931   2.198
  168    HD3  PRO  23           HD2      PRO  23 -13.242 -14.308   1.736
  169    H    ALA  24           H        ALA  24  -9.600 -13.513  -0.743
  170    HA   ALA  24           HA       ALA  24  -8.354 -15.101  -2.710
  171    HB1  ALA  24           HB1      ALA  24  -9.572 -12.567  -3.724
  172    HB2  ALA  24           HB2      ALA  24  -9.341 -14.109  -4.550
  173    HB3  ALA  24           HB3      ALA  24  -7.977 -13.011  -4.334
  174    H    ILE  25           H        ILE  25  -6.103 -14.793  -2.596
  175    HA   ILE  25           HA       ILE  25  -5.201 -12.604  -0.777
  176    HB   ILE  25           HB       ILE  25  -4.580 -14.779   0.046
  177   HG12  ILE  25          HG13      ILE  25  -2.109 -13.803  -1.398
  178   HG13  ILE  25          HG12      ILE  25  -2.824 -12.890  -0.070
  179   HG21  ILE  25          HG21      ILE  25  -3.266 -16.349  -1.383
  180   HG22  ILE  25          HG22      ILE  25  -3.501 -15.259  -2.749
  181   HG23  ILE  25          HG23      ILE  25  -4.887 -16.061  -2.011
  182   HD11  ILE  25          HD11      ILE  25  -2.020 -15.804   0.128
  183   HD12  ILE  25          HD12      ILE  25  -2.550 -14.758   1.446
  184   HD13  ILE  25          HD13      ILE  25  -1.001 -14.465   0.655
  185    H    CYS  26           H        CYS  26  -3.045 -11.628  -1.341
  186    HA   CYS  26           HA       CYS  26  -2.201 -11.850  -4.146
  187    HB2  CYS  26           HB3      CYS  26  -3.535  -9.370  -3.043
  188    HB3  CYS  26           HB2      CYS  26  -2.474  -9.323  -4.448
  189    H    HIS  27           H        HIS  27  -0.028 -11.572  -4.208
  190    HA   HIS  27           HA       HIS  27   1.400 -10.712  -1.808
  191    HB2  HIS  27           HB3      HIS  27   1.993 -12.263  -4.164
  192    HB3  HIS  27           HB2      HIS  27   3.197 -10.987  -3.986
  193    HD1  HIS  27           HD1      HIS  27   5.103 -11.645  -2.531
  194    HD2  HIS  27           HD2      HIS  27   1.586 -13.586  -1.402
  195    HE1  HIS  27           HE1      HIS  27   5.707 -13.150  -0.583
  196    HE2  HIS  27           HE2      HIS  27   3.576 -14.335   0.111
  197    H    LEU  28           H        LEU  28   2.654  -8.833  -1.641
  198    HA   LEU  28           HA       LEU  28   2.324  -6.822  -3.840
  199    HB2  LEU  28           HB3      LEU  28   1.872  -6.613  -0.874
  200    HB3  LEU  28           HB2      LEU  28   2.246  -5.183  -1.821
  201    HG   LEU  28           HG       LEU  28   0.190  -6.801  -3.114
  202   HD11  LEU  28          HD11      LEU  28  -0.240  -5.905  -0.269
  203   HD12  LEU  28          HD12      LEU  28  -0.547  -7.491  -0.971
  204   HD13  LEU  28          HD13      LEU  28  -1.573  -6.122  -1.399
  205   HD21  LEU  28          HD21      LEU  28  -0.971  -4.617  -3.115
  206   HD22  LEU  28          HD22      LEU  28   0.696  -4.455  -3.662
  207   HD23  LEU  28          HD23      LEU  28   0.253  -3.970  -2.025
  208    H    GLU  29           H        GLU  29   3.913  -4.977  -3.599
  209    HA   GLU  29           HA       GLU  29   6.446  -5.716  -2.249
  210    HB2  GLU  29           HB3      GLU  29   5.959  -6.092  -5.060
  211    HB3  GLU  29           HB2      GLU  29   7.153  -4.809  -4.853
  212    HG2  GLU  29           HG3      GLU  29   8.461  -6.297  -3.354
  213    HG3  GLU  29           HG2      GLU  29   7.290  -7.584  -3.637
  214    H    LEU  30           H        LEU  30   6.914  -3.898  -1.127
  215    HA   LEU  30           HA       LEU  30   6.027  -1.270  -2.137
  216    HB2  LEU  30           HB3      LEU  30   6.937  -2.394   0.444
  217    HB3  LEU  30           HB2      LEU  30   7.448  -0.737   0.131
  218    HG   LEU  30           HG       LEU  30   5.123  -0.088  -0.323
  219   HD11  LEU  30          HD11      LEU  30   4.765  -3.028  -0.179
  220   HD12  LEU  30          HD12      LEU  30   3.920  -1.837  -1.168
  221   HD13  LEU  30          HD13      LEU  30   3.478  -2.048   0.526
  222   HD21  LEU  30          HD21      LEU  30   6.112  -0.222   2.061
  223   HD22  LEU  30          HD22      LEU  30   5.118  -1.665   2.252
  224   HD23  LEU  30          HD23      LEU  30   4.358  -0.107   1.924
  225    H    ARG  31           H        ARG  31   7.351  -0.536  -3.763
  226    HA   ARG  31           HA       ARG  31  10.199  -1.108  -3.831
  227    HB2  ARG  31           HB3      ARG  31   8.222   0.245  -5.520
  228    HB3  ARG  31           HB2      ARG  31   9.808   1.017  -5.552
  229    HG2  ARG  31           HG3      ARG  31  10.878  -1.068  -6.169
  230    HG3  ARG  31           HG2      ARG  31   9.368  -1.955  -5.957
  231    HD2  ARG  31           HD3      ARG  31   9.610  -1.577  -8.315
  232    HD3  ARG  31           HD2      ARG  31   8.367  -0.463  -7.752
  233    HE   ARG  31           HE       ARG  31   9.841   1.344  -8.193
  234   HH11  ARG  31          HH22      ARG  31  11.407  -1.728  -8.324
  235   HH12  ARG  31          HH21      ARG  31  12.870  -1.099  -9.005
  236   HH21  ARG  31          HH11      ARG  31  11.744   2.178  -9.080
  237   HH22  ARG  31          HH12      ARG  31  13.061   1.111  -9.431
  238    H    ASP  32           H        ASP  32  11.877   0.599  -3.810
  239    HA   ASP  32           HA       ASP  32  11.240   2.733  -1.809
  240    HB2  ASP  32           HB3      ASP  32  13.369   2.473  -0.912
  241    HB3  ASP  32           HB2      ASP  32  13.020   0.817  -1.409
  242    H    SER  33           H        SER  33  11.307   2.542  -4.975
  243    HA   SER  33           HA       SER  33  13.309   4.558  -5.664
  244    HB2  SER  33           HB3      SER  33  12.669   2.932  -7.355
  245    HB3  SER  33           HB2      SER  33  10.976   3.394  -7.215
  246    HG   SER  33           HG       SER  33  13.107   5.097  -8.017
  247    H    GLU  34           H        GLU  34  12.741   6.725  -6.461
  248    HA   GLU  34           HA       GLU  34  10.460   7.853  -4.940
  249    HB2  GLU  34           HB3      GLU  34  11.525  10.053  -5.696
  250    HB3  GLU  34           HB2      GLU  34  12.493   9.060  -4.607
  251    HG2  GLU  34           HG3      GLU  34  13.835   8.231  -6.412
  252    HG3  GLU  34           HG2      GLU  34  12.744   8.911  -7.620
  253    H    VAL  35           H        VAL  35   8.814   9.078  -5.954
  254    HA   VAL  35           HA       VAL  35   8.770   9.083  -8.937
  255    HB   VAL  35           HB       VAL  35   6.476   8.151  -7.182
  256   HG11  VAL  35          HG11      VAL  35   5.700   9.311  -9.183
  257   HG12  VAL  35          HG12      VAL  35   5.450   7.578  -9.389
  258   HG13  VAL  35          HG13      VAL  35   6.804   8.375 -10.188
  259   HG21  VAL  35          HG21      VAL  35   8.126   6.407  -7.249
  260   HG22  VAL  35          HG22      VAL  35   8.430   6.675  -8.964
  261   HG23  VAL  35          HG23      VAL  35   6.900   5.974  -8.440
  262    H    ALA  36           H        ALA  36   8.568  11.213  -9.441
  263    HA   ALA  36           HA       ALA  36   7.337  13.088  -7.559
  264    HB1  ALA  36           HB1      ALA  36   8.955  13.243 -10.018
  265    HB2  ALA  36           HB2      ALA  36   8.957  14.294  -8.602
  266    HB3  ALA  36           HB3      ALA  36   7.745  14.517  -9.864
  267    H    GLU  37           H        GLU  37   6.417  11.441 -10.532
  268    HA   GLU  37           HA       GLU  37   4.267  13.048 -11.375
  269    HB2  GLU  37           HB3      GLU  37   4.759  11.232 -12.785
  270    HB3  GLU  37           HB2      GLU  37   4.745  10.076 -11.453
  271    HG2  GLU  37           HG3      GLU  37   2.412  10.007 -11.357
  272    HG3  GLU  37           HG2      GLU  37   2.234  11.586 -12.125
  273    H    ALA  38           H        ALA  38   4.473  10.781  -8.694
  274    HA   ALA  38           HA       ALA  38   1.715  11.597  -7.860
  275    HB1  ALA  38           HB1      ALA  38   1.279   9.372  -7.986
  276    HB2  ALA  38           HB2      ALA  38   2.227   9.257  -6.504
  277    HB3  ALA  38           HB3      ALA  38   2.991   8.958  -8.064
  278    H    SER  39           H        SER  39   4.905  12.011  -7.213
  279    HA   SER  39           HA       SER  39   6.063  12.760  -5.324
  280    HB2  SER  39           HB3      SER  39   4.904  14.237  -3.935
  281    HB3  SER  39           HB2      SER  39   3.866  14.218  -5.357
  282    HG   SER  39           HG       SER  39   2.673  12.529  -4.282
  283    H    GLY  40           H        GLY  40   5.761  10.026  -5.454
  284    HA2  GLY  40           HA3      GLY  40   5.805   9.312  -2.604
  285    HA3  GLY  40           HA2      GLY  40   4.537   8.522  -3.543
  286    H    TYR  41           H        TYR  41   5.590   6.460  -3.152
  287    HA   TYR  41           HA       TYR  41   8.090   6.056  -4.736
  288    HB2  TYR  41           HB3      TYR  41   7.024   4.490  -2.369
  289    HB3  TYR  41           HB2      TYR  41   8.509   4.127  -3.250
  290    HD1  TYR  41           HD1      TYR  41   6.805   6.884  -1.370
  291    HD2  TYR  41           HD2      TYR  41  10.522   5.154  -2.635
  292    HE1  TYR  41           HE1      TYR  41   8.042   8.529   0.013
  293    HE2  TYR  41           HE2      TYR  41  11.763   6.794  -1.250
  294    HH   TYR  41           HH       TYR  41  10.088   8.977   0.945
  295    H    ASP  42           H        ASP  42   8.168   4.147  -6.052
  296    HA   ASP  42           HA       ASP  42   5.750   3.526  -7.399
  297    HB2  ASP  42           HB3      ASP  42   8.026   3.264  -8.371
  298    HB3  ASP  42           HB2      ASP  42   8.280   1.864  -7.335
  299    H    LEU  43           H        LEU  43   4.674   1.501  -7.556
  300    HA   LEU  43           HA       LEU  43   4.814  -0.219  -5.116
  301    HB2  LEU  43           HB3      LEU  43   2.892   1.365  -4.872
  302    HB3  LEU  43           HB2      LEU  43   2.239   0.769  -6.390
  303    HG   LEU  43           HG       LEU  43   1.863  -1.428  -5.464
  304   HD11  LEU  43          HD11      LEU  43   3.539  -0.393  -3.185
  305   HD12  LEU  43          HD12      LEU  43   3.675  -1.922  -4.056
  306   HD13  LEU  43          HD13      LEU  43   2.361  -1.674  -2.908
  307   HD21  LEU  43          HD21      LEU  43   0.925  -0.093  -3.068
  308   HD22  LEU  43          HD22      LEU  43  -0.007  -0.736  -4.416
  309   HD23  LEU  43          HD23      LEU  43   0.638   0.901  -4.493
  310    H    GLY  44           H        GLY  44   5.840  -1.894  -6.299
  311    HA2  GLY  44           HA3      GLY  44   4.447  -2.945  -8.690
  312    HA3  GLY  44           HA2      GLY  44   6.034  -3.454  -8.116
  313    H    GLY  45           H        GLY  45   4.954  -5.640  -8.528
  314    HA2  GLY  45           HA3      GLY  45   4.567  -7.596  -7.148
  315    HA3  GLY  45           HA2      GLY  45   3.716  -6.579  -5.992
  316    H    ASP  46           H        ASP  46   1.844  -7.974  -6.096
  317    HA   ASP  46           HA       ASP  46   0.495  -8.329  -8.660
  318    HB2  ASP  46           HB3      ASP  46   0.563  -9.932  -6.558
  319    HB3  ASP  46           HB2      ASP  46  -0.782  -8.937  -6.012
  320    H    THR  47           H        THR  47   0.406  -5.943  -8.945
  321    HA   THR  47           HA       THR  47  -1.608  -4.527  -7.294
  322    HB   THR  47           HB       THR  47  -0.953  -2.553  -8.448
  323    HG1  THR  47           HG1      THR  47   0.025  -2.593 -10.423
  324   HG21  THR  47          HG21      THR  47   1.166  -2.457  -7.678
  325   HG22  THR  47          HG22      THR  47   1.708  -3.726  -8.776
  326   HG23  THR  47          HG23      THR  47   0.954  -4.152  -7.240
  327    H    ALA  48           H        ALA  48  -1.265  -6.349 -10.131
  328    HA   ALA  48           HA       ALA  48  -3.614  -5.321 -11.536
  329    HB1  ALA  48           HB1      ALA  48  -1.484  -6.753 -12.361
  330    HB2  ALA  48           HB2      ALA  48  -3.025  -6.766 -13.221
  331    HB3  ALA  48           HB3      ALA  48  -2.627  -8.072 -12.103
  332    H    CYS  49           H        CYS  49  -3.529  -6.757  -8.676
  333    HA   CYS  49           HA       CYS  49  -5.875  -8.552  -9.186
  334    HB2  CYS  49           HB3      CYS  49  -4.775 -10.032  -7.891
  335    HB3  CYS  49           HB2      CYS  49  -3.491  -8.860  -7.599
  336    H    LEU  50           H        LEU  50  -4.677  -5.778  -7.449
  337    HA   LEU  50           HA       LEU  50  -6.752  -5.543  -5.496
  338    HB2  LEU  50           HB3      LEU  50  -5.294  -3.255  -6.827
  339    HB3  LEU  50           HB2      LEU  50  -5.996  -3.276  -5.214
  340    HG   LEU  50           HG       LEU  50  -3.716  -5.074  -6.096
  341   HD11  LEU  50          HD11      LEU  50  -3.401  -2.433  -5.822
  342   HD12  LEU  50          HD12      LEU  50  -2.192  -3.570  -5.243
  343   HD13  LEU  50          HD13      LEU  50  -3.353  -2.869  -4.118
  344   HD21  LEU  50          HD21      LEU  50  -5.121  -4.564  -3.470
  345   HD22  LEU  50          HD22      LEU  50  -3.499  -5.251  -3.538
  346   HD23  LEU  50          HD23      LEU  50  -4.848  -6.107  -4.279
  347    H    THR  51           H        THR  51  -7.084  -5.565  -8.780
  348    HA   THR  51           HA       THR  51  -8.844  -3.349  -9.257
  349    HB   THR  51           HB       THR  51  -9.717  -5.218 -11.033
  350    HG1  THR  51           HG1      THR  51  -7.180  -5.990 -10.069
  351   HG21  THR  51          HG21      THR  51  -7.845  -4.372 -12.507
  352   HG22  THR  51          HG22      THR  51  -7.188  -3.559 -11.086
  353   HG23  THR  51          HG23      THR  51  -8.777  -3.110 -11.704
  354    H    ARG  52           H        ARG  52  -9.213  -5.801  -7.121
  355    HA   ARG  52           HA       ARG  52 -12.178  -5.985  -7.486
  356    HB2  ARG  52           HB3      ARG  52 -12.049  -7.949  -6.000
  357    HB3  ARG  52           HB2      ARG  52 -10.995  -8.153  -7.400
  358    HG2  ARG  52           HG3      ARG  52  -9.143  -7.141  -5.903
  359    HG3  ARG  52           HG2      ARG  52 -10.231  -7.489  -4.559
  360    HD2  ARG  52           HD3      ARG  52  -8.803  -9.384  -6.381
  361    HD3  ARG  52           HD2      ARG  52  -9.044  -9.475  -4.637
  362    HE   ARG  52           HE       ARG  52 -10.819 -10.573  -6.643
  363   HH11  ARG  52          HH22      ARG  52 -10.616  -9.049  -3.555
  364   HH12  ARG  52          HH21      ARG  52 -12.083  -9.754  -2.963
  365   HH21  ARG  52          HH11      ARG  52 -12.735 -11.502  -5.887
  366   HH22  ARG  52          HH12      ARG  52 -13.283 -11.141  -4.284
  367    H    TRP  53           H        TRP  53  -9.647  -4.748  -5.485
  368    HA   TRP  53           HA       TRP  53 -11.647  -3.998  -3.380
  369    HB2  TRP  53           HB3      TRP  53  -8.629  -4.205  -3.159
  370    HB3  TRP  53           HB2      TRP  53  -9.735  -3.799  -1.849
  371    HD1  TRP  53           HD1      TRP  53 -11.955  -5.925  -2.142
  372    HE1  TRP  53           HE1      TRP  53 -11.469  -8.425  -1.765
  373    HE3  TRP  53           HE3      TRP  53  -6.899  -5.966  -2.879
  374    HZ2  TRP  53           HZ2      TRP  53  -9.232 -10.208  -1.765
  375    HZ3  TRP  53           HZ3      TRP  53  -5.618  -8.079  -2.677
  376    HH2  TRP  53           HH2      TRP  53  -6.781 -10.199  -2.118
  377    H    LEU  54           H        LEU  54  -9.081  -2.888  -5.503
  378    HA   LEU  54           HA       LEU  54  -9.565  -0.080  -4.640
  379    HB2  LEU  54           HB3      LEU  54  -7.336  -1.420  -6.180
  380    HB3  LEU  54           HB2      LEU  54  -7.463   0.328  -6.068
  381    HG   LEU  54           HG       LEU  54  -7.332  -1.533  -3.672
  382   HD11  LEU  54          HD11      LEU  54  -5.236  -1.074  -5.310
  383   HD12  LEU  54          HD12      LEU  54  -5.063  -1.258  -3.568
  384   HD13  LEU  54          HD13      LEU  54  -5.121   0.353  -4.284
  385   HD21  LEU  54          HD21      LEU  54  -7.833   1.341  -4.022
  386   HD22  LEU  54          HD22      LEU  54  -6.541   0.982  -2.881
  387   HD23  LEU  54          HD23      LEU  54  -8.151   0.305  -2.636
  388    HA   PRO  55           HA       PRO  55 -11.732   0.607  -8.463
  389    HB2  PRO  55           HB2      PRO  55 -11.425   3.270  -8.834
  390    HB3  PRO  55           HB3      PRO  55 -12.409   2.611  -7.513
  391    HG2  PRO  55           HG3      PRO  55  -9.641   3.696  -7.448
  392    HG3  PRO  55           HG2      PRO  55 -10.961   3.907  -6.287
  393    HD2  PRO  55           HD3      PRO  55  -8.893   2.125  -5.939
  394    HD3  PRO  55           HD2      PRO  55 -10.494   1.938  -5.199
  395    H    SER  56           H        SER  56  -8.359   1.181  -8.246
  396    HA   SER  56           HA       SER  56  -8.046   0.728 -11.128
  397    HB2  SER  56           HB3      SER  56  -6.746   3.191  -9.967
  398    HB3  SER  56           HB2      SER  56  -6.928   2.747 -11.661
  399    HG   SER  56           HG       SER  56  -8.848   3.703  -9.829
  400    H    GLU  57           H        GLU  57  -5.721   0.334 -11.655
  401    HA   GLU  57           HA       GLU  57  -4.441  -1.152  -9.534
  402    HB2  GLU  57           HB3      GLU  57  -4.267  -1.820 -11.902
  403    HB3  GLU  57           HB2      GLU  57  -3.377  -0.340 -12.252
  404    HG2  GLU  57           HG3      GLU  57  -1.563  -1.011 -10.798
  405    HG3  GLU  57           HG2      GLU  57  -2.475  -2.411 -10.235
  406    HA   PRO  58           HA       PRO  58  -2.355   2.632  -8.092
  407    HB2  PRO  58           HB2      PRO  58  -1.035   1.518  -5.972
  408    HB3  PRO  58           HB3      PRO  58  -2.717   2.044  -5.914
  409    HG2  PRO  58           HG3      PRO  58  -1.594  -0.670  -6.113
  410    HG3  PRO  58           HG2      PRO  58  -3.104  -0.118  -5.385
  411    HD2  PRO  58           HD3      PRO  58  -2.888  -1.395  -7.849
  412    HD3  PRO  58           HD2      PRO  58  -4.280  -0.430  -7.320
  413    H    ARG  59           H        ARG  59  -0.557   3.396  -9.020
  414    HA   ARG  59           HA       ARG  59   1.761   1.562  -9.440
  415    HB2  ARG  59           HB3      ARG  59   0.498   3.562 -11.080
  416    HB3  ARG  59           HB2      ARG  59   2.172   4.031 -10.772
  417    HG2  ARG  59           HG3      ARG  59   2.977   1.883 -11.570
  418    HG3  ARG  59           HG2      ARG  59   1.326   1.284 -11.734
  419    HD2  ARG  59           HD3      ARG  59   0.928   2.488 -13.652
  420    HD3  ARG  59           HD2      ARG  59   1.989   3.810 -13.166
  421    HE   ARG  59           HE       ARG  59   3.418   1.330 -13.764
  422   HH11  ARG  59          HH22      ARG  59   2.025   4.254 -14.944
  423   HH12  ARG  59          HH21      ARG  59   3.044   4.331 -16.343
  424   HH21  ARG  59          HH11      ARG  59   4.757   1.412 -15.585
  425   HH22  ARG  59          HH12      ARG  59   4.590   2.723 -16.707
  426    H    ALA  60           H        ALA  60   0.624   4.059  -7.466
  427    HA   ALA  60           HA       ALA  60   3.392   4.562  -6.480
  428    HB1  ALA  60           HB1      ALA  60   2.229   6.971  -6.019
  429    HB2  ALA  60           HB2      ALA  60   1.446   6.529  -7.536
  430    HB3  ALA  60           HB3      ALA  60   3.205   6.621  -7.445
  431    H    TRP  61           H        TRP  61   3.530   4.901  -4.263
  432    HA   TRP  61           HA       TRP  61   1.058   4.974  -2.618
  433    HB2  TRP  61           HB3      TRP  61   1.503   2.990  -1.430
  434    HB3  TRP  61           HB2      TRP  61   1.898   2.524  -3.086
  435    HD1  TRP  61           HD1      TRP  61   4.543   2.612  -3.760
  436    HE1  TRP  61           HE1      TRP  61   6.634   2.186  -2.313
  437    HE3  TRP  61           HE3      TRP  61   2.506   3.117   0.883
  438    HZ2  TRP  61           HZ2      TRP  61   7.341   2.065   0.459
  439    HZ3  TRP  61           HZ3      TRP  61   3.900   2.836   2.913
  440    HH2  TRP  61           HH2      TRP  61   6.315   2.309   2.706
  441    H    ARG  62           H        ARG  62   1.620   5.715  -0.387
  442    HA   ARG  62           HA       ARG  62   4.428   6.393   0.106
  443    HB2  ARG  62           HB3      ARG  62   3.714   8.860   0.507
  444    HB3  ARG  62           HB2      ARG  62   4.046   8.322  -1.137
  445    HG2  ARG  62           HG3      ARG  62   1.658   7.980  -1.547
  446    HG3  ARG  62           HG2      ARG  62   1.289   8.426   0.121
  447    HD2  ARG  62           HD3      ARG  62   2.581  10.636  -0.472
  448    HD3  ARG  62           HD2      ARG  62   2.240  10.166  -2.137
  449    HE   ARG  62           HE       ARG  62  -0.037  10.681  -1.761
  450   HH11  ARG  62          HH22      ARG  62   1.760  10.411   1.170
  451   HH12  ARG  62          HH21      ARG  62   0.478  11.015   2.167
  452   HH21  ARG  62          HH11      ARG  62  -1.722  11.470  -0.473
  453   HH22  ARG  62          HH12      ARG  62  -1.492  11.614   1.237
  454    HA   PRO  63           HA       PRO  63   2.669   5.561   4.218
  455    HB2  PRO  63           HB2      PRO  63   5.067   6.943   5.258
  456    HB3  PRO  63           HB3      PRO  63   4.484   5.304   5.586
  457    HG2  PRO  63           HG3      PRO  63   6.641   5.855   4.045
  458    HG3  PRO  63           HG2      PRO  63   5.639   4.408   3.863
  459    HD2  PRO  63           HD3      PRO  63   5.815   6.791   2.115
  460    HD3  PRO  63           HD2      PRO  63   5.282   5.140   1.742
  461    H    THR  64           H        THR  64   1.574   6.857   5.779
  462    HA   THR  64           HA       THR  64   1.841   9.820   5.437
  463    HB   THR  64           HB       THR  64  -0.721   9.520   6.326
  464    HG1  THR  64           HG1      THR  64  -0.248   7.164   5.952
  465   HG21  THR  64          HG21      THR  64   0.197   9.419   3.437
  466   HG22  THR  64          HG22      THR  64   0.027  10.883   4.404
  467   HG23  THR  64          HG23      THR  64  -1.397   9.930   3.993
  468    HA   PRO  65           HA       PRO  65   2.558   9.986   9.784
  469    HB2  PRO  65           HB2      PRO  65   1.125  12.238  10.520
  470    HB3  PRO  65           HB3      PRO  65   2.705  12.272   9.720
  471    HG2  PRO  65           HG3      PRO  65  -0.007  12.644   8.565
  472    HG3  PRO  65           HG2      PRO  65   1.512  13.469   8.177
  473    HD2  PRO  65           HD3      PRO  65   0.480  11.501   6.608
  474    HD3  PRO  65           HD2      PRO  65   2.227  11.779   6.762
  475    H    ALA  66           H        ALA  66   0.442   8.187   9.079
  476    HA   ALA  66           HA       ALA  66  -0.784   7.698  11.554
  477    HB1  ALA  66           HB1      ALA  66  -3.207   8.431  10.587
  478    HB2  ALA  66           HB2      ALA  66  -2.204   9.696   9.878
  479    HB3  ALA  66           HB3      ALA  66  -2.232   9.469  11.627
  480    H    GLY  67           H        GLY  67   0.105   6.679   8.713
  481    HA2  GLY  67           HA3      GLY  67  -0.830   4.152   8.651
  482    HA3  GLY  67           HA2      GLY  67  -2.233   5.014   8.028
  483    H    ILE  68           H        ILE  68  -1.575   3.467   6.155
  484    HA   ILE  68           HA       ILE  68   0.487   4.763   4.420
  485    HB   ILE  68           HB       ILE  68  -0.747   1.996   4.251
  486   HG12  ILE  68          HG13      ILE  68   2.060   2.801   5.069
  487   HG13  ILE  68          HG12      ILE  68   0.785   2.399   6.216
  488   HG21  ILE  68          HG21      ILE  68   0.045   2.042   2.143
  489   HG22  ILE  68          HG22      ILE  68   1.667   2.123   2.831
  490   HG23  ILE  68          HG23      ILE  68   0.813   3.607   2.408
  491   HD11  ILE  68          HD11      ILE  68   1.061   0.188   5.877
  492   HD12  ILE  68          HD12      ILE  68   2.530   0.593   4.991
  493   HD13  ILE  68          HD13      ILE  68   1.007   0.385   4.126
  494    H    ALA  69           H        ALA  69  -0.111   5.370   2.287
  495    HA   ALA  69           HA       ALA  69  -3.025   5.140   1.626
  496    HB1  ALA  69           HB1      ALA  69  -3.119   7.388   0.957
  497    HB2  ALA  69           HB2      ALA  69  -1.365   7.520   0.826
  498    HB3  ALA  69           HB3      ALA  69  -2.129   7.464   2.415
  499    H    LEU  70           H        LEU  70  -3.485   4.916  -0.615
  500    HA   LEU  70           HA       LEU  70  -1.109   4.230  -2.310
  501    HB2  LEU  70           HB3      LEU  70  -3.904   3.105  -2.334
  502    HB3  LEU  70           HB2      LEU  70  -2.656   2.678  -3.492
  503    HG   LEU  70           HG       LEU  70  -1.963   2.454  -0.601
  504   HD11  LEU  70          HD11      LEU  70  -2.938   0.011  -0.865
  505   HD12  LEU  70          HD12      LEU  70  -4.027   0.793  -2.011
  506   HD13  LEU  70          HD13      LEU  70  -3.980   1.328  -0.331
  507   HD21  LEU  70          HD21      LEU  70  -1.491   0.523  -2.879
  508   HD22  LEU  70          HD22      LEU  70  -0.566   0.696  -1.388
  509   HD23  LEU  70          HD23      LEU  70  -0.474   1.943  -2.633
  510    H    LEU  71           H        LEU  71  -1.015   5.139  -4.353
  511    HA   LEU  71           HA       LEU  71  -3.198   7.069  -5.059
  512    HB2  LEU  71           HB3      LEU  71  -0.360   7.166  -6.094
  513    HB3  LEU  71           HB2      LEU  71  -1.562   8.453  -6.076
  514    HG   LEU  71           HG       LEU  71  -0.235   7.227  -3.638
  515   HD11  LEU  71          HD11      LEU  71   0.394   9.837  -3.539
  516   HD12  LEU  71          HD12      LEU  71   0.264   9.661  -5.288
  517   HD13  LEU  71          HD13      LEU  71   1.400   8.661  -4.384
  518   HD21  LEU  71          HD21      LEU  71  -2.246   7.891  -2.741
  519   HD22  LEU  71          HD22      LEU  71  -2.552   9.064  -4.022
  520   HD23  LEU  71          HD23      LEU  71  -1.430   9.454  -2.720
  521    H    GLU  72           H        GLU  72  -3.201   7.463  -7.556
  522    HA   GLU  72           HA       GLU  72  -3.049   4.799  -8.920
  523    HB2  GLU  72           HB3      GLU  72  -4.675   6.198 -10.542
  524    HB3  GLU  72           HB2      GLU  72  -5.280   5.310  -9.146
  525    HG2  GLU  72           HG3      GLU  72  -5.336   7.289  -7.797
  526    HG3  GLU  72           HG2      GLU  72  -4.419   8.205  -8.994
  527    H    ARG  73           H        ARG  73  -1.005   7.105  -8.609
  528    HA   ARG  73           HA       ARG  73   0.797   7.725 -10.003
  529    HB2  ARG  73           HB3      ARG  73  -0.210   5.743 -11.514
  530    HB3  ARG  73           HB2      ARG  73  -0.656   7.113 -12.532
  531    HG2  ARG  73           HG3      ARG  73   1.799   7.891 -12.168
  532    HG3  ARG  73           HG2      ARG  73   2.088   6.224 -11.668
  533    HD2  ARG  73           HD3      ARG  73   1.398   7.305 -14.360
  534    HD3  ARG  73           HD2      ARG  73   2.475   5.978 -13.924
  535    HE   ARG  73           HE       ARG  73   0.005   4.978 -13.265
  536   HH11  ARG  73          HH22      ARG  73   1.336   6.555 -16.026
  537   HH12  ARG  73          HH21      ARG  73   0.307   5.738 -17.155
  538   HH21  ARG  73          HH11      ARG  73  -1.347   3.902 -14.722
  539   HH22  ARG  73          HH12      ARG  73  -1.214   4.237 -16.416
  540    H    GLY  74           H        GLY  74  -1.366   9.403  -9.118
  541    HA2  GLY  74           HA3      GLY  74  -0.957  11.632 -10.964
  542    HA3  GLY  74           HA2      GLY  74  -2.628  11.071 -10.901
  543    H    GLY  75           H        GLY  75  -1.634  10.314  -7.945
  544    HA2  GLY  75           HA3      GLY  75  -1.301  11.631  -5.925
  545    HA3  GLY  75           HA2      GLY  75  -1.924  13.042  -6.778
  546    H    LEU  76           H        LEU  76  -3.855  10.480  -7.623
  547    HA   LEU  76           HA       LEU  76  -6.005  11.432  -5.862
  548    HB2  LEU  76           HB3      LEU  76  -5.824  10.099  -8.401
  549    HB3  LEU  76           HB2      LEU  76  -6.835   9.139  -7.318
  550    HG   LEU  76           HG       LEU  76  -8.157  11.174  -6.784
  551   HD11  LEU  76          HD11      LEU  76  -5.939  12.433  -8.105
  552   HD12  LEU  76          HD12      LEU  76  -7.281  13.192  -7.252
  553   HD13  LEU  76          HD13      LEU  76  -7.421  12.831  -8.972
  554   HD21  LEU  76          HD21      LEU  76  -8.881   9.667  -8.603
  555   HD22  LEU  76          HD22      LEU  76  -7.897  10.578  -9.749
  556   HD23  LEU  76          HD23      LEU  76  -9.287  11.342  -8.978
  557    H    THR  77           H        THR  77  -5.624  10.693  -3.772
  558    HA   THR  77           HA       THR  77  -4.545   8.203  -3.012
  559    HB   THR  77           HB       THR  77  -6.739   9.162  -1.297
  560    HG1  THR  77           HG1      THR  77  -5.743  11.117  -0.858
  561   HG21  THR  77          HG21      THR  77  -4.863   7.601  -0.659
  562   HG22  THR  77          HG22      THR  77  -5.041   9.000   0.401
  563   HG23  THR  77          HG23      THR  77  -3.760   8.970  -0.811
  564    H    LEU  78           H        LEU  78  -5.313   6.159  -3.217
  565    HA   LEU  78           HA       LEU  78  -8.122   5.798  -4.104
  566    HB2  LEU  78           HB3      LEU  78  -5.906   3.740  -3.906
  567    HB3  LEU  78           HB2      LEU  78  -7.460   3.536  -4.704
  568    HG   LEU  78           HG       LEU  78  -5.740   5.825  -5.568
  569   HD11  LEU  78          HD11      LEU  78  -4.174   3.930  -5.485
  570   HD12  LEU  78          HD12      LEU  78  -4.568   4.325  -7.157
  571   HD13  LEU  78          HD13      LEU  78  -5.318   2.932  -6.380
  572   HD21  LEU  78          HD21      LEU  78  -7.278   3.894  -7.285
  573   HD22  LEU  78          HD22      LEU  78  -6.959   5.609  -7.552
  574   HD23  LEU  78          HD23      LEU  78  -8.145   5.112  -6.347
  575    H    MET  79           H        MET  79  -5.908   4.646  -1.547
  576    HA   MET  79           HA       MET  79  -8.282   4.162   0.158
  577    HB2  MET  79           HB3      MET  79  -7.666   2.058  -1.174
  578    HB3  MET  79           HB2      MET  79  -6.223   1.981  -0.174
  579    HG2  MET  79           HG3      MET  79  -7.808   0.636   0.967
  580    HG3  MET  79           HG2      MET  79  -7.819   2.168   1.839
  581    HE1  MET  79           HE1      MET  79  -9.665  -0.371  -0.280
  582    HE2  MET  79           HE2      MET  79 -11.288  -0.011   0.326
  583    HE3  MET  79           HE3      MET  79  -9.976  -0.345   1.453
  584    H    LEU  80           H        LEU  80  -7.868   4.561   2.277
  585    HA   LEU  80           HA       LEU  80  -5.056   5.239   3.018
  586    HB2  LEU  80           HB3      LEU  80  -6.739   7.055   3.230
  587    HB3  LEU  80           HB2      LEU  80  -7.674   6.043   4.328
  588    HG   LEU  80           HG       LEU  80  -5.755   5.979   5.897
  589   HD11  LEU  80          HD11      LEU  80  -4.478   7.485   3.650
  590   HD12  LEU  80          HD12      LEU  80  -3.786   6.266   4.717
  591   HD13  LEU  80          HD13      LEU  80  -4.023   7.914   5.299
  592   HD21  LEU  80          HD21      LEU  80  -5.844   8.398   6.545
  593   HD22  LEU  80          HD22      LEU  80  -7.434   7.712   6.216
  594   HD23  LEU  80          HD23      LEU  80  -6.652   8.739   5.014
  595    H    LEU  81           H        LEU  81  -4.275   3.234   3.716
  596    HA   LEU  81           HA       LEU  81  -5.857   1.542   5.516
  597    HB2  LEU  81           HB3      LEU  81  -3.286   1.363   4.075
  598    HB3  LEU  81           HB2      LEU  81  -3.276   0.600   5.664
  599    HG   LEU  81           HG       LEU  81  -5.273  -0.705   5.070
  600   HD11  LEU  81          HD11      LEU  81  -6.565   0.453   3.556
  601   HD12  LEU  81          HD12      LEU  81  -5.687  -0.570   2.419
  602   HD13  LEU  81          HD13      LEU  81  -5.167   1.094   2.693
  603   HD21  LEU  81          HD21      LEU  81  -4.162  -2.267   3.724
  604   HD22  LEU  81          HD22      LEU  81  -2.819  -1.331   4.383
  605   HD23  LEU  81          HD23      LEU  81  -3.392  -1.018   2.744
  606    H    GLY  82           H        GLY  82  -5.911   1.836   7.725
  607    HA2  GLY  82           HA3      GLY  82  -3.993   3.776   8.893
  608    HA3  GLY  82           HA2      GLY  82  -5.493   3.245   9.634
  609    H    ARG  83           H        ARG  83  -2.486   3.202  10.400
  610    HA   ARG  83           HA       ARG  83  -1.783   0.422  10.726
  611    HB2  ARG  83           HB3      ARG  83  -0.133   2.276  10.863
  612    HB3  ARG  83           HB2      ARG  83  -0.908   2.838  12.343
  613    HG2  ARG  83           HG3      ARG  83  -0.235  -0.018  12.414
  614    HG3  ARG  83           HG2      ARG  83   1.176   1.024  12.232
  615    HD2  ARG  83           HD3      ARG  83  -0.962   1.328  14.362
  616    HD3  ARG  83           HD2      ARG  83   0.647   0.650  14.617
  617    HE   ARG  83           HE       ARG  83   0.009   3.472  14.430
  618   HH11  ARG  83          HH22      ARG  83   2.342   1.021  13.767
  619   HH12  ARG  83          HH21      ARG  83   3.692   2.104  13.822
  620   HH21  ARG  83          HH11      ARG  83   1.759   4.902  14.508
  621   HH22  ARG  83          HH12      ARG  83   3.362   4.301  14.241
  622    H    GLN  84           H        GLN  84  -2.965  -0.965  11.985
  623    HA   GLN  84           HA       GLN  84  -4.445   0.140  14.315
  624    HB2  GLN  84           HB3      GLN  84  -5.945  -1.038  12.963
  625    HB3  GLN  84           HB2      GLN  84  -4.741  -2.239  12.514
  626    HG2  GLN  84           HG3      GLN  84  -6.559  -2.999  14.131
  627    HG3  GLN  84           HG2      GLN  84  -4.900  -3.337  14.615
  628   HE21  GLN  84          HE22      GLN  84  -6.741  -0.246  14.784
  629   HE22  GLN  84          HE21      GLN  84  -6.578  -0.063  16.464
  630    H    GLY  85           H        GLY  85  -2.011  -2.218  13.339
  631    HA2  GLY  85           HA3      GLY  85  -1.191  -2.463  16.181
  632    HA3  GLY  85           HA2      GLY  85  -1.539  -3.951  15.299
  633    H    GLU  86           H        GLU  86   0.709  -1.377  15.757
  634    HA   GLU  86           HA       GLU  86   2.584  -0.853  14.180
  635    HB2  GLU  86           HB3      GLU  86   2.991  -1.588  16.633
  636    HB3  GLU  86           HB2      GLU  86   3.548  -3.103  15.925
  637    HG2  GLU  86           HG3      GLU  86   5.166  -1.855  14.532
  638    HG3  GLU  86           HG2      GLU  86   4.620  -0.344  15.261
  639    H    GLY  87           H        GLY  87   2.122  -1.649  12.050
  640    HA2  GLY  87           HA3      GLY  87   3.316  -2.917  10.318
  641    HA3  GLY  87           HA2      GLY  87   3.452  -4.257  11.450
  642    H    ASP  88           H        ASP  88   0.555  -3.658  12.263
  643    HA   ASP  88           HA       ASP  88  -0.700  -5.135   9.982
  644    HB2  ASP  88           HB3      ASP  88  -0.895  -5.368  12.906
  645    HB3  ASP  88           HB2      ASP  88  -2.465  -5.309  12.103
  646    H    TYR  89           H        TYR  89  -1.674  -3.639   8.699
  647    HA   TYR  89           HA       TYR  89  -3.116  -1.370   9.988
  648    HB2  TYR  89           HB3      TYR  89  -2.478  -1.740   7.051
  649    HB3  TYR  89           HB2      TYR  89  -3.085  -0.292   7.815
  650    HD1  TYR  89           HD1      TYR  89  -0.155  -2.668   8.155
  651    HD2  TYR  89           HD2      TYR  89  -1.563   1.400   8.302
  652    HE1  TYR  89           HE1      TYR  89   2.149  -1.878   8.565
  653    HE2  TYR  89           HE2      TYR  89   0.753   2.176   8.705
  654    HH   TYR  89           HH       TYR  89   3.153   0.334   9.760
  655    H    ARG  90           H        ARG  90  -5.308  -1.084   9.580
  656    HA   ARG  90           HA       ARG  90  -6.666  -3.165   7.936
  657    HB2  ARG  90           HB3      ARG  90  -7.639  -2.268  10.665
  658    HB3  ARG  90           HB2      ARG  90  -8.318  -3.552   9.665
  659    HG2  ARG  90           HG3      ARG  90  -6.290  -4.884   9.919
  660    HG3  ARG  90           HG2      ARG  90  -5.508  -3.585  10.802
  661    HD2  ARG  90           HD3      ARG  90  -6.245  -4.758  12.617
  662    HD3  ARG  90           HD2      ARG  90  -7.741  -3.878  12.310
  663    HE   ARG  90           HE       ARG  90  -7.958  -6.149  10.728
  664   HH11  ARG  90          HH22      ARG  90  -7.321  -5.437  14.040
  665   HH12  ARG  90          HH21      ARG  90  -8.031  -6.903  14.630
  666   HH21  ARG  90          HH11      ARG  90  -8.888  -8.069  11.480
  667   HH22  ARG  90          HH12      ARG  90  -8.918  -8.392  13.181
  668    H    VAL  91           H        VAL  91  -8.693  -2.441   7.064
  669    HA   VAL  91           HA       VAL  91  -9.441   0.387   7.565
  670    HB   VAL  91           HB       VAL  91  -7.785   0.138   5.576
  671   HG11  VAL  91          HG11      VAL  91 -10.269  -0.634   4.066
  672   HG12  VAL  91          HG12      VAL  91  -9.248  -1.888   4.767
  673   HG13  VAL  91          HG13      VAL  91  -8.581  -0.775   3.573
  674   HG21  VAL  91          HG21      VAL  91 -10.491   1.483   5.438
  675   HG22  VAL  91          HG22      VAL  91  -9.267   1.724   4.191
  676   HG23  VAL  91          HG23      VAL  91  -8.937   2.205   5.856
  677    H    GLN  92           H        GLN  92 -11.642   0.795   7.137
  678    HA   GLN  92           HA       GLN  92 -13.333  -1.594   7.025
  679    HB2  GLN  92           HB3      GLN  92 -13.964   1.367   7.199
  680    HB3  GLN  92           HB2      GLN  92 -15.197   0.103   7.195
  681    HG2  GLN  92           HG3      GLN  92 -14.142  -0.915   9.195
  682    HG3  GLN  92           HG2      GLN  92 -12.948   0.384   9.212
  683   HE21  GLN  92          HE22      GLN  92 -16.287  -0.426   9.955
  684   HE22  GLN  92          HE21      GLN  92 -16.692   1.068  10.651
  685    H    LYS  93           H        LYS  93 -13.640  -2.508   5.043
  686    HA   LYS  93           HA       LYS  93 -13.611  -0.840   2.618
  687    HB2  LYS  93           HB3      LYS  93 -12.636  -3.237   2.877
  688    HB3  LYS  93           HB2      LYS  93 -14.308  -3.771   2.700
  689    HG2  LYS  93           HG3      LYS  93 -14.474  -2.544   0.562
  690    HG3  LYS  93           HG2      LYS  93 -12.796  -2.028   0.733
  691    HD2  LYS  93           HD3      LYS  93 -12.289  -3.909  -0.427
  692    HD3  LYS  93           HD2      LYS  93 -12.608  -4.755   1.088
  693    HE2  LYS  93           HE3      LYS  93 -15.062  -4.824   0.363
  694    HE3  LYS  93           HE2      LYS  93 -14.500  -4.319  -1.229
  695    HZ1  LYS  93           HZ1      LYS  93 -12.869  -6.411  -0.345
  696    HZ2  LYS  93           HZ2      LYS  93 -13.945  -6.402  -1.656
  697    HZ3  LYS  93           HZ3      LYS  93 -14.485  -6.888  -0.120
  698    H    GLY  94           H        GLY  94 -15.504   0.406   2.676
  699    HA2  GLY  94           HA3      GLY  94 -17.812   0.860   2.610
  700    HA3  GLY  94           HA2      GLY  94 -17.872  -0.585   1.601
  701    H    ASP  95           H        ASP  95 -18.511  -2.563   2.542
  702    HA   ASP  95           HA       ASP  95 -18.887  -2.875   5.395
  703    HB2  ASP  95           HB3      ASP  95 -21.171  -1.969   3.690
  704    HB3  ASP  95           HB2      ASP  95 -21.498  -3.168   4.942
  705    H    GLY  96           H        GLY  96 -17.572  -4.707   4.382
  706    HA2  GLY  96           HA3      GLY  96 -18.598  -7.170   4.539
  707    HA3  GLY  96           HA2      GLY  96 -19.219  -6.711   2.953
  708    H    GLY  97           H        GLY  97 -16.140  -6.832   4.774
  709    HA2  GLY  97           HA3      GLY  97 -14.594  -8.444   3.287
  710    HA3  GLY  97           HA2      GLY  97 -14.653  -7.035   2.227
  711    H    GLN  98           H        GLN  98 -13.137  -8.452   4.902
  712    HA   GLN  98           HA       GLN  98 -12.052  -5.911   5.932
  713    HB2  GLN  98           HB3      GLN  98 -12.699  -8.055   7.300
  714    HB3  GLN  98           HB2      GLN  98 -11.116  -8.635   6.784
  715    HG2  GLN  98           HG3      GLN  98 -10.052  -6.634   7.730
  716    HG3  GLN  98           HG2      GLN  98 -11.631  -6.021   8.227
  717   HE21  GLN  98          HE22      GLN  98  -9.265  -8.625   8.838
  718   HE22  GLN  98          HE21      GLN  98  -9.884  -9.053  10.360
  719    H    LEU  99           H        LEU  99  -9.729  -5.574   6.052
  720    HA   LEU  99           HA       LEU  99  -8.130  -7.088   4.040
  721    HB2  LEU  99           HB3      LEU  99  -7.946  -4.094   4.325
  722    HB3  LEU  99           HB2      LEU  99  -7.316  -5.094   3.028
  723    HG   LEU  99           HG       LEU  99 -10.274  -4.757   3.599
  724   HD11  LEU  99          HD11      LEU  99 -10.069  -2.701   2.708
  725   HD12  LEU  99          HD12      LEU  99  -9.647  -3.494   1.190
  726   HD13  LEU  99          HD13      LEU  99  -8.376  -2.980   2.300
  727   HD21  LEU  99          HD21      LEU  99 -10.492  -6.409   2.084
  728   HD22  LEU  99          HD22      LEU  99  -8.744  -6.484   1.870
  729   HD23  LEU  99          HD23      LEU  99  -9.703  -5.378   0.891
  730    H    VAL 100           H        VAL 100  -5.976  -7.351   4.675
  731    HA   VAL 100           HA       VAL 100  -5.062  -5.892   7.105
  732    HB   VAL 100           HB       VAL 100  -5.015  -8.906   6.781
  733   HG11  VAL 100          HG11      VAL 100  -3.040  -8.410   7.942
  734   HG12  VAL 100          HG12      VAL 100  -4.201  -8.628   9.253
  735   HG13  VAL 100          HG13      VAL 100  -3.747  -7.003   8.738
  736   HG21  VAL 100          HG21      VAL 100  -6.369  -8.664   8.978
  737   HG22  VAL 100          HG22      VAL 100  -7.201  -8.313   7.464
  738   HG23  VAL 100          HG23      VAL 100  -6.620  -6.992   8.478
  739    H    LEU 101           H        LEU 101  -3.253  -4.879   6.302
  740    HA   LEU 101           HA       LEU 101  -1.522  -6.261   4.326
  741    HB2  LEU 101           HB3      LEU 101  -2.149  -3.792   4.208
  742    HB3  LEU 101           HB2      LEU 101  -1.170  -3.566   5.640
  743    HG   LEU 101           HG       LEU 101   0.354  -5.046   3.710
  744   HD11  LEU 101          HD11      LEU 101  -0.724  -2.371   2.764
  745   HD12  LEU 101          HD12      LEU 101  -1.187  -3.931   2.085
  746   HD13  LEU 101          HD13      LEU 101   0.476  -3.360   1.935
  747   HD21  LEU 101          HD21      LEU 101   1.942  -3.261   4.088
  748   HD22  LEU 101          HD22      LEU 101   1.144  -3.584   5.628
  749   HD23  LEU 101          HD23      LEU 101   0.670  -2.185   4.664
  750    H    ARG 102           H        ARG 102   0.055  -7.670   5.208
  751    HA   ARG 102           HA       ARG 102   1.435  -6.727   7.684
  752    HB2  ARG 102           HB3      ARG 102  -0.266  -8.631   8.028
  753    HB3  ARG 102           HB2      ARG 102   0.853  -9.630   7.099
  754    HG2  ARG 102           HG3      ARG 102   2.672  -8.885   8.722
  755    HG3  ARG 102           HG2      ARG 102   1.380  -8.214   9.720
  756    HD2  ARG 102           HD3      ARG 102   1.850 -10.442  10.530
  757    HD3  ARG 102           HD2      ARG 102   0.293 -10.490   9.705
  758    HE   ARG 102           HE       ARG 102   1.265 -11.890   8.067
  759   HH11  ARG 102          HH22      ARG 102   3.629 -10.297  10.005
  760   HH12  ARG 102          HH21      ARG 102   4.960 -11.193   9.355
  761   HH21  ARG 102          HH11      ARG 102   2.990 -13.069   7.205
  762   HH22  ARG 102          HH12      ARG 102   4.599 -12.763   7.769
  763    H    ARG 103           H        ARG 103   3.597  -6.737   7.503
  764    HA   ARG 103           HA       ARG 103   5.007  -7.021   5.139
  765    HB2  ARG 103           HB3      ARG 103   6.832  -7.914   7.034
  766    HB3  ARG 103           HB2      ARG 103   6.535  -6.231   6.603
  767    HG2  ARG 103           HG3      ARG 103   4.956  -5.964   8.390
  768    HG3  ARG 103           HG2      ARG 103   4.926  -7.699   8.705
  769    HD2  ARG 103           HD3      ARG 103   7.490  -6.128   8.911
  770    HD3  ARG 103           HD2      ARG 103   6.369  -6.223  10.268
  771    HE   ARG 103           HE       ARG 103   6.734  -8.869   9.492
  772   HH11  ARG 103          HH22      ARG 103   8.722  -6.200  10.399
  773   HH12  ARG 103          HH21      ARG 103   9.961  -7.190  11.094
  774   HH21  ARG 103          HH11      ARG 103   8.342 -10.176  10.395
  775   HH22  ARG 103          HH12      ARG 103   9.746  -9.439  11.094
  776    H    ALA 104           H        ALA 104   5.806  -8.714   3.947
  777    HA   ALA 104           HA       ALA 104   4.786 -11.357   4.362
  778    HB1  ALA 104           HB1      ALA 104   7.270 -11.160   2.786
  779    HB2  ALA 104           HB2      ALA 104   6.002 -10.047   2.274
  780    HB3  ALA 104           HB3      ALA 104   5.688 -11.782   2.317
  781    H    THR 105           H        THR 105   5.675 -13.121   5.390
  782    HA   THR 105           HA       THR 105   8.420 -12.844   6.540
  783    HB   THR 105           HB       THR 105   6.065 -14.005   8.051
  784    HG1  THR 105           HG1      THR 105   7.268 -11.441   8.208
  785   HG21  THR 105          HG21      THR 105   8.831 -14.212   8.407
  786   HG22  THR 105          HG22      THR 105   7.591 -14.572   9.609
  787   HG23  THR 105          HG23      THR 105   8.330 -12.972   9.558
  788    HA   PRO 106           HA       PRO 106   7.771 -16.748   4.013
  789    HB2  PRO 106           HB2      PRO 106  10.712 -16.283   3.815
  790    HB3  PRO 106           HB3      PRO 106   9.552 -16.736   2.551
  791    HG2  PRO 106           HG3      PRO 106  10.537 -14.263   2.731
  792    HG3  PRO 106           HG2      PRO 106   8.875 -14.577   2.205
  793    HD2  PRO 106           HD3      PRO 106   9.850 -13.485   4.803
  794    HD3  PRO 106           HD2      PRO 106   8.315 -13.190   3.958
  Start of MODEL    4
    1    H1   SER   1           H        SER   1  20.370  10.840  -6.537
    2    H2   SER   1           H2       SER   1  19.345  12.195  -6.550
    3    H3   SER   1           1HT      SER   1  20.571  12.043  -7.715
    4    HA   SER   1           HA       SER   1  21.438  11.991  -4.941
    5    HB2  SER   1           HB3      SER   1  23.032  11.879  -6.806
    6    HB3  SER   1           HB2      SER   1  22.389  13.380  -7.466
    7    HG   SER   1           HG       SER   1  23.526  14.449  -6.061
    8    H    SER   2           H        SER   2  21.775  14.917  -6.722
    9    HA   SER   2           HA       SER   2  21.129  17.104  -6.141
   10    HB2  SER   2           HB3      SER   2  19.045  16.108  -7.218
   11    HB3  SER   2           HB2      SER   2  18.446  15.811  -5.588
   12    HG   SER   2           HG       SER   2  19.322  18.335  -6.551
   13    H    LEU   3           H        LEU   3  18.728  17.317  -4.162
   14    HA   LEU   3           HA       LEU   3  20.440  17.448  -1.766
   15    HB2  LEU   3           HB3      LEU   3  17.545  18.239  -2.213
   16    HB3  LEU   3           HB2      LEU   3  18.456  18.535  -0.732
   17    HG   LEU   3           HG       LEU   3  19.949  19.455  -3.036
   18   HD11  LEU   3          HD11      LEU   3  17.141  20.539  -2.659
   19   HD12  LEU   3          HD12      LEU   3  17.796  19.782  -4.112
   20   HD13  LEU   3          HD13      LEU   3  18.400  21.354  -3.588
   21   HD21  LEU   3          HD21      LEU   3  18.690  20.973  -0.729
   22   HD22  LEU   3          HD22      LEU   3  20.056  21.496  -1.715
   23   HD23  LEU   3          HD23      LEU   3  20.229  20.116  -0.630
   24    H    ILE   4           H        ILE   4  20.014  16.270   0.158
   25    HA   ILE   4           HA       ILE   4  18.849  13.636  -0.265
   26    HB   ILE   4           HB       ILE   4  19.672  14.849   2.383
   27   HG12  ILE   4          HG13      ILE   4  21.802  13.329   1.448
   28   HG13  ILE   4          HG12      ILE   4  21.278  14.214   0.015
   29   HG21  ILE   4          HG21      ILE   4  20.083  12.004   1.535
   30   HG22  ILE   4          HG22      ILE   4  18.461  12.521   1.998
   31   HG23  ILE   4          HG23      ILE   4  19.792  12.660   3.146
   32   HD11  ILE   4          HD11      ILE   4  22.868  15.624   1.119
   33   HD12  ILE   4          HD12      ILE   4  22.116  15.352   2.691
   34   HD13  ILE   4          HD13      ILE   4  21.282  16.310   1.467
   35    H    LEU   5           H        LEU   5  16.813  12.960   0.302
   36    HA   LEU   5           HA       LEU   5  15.212  14.314   2.308
   37    HB2  LEU   5           HB3      LEU   5  15.092  15.286  -0.404
   38    HB3  LEU   5           HB2      LEU   5  13.546  14.556   0.025
   39    HG   LEU   5           HG       LEU   5  14.995  16.584   1.750
   40   HD11  LEU   5          HD11      LEU   5  13.411  18.225   0.921
   41   HD12  LEU   5          HD12      LEU   5  12.585  17.002  -0.043
   42   HD13  LEU   5          HD13      LEU   5  14.224  17.498  -0.464
   43   HD21  LEU   5          HD21      LEU   5  12.900  14.770   2.284
   44   HD22  LEU   5          HD22      LEU   5  12.128  16.345   2.088
   45   HD23  LEU   5          HD23      LEU   5  13.405  16.132   3.284
   46    H    LEU   6           H        LEU   6  16.105  11.628   0.832
   47    HA   LEU   6           HA       LEU   6  13.437  10.358   0.616
   48    HB2  LEU   6           HB3      LEU   6  16.178   9.742  -0.304
   49    HB3  LEU   6           HB2      LEU   6  15.257   8.340   0.234
   50    HG   LEU   6           HG       LEU   6  14.990   8.861  -2.216
   51   HD11  LEU   6          HD11      LEU   6  12.993   8.241  -0.276
   52   HD12  LEU   6          HD12      LEU   6  13.023   7.800  -1.983
   53   HD13  LEU   6          HD13      LEU   6  12.257   9.305  -1.474
   54   HD21  LEU   6          HD21      LEU   6  14.226  10.883  -2.957
   55   HD22  LEU   6          HD22      LEU   6  14.853  11.459  -1.413
   56   HD23  LEU   6          HD23      LEU   6  13.137  11.089  -1.586
   57    H    SER   7           H        SER   7  12.918  10.514   2.906
   58    HA   SER   7           HA       SER   7  14.606   8.875   4.730
   59    HB2  SER   7           HB3      SER   7  12.357   9.959   6.087
   60    HB3  SER   7           HB2      SER   7  14.043  10.452   6.228
   61    HG   SER   7           HG       SER   7  12.209  11.337   4.243
   62    H    ALA   8           H        ALA   8  12.494   8.028   2.560
   63    HA   ALA   8           HA       ALA   8  10.616   6.520   4.283
   64    HB1  ALA   8           HB1      ALA   8   9.242   6.711   2.513
   65    HB2  ALA   8           HB2      ALA   8  10.393   5.840   1.500
   66    HB3  ALA   8           HB3      ALA   8  10.506   7.594   1.654
   67    H    SER   9           H        SER   9  13.644   5.989   3.899
   68    HA   SER   9           HA       SER   9  13.810   3.438   2.538
   69    HB2  SER   9           HB3      SER   9  16.057   3.409   3.215
   70    HB3  SER   9           HB2      SER   9  15.707   5.134   3.140
   71    HG   SER   9           HG       SER   9  15.214   4.975   5.418
   72    H    ASP  10           H        ASP  10  12.317   4.297   5.390
   73    HA   ASP  10           HA       ASP  10  12.965   1.773   6.805
   74    HB2  ASP  10           HB3      ASP  10  11.197   4.111   7.588
   75    HB3  ASP  10           HB2      ASP  10  11.555   2.724   8.615
   76    H    LEU  11           H        LEU  11  10.361   3.310   5.006
   77    HA   LEU  11           HA       LEU  11   8.401   1.258   5.718
   78    HB2  LEU  11           HB3      LEU  11   8.415   3.474   3.653
   79    HB3  LEU  11           HB2      LEU  11   7.059   2.368   3.874
   80    HG   LEU  11           HG       LEU  11   8.120   3.674   6.328
   81   HD11  LEU  11          HD11      LEU  11   6.714   5.130   4.088
   82   HD12  LEU  11          HD12      LEU  11   8.137   5.632   5.001
   83   HD13  LEU  11          HD13      LEU  11   6.547   5.649   5.766
   84   HD21  LEU  11          HD21      LEU  11   5.259   3.473   5.407
   85   HD22  LEU  11          HD22      LEU  11   5.897   3.444   7.052
   86   HD23  LEU  11          HD23      LEU  11   6.099   2.042   6.001
   87    H    ALA  12           H        ALA  12  10.673   1.866   3.109
   88    HA   ALA  12           HA       ALA  12   9.770   0.171   1.090
   89    HB1  ALA  12           HB1      ALA  12  12.625   0.417   2.092
   90    HB2  ALA  12           HB2      ALA  12  11.854   1.483   0.918
   91    HB3  ALA  12           HB3      ALA  12  12.146  -0.209   0.515
   92    H    GLY  13           H        GLY  13  10.241  -2.103   0.617
   93    HA2  GLY  13           HA3      GLY  13  11.406  -4.117   1.901
   94    HA3  GLY  13           HA2      GLY  13  10.160  -3.753   3.088
   95    H    GLN  14           H        GLN  14   9.310  -5.914   2.696
   96    HA   GLN  14           HA       GLN  14   7.730  -6.097   0.161
   97    HB2  GLN  14           HB3      GLN  14   8.577  -8.472   1.824
   98    HB3  GLN  14           HB2      GLN  14   8.041  -8.444   0.143
   99    HG2  GLN  14           HG3      GLN  14  10.175  -6.853  -0.114
  100    HG3  GLN  14           HG2      GLN  14  10.712  -7.769   1.293
  101   HE21  GLN  14          HE22      GLN  14  10.627  -7.832  -2.093
  102   HE22  GLN  14          HE21      GLN  14  10.910  -9.490  -2.319
  103    H    TRP  15           H        TRP  15   5.550  -6.786   0.442
  104    HA   TRP  15           HA       TRP  15   4.620  -7.248   3.218
  105    HB2  TRP  15           HB3      TRP  15   3.513  -5.075   1.417
  106    HB3  TRP  15           HB2      TRP  15   2.816  -5.566   2.952
  107    HD1  TRP  15           HD1      TRP  15   6.199  -4.164   1.614
  108    HE1  TRP  15           HE1      TRP  15   7.206  -2.681   3.460
  109    HE3  TRP  15           HE3      TRP  15   2.731  -4.852   5.309
  110    HZ2  TRP  15           HZ2      TRP  15   6.628  -1.882   6.143
  111    HZ3  TRP  15           HZ3      TRP  15   2.986  -3.712   7.496
  112    HH2  TRP  15           HH2      TRP  15   4.928  -2.228   7.916
  113    H    THR  16           H        THR  16   2.143  -7.717   3.103
  114    HA   THR  16           HA       THR  16   1.411  -9.030   0.523
  115    HB   THR  16           HB       THR  16   0.573 -10.992   1.998
  116    HG1  THR  16           HG1      THR  16   1.515  -9.470   3.851
  117   HG21  THR  16          HG21      THR  16   2.316 -11.430   0.456
  118   HG22  THR  16          HG22      THR  16   2.951 -11.976   2.008
  119   HG23  THR  16          HG23      THR  16   3.462 -10.424   1.343
  120    H    LEU  17           H        LEU  17  -0.917  -9.541   0.443
  121    HA   LEU  17           HA       LEU  17  -2.521  -7.757   2.247
  122    HB2  LEU  17           HB3      LEU  17  -2.348  -7.773  -0.553
  123    HB3  LEU  17           HB2      LEU  17  -3.866  -8.594  -0.193
  124    HG   LEU  17           HG       LEU  17  -4.441  -6.685   1.352
  125   HD11  LEU  17          HD11      LEU  17  -1.739  -6.027   0.876
  126   HD12  LEU  17          HD12      LEU  17  -2.915  -5.090   1.797
  127   HD13  LEU  17          HD13      LEU  17  -2.688  -4.774   0.076
  128   HD21  LEU  17          HD21      LEU  17  -4.139  -6.504  -1.607
  129   HD22  LEU  17          HD22      LEU  17  -4.554  -5.017  -0.756
  130   HD23  LEU  17          HD23      LEU  17  -5.600  -6.432  -0.622
  131    H    GLN  18           H        GLN  18  -4.605  -8.603   2.924
  132    HA   GLN  18           HA       GLN  18  -5.136 -11.457   2.353
  133    HB2  GLN  18           HB3      GLN  18  -3.663 -10.940   4.551
  134    HB3  GLN  18           HB2      GLN  18  -5.273 -10.689   5.226
  135    HG2  GLN  18           HG3      GLN  18  -5.896 -12.934   4.138
  136    HG3  GLN  18           HG2      GLN  18  -4.162 -13.181   3.936
  137   HE21  GLN  18          HE22      GLN  18  -3.229 -11.995   6.363
  138   HE22  GLN  18          HE21      GLN  18  -3.787 -12.927   7.669
  139    H    GLN  19           H        GLN  19  -7.250 -11.486   1.807
  140    HA   GLN  19           HA       GLN  19  -9.054  -9.381   2.876
  141    HB2  GLN  19           HB3      GLN  19  -9.076  -9.871   0.431
  142    HB3  GLN  19           HB2      GLN  19  -9.560 -11.530   0.784
  143    HG2  GLN  19           HG3      GLN  19 -11.711 -10.877   0.867
  144    HG3  GLN  19           HG2      GLN  19 -11.325  -9.798   2.208
  145   HE21  GLN  19          HE22      GLN  19 -13.039  -9.493  -0.399
  146   HE22  GLN  19          HE21      GLN  19 -12.513  -8.006  -1.027
  147    H    ASP  20           H        ASP  20 -10.428  -9.866   4.551
  148    HA   ASP  20           HA       ASP  20 -11.256 -11.128   6.345
  149    HB2  ASP  20           HB3      ASP  20 -12.978 -11.301   4.551
  150    HB3  ASP  20           HB2      ASP  20 -12.212 -12.788   4.001
  151    H    GLU  21           H        GLU  21 -11.633 -14.159   5.226
  152    HA   GLU  21           HA       GLU  21  -8.890 -15.083   5.900
  153    HB2  GLU  21           HB3      GLU  21 -10.787 -15.088   7.843
  154    HB3  GLU  21           HB2      GLU  21 -11.121 -16.646   7.085
  155    HG2  GLU  21           HG3      GLU  21  -8.644 -17.152   7.265
  156    HG3  GLU  21           HG2      GLU  21  -8.494 -15.700   8.254
  157    H    ALA  22           H        ALA  22 -10.274 -14.915   3.389
  158    HA   ALA  22           HA       ALA  22 -10.761 -17.812   2.811
  159    HB1  ALA  22           HB1      ALA  22 -12.301 -15.483   2.187
  160    HB2  ALA  22           HB2      ALA  22 -12.655 -17.164   1.788
  161    HB3  ALA  22           HB3      ALA  22 -11.705 -16.175   0.679
  162    HA   PRO  23           HA       PRO  23  -7.167 -18.097   0.205
  163    HB2  PRO  23           HB2      PRO  23  -9.038 -18.752  -2.030
  164    HB3  PRO  23           HB3      PRO  23  -7.585 -19.612  -1.487
  165    HG2  PRO  23           HG3      PRO  23 -10.094 -20.436  -0.928
  166    HG3  PRO  23           HG2      PRO  23  -8.702 -20.762   0.114
  167    HD2  PRO  23           HD3      PRO  23 -10.992 -18.988   0.603
  168    HD3  PRO  23           HD2      PRO  23  -9.776 -19.605   1.743
  169    H    ALA  24           H        ALA  24  -6.420 -15.990  -0.151
  170    HA   ALA  24           HA       ALA  24  -6.684 -14.784  -2.681
  171    HB1  ALA  24           HB1      ALA  24  -8.870 -14.092  -2.484
  172    HB2  ALA  24           HB2      ALA  24  -8.088 -12.725  -1.692
  173    HB3  ALA  24           HB3      ALA  24  -8.798 -14.017  -0.724
  174    H    ILE  25           H        ILE  25  -4.395 -14.733  -1.894
  175    HA   ILE  25           HA       ILE  25  -3.866 -12.316  -0.199
  176    HB   ILE  25           HB       ILE  25  -2.298 -14.895  -0.485
  177   HG12  ILE  25          HG13      ILE  25  -2.813 -14.019   2.207
  178   HG13  ILE  25          HG12      ILE  25  -4.330 -14.040   1.310
  179   HG21  ILE  25          HG21      ILE  25  -1.054 -13.452   1.480
  180   HG22  ILE  25          HG22      ILE  25  -1.489 -12.179   0.340
  181   HG23  ILE  25          HG23      ILE  25  -0.498 -13.536  -0.191
  182   HD11  ILE  25          HD11      ILE  25  -3.877 -16.351   0.580
  183   HD12  ILE  25          HD12      ILE  25  -3.884 -16.239   2.340
  184   HD13  ILE  25          HD13      ILE  25  -2.355 -16.335   1.469
  185    H    CYS  26           H        CYS  26  -3.182 -10.696  -1.523
  186    HA   CYS  26           HA       CYS  26  -1.752 -11.390  -4.034
  187    HB2  CYS  26           HB3      CYS  26  -3.301  -9.047  -3.058
  188    HB3  CYS  26           HB2      CYS  26  -1.945  -8.700  -4.122
  189    H    HIS  27           H        HIS  27   0.436 -11.555  -3.790
  190    HA   HIS  27           HA       HIS  27   1.935 -10.434  -1.636
  191    HB2  HIS  27           HB3      HIS  27   3.683 -10.592  -3.843
  192    HB3  HIS  27           HB2      HIS  27   3.445 -11.819  -2.597
  193    HD1  HIS  27           HD1      HIS  27   1.570 -13.662  -3.108
  194    HD2  HIS  27           HD2      HIS  27   2.654 -11.279  -6.355
  195    HE1  HIS  27           HE1      HIS  27   0.706 -14.837  -5.181
  196    HE2  HIS  27           HE2      HIS  27   1.361 -13.394  -7.162
  197    H    LEU  28           H        LEU  28   2.783  -8.372  -1.371
  198    HA   LEU  28           HA       LEU  28   2.464  -6.465  -3.663
  199    HB2  LEU  28           HB3      LEU  28   1.349  -6.401  -0.978
  200    HB3  LEU  28           HB2      LEU  28   2.361  -4.995  -1.272
  201    HG   LEU  28           HG       LEU  28  -0.033  -4.641  -1.914
  202   HD11  LEU  28          HD11      LEU  28   0.952  -4.359  -4.553
  203   HD12  LEU  28          HD12      LEU  28   2.331  -4.138  -3.476
  204   HD13  LEU  28          HD13      LEU  28   0.898  -3.132  -3.287
  205   HD21  LEU  28          HD21      LEU  28   0.112  -7.183  -2.925
  206   HD22  LEU  28          HD22      LEU  28   0.254  -6.215  -4.389
  207   HD23  LEU  28          HD23      LEU  28  -1.144  -6.019  -3.333
  208    H    GLU  29           H        GLU  29   4.025  -4.709  -3.672
  209    HA   GLU  29           HA       GLU  29   6.408  -5.102  -1.936
  210    HB2  GLU  29           HB3      GLU  29   6.279  -5.904  -4.659
  211    HB3  GLU  29           HB2      GLU  29   7.252  -4.433  -4.613
  212    HG2  GLU  29           HG3      GLU  29   8.569  -5.480  -2.721
  213    HG3  GLU  29           HG2      GLU  29   7.695  -6.979  -3.041
  214    H    LEU  30           H        LEU  30   6.798  -3.177  -1.028
  215    HA   LEU  30           HA       LEU  30   5.740  -0.721  -2.253
  216    HB2  LEU  30           HB3      LEU  30   6.846  -1.533   0.386
  217    HB3  LEU  30           HB2      LEU  30   7.075   0.151  -0.080
  218    HG   LEU  30           HG       LEU  30   4.683   0.432  -0.429
  219   HD11  LEU  30          HD11      LEU  30   4.731  -2.538  -0.156
  220   HD12  LEU  30          HD12      LEU  30   3.781  -1.526  -1.243
  221   HD13  LEU  30          HD13      LEU  30   3.311  -1.686   0.449
  222   HD21  LEU  30          HD21      LEU  30   4.079   0.503   1.811
  223   HD22  LEU  30          HD22      LEU  30   5.826   0.314   1.970
  224   HD23  LEU  30          HD23      LEU  30   4.767  -1.085   2.152
  225    H    ARG  31           H        ARG  31   6.976   0.024  -3.932
  226    HA   ARG  31           HA       ARG  31   9.832  -0.390  -4.092
  227    HB2  ARG  31           HB3      ARG  31   7.736   0.906  -5.695
  228    HB3  ARG  31           HB2      ARG  31   9.307   1.701  -5.807
  229    HG2  ARG  31           HG3      ARG  31  10.373  -0.394  -6.443
  230    HG3  ARG  31           HG2      ARG  31   8.865  -1.274  -6.194
  231    HD2  ARG  31           HD3      ARG  31   9.123  -0.858  -8.571
  232    HD3  ARG  31           HD2      ARG  31   7.808   0.150  -7.967
  233    HE   ARG  31           HE       ARG  31  10.122   1.727  -7.784
  234   HH11  ARG  31          HH22      ARG  31   8.316   0.028 -10.179
  235   HH12  ARG  31          HH21      ARG  31   8.724   1.124 -11.456
  236   HH21  ARG  31          HH11      ARG  31  10.667   3.168  -9.437
  237   HH22  ARG  31          HH12      ARG  31  10.055   2.902 -11.037
  238    H    ASP  32           H        ASP  32  11.377   1.517  -4.287
  239    HA   ASP  32           HA       ASP  32  10.802   3.485  -2.109
  240    HB2  ASP  32           HB3      ASP  32  13.518   3.604  -2.614
  241    HB3  ASP  32           HB2      ASP  32  12.767   2.670  -1.321
  242    H    SER  33           H        SER  33  10.610   3.329  -5.336
  243    HA   SER  33           HA       SER  33  12.150   5.685  -6.100
  244    HB2  SER  33           HB3      SER  33  10.059   5.208  -7.966
  245    HB3  SER  33           HB2      SER  33  11.765   4.804  -8.132
  246    HG   SER  33           HG       SER  33  10.070   3.186  -6.576
  247    H    GLU  34           H        GLU  34  11.504   7.772  -5.824
  248    HA   GLU  34           HA       GLU  34   8.958   8.370  -4.570
  249    HB2  GLU  34           HB3      GLU  34   9.674  10.718  -4.761
  250    HB3  GLU  34           HB2      GLU  34  10.999   9.720  -4.157
  251    HG2  GLU  34           HG3      GLU  34  11.594   9.496  -6.719
  252    HG3  GLU  34           HG2      GLU  34  10.659  10.986  -6.856
  253    H    VAL  35           H        VAL  35   7.286   9.751  -5.525
  254    HA   VAL  35           HA       VAL  35   7.278   9.863  -8.502
  255    HB   VAL  35           HB       VAL  35   5.067   8.663  -6.805
  256   HG11  VAL  35          HG11      VAL  35   4.482   8.177  -9.453
  257   HG12  VAL  35          HG12      VAL  35   5.142   9.810  -9.514
  258   HG13  VAL  35          HG13      VAL  35   3.757   9.458  -8.481
  259   HG21  VAL  35          HG21      VAL  35   7.012   7.505  -8.822
  260   HG22  VAL  35          HG22      VAL  35   5.568   6.653  -8.271
  261   HG23  VAL  35          HG23      VAL  35   6.842   7.063  -7.123
  262    H    ALA  36           H        ALA  36   6.969  11.998  -8.912
  263    HA   ALA  36           HA       ALA  36   5.573  13.710  -6.986
  264    HB1  ALA  36           HB1      ALA  36   5.949  15.350  -9.070
  265    HB2  ALA  36           HB2      ALA  36   7.119  14.105  -9.508
  266    HB3  ALA  36           HB3      ALA  36   7.259  14.943  -7.963
  267    H    GLU  37           H        GLU  37   4.883  12.202 -10.105
  268    HA   GLU  37           HA       GLU  37   2.601  13.680 -10.864
  269    HB2  GLU  37           HB3      GLU  37   3.700  11.830 -12.194
  270    HB3  GLU  37           HB2      GLU  37   2.900  10.674 -11.129
  271    HG2  GLU  37           HG3      GLU  37   1.509  10.936 -13.082
  272    HG3  GLU  37           HG2      GLU  37   0.701  11.759 -11.748
  273    H    ALA  38           H        ALA  38   3.013  11.218  -8.402
  274    HA   ALA  38           HA       ALA  38   0.140  11.555  -7.625
  275    HB1  ALA  38           HB1      ALA  38   1.558   9.250  -6.489
  276    HB2  ALA  38           HB2      ALA  38   1.438   9.196  -8.247
  277    HB3  ALA  38           HB3      ALA  38  -0.024   9.319  -7.268
  278    H    SER  39           H        SER  39   3.276  12.322  -6.814
  279    HA   SER  39           HA       SER  39   4.190  13.280  -4.892
  280    HB2  SER  39           HB3      SER  39   1.706  14.264  -4.961
  281    HB3  SER  39           HB2      SER  39   1.550  13.291  -3.502
  282    HG   SER  39           HG       SER  39   3.418  14.372  -2.708
  283    H    GLY  40           H        GLY  40   4.255  10.477  -5.099
  284    HA2  GLY  40           HA3      GLY  40   4.469   9.772  -2.257
  285    HA3  GLY  40           HA2      GLY  40   3.290   8.823  -3.160
  286    H    TYR  41           H        TYR  41   4.605   6.918  -2.814
  287    HA   TYR  41           HA       TYR  41   7.148   6.861  -4.381
  288    HB2  TYR  41           HB3      TYR  41   6.183   5.056  -2.146
  289    HB3  TYR  41           HB2      TYR  41   7.724   4.899  -2.992
  290    HD1  TYR  41           HD1      TYR  41   5.679   7.359  -1.037
  291    HD2  TYR  41           HD2      TYR  41   9.598   6.092  -2.248
  292    HE1  TYR  41           HE1      TYR  41   6.688   9.054   0.461
  293    HE2  TYR  41           HE2      TYR  41  10.612   7.784  -0.741
  294    HH   TYR  41           HH       TYR  41  10.227   9.467   0.651
  295    H    ASP  42           H        ASP  42   7.487   5.061  -5.793
  296    HA   ASP  42           HA       ASP  42   5.174   4.240  -7.250
  297    HB2  ASP  42           HB3      ASP  42   7.823   4.302  -7.796
  298    HB3  ASP  42           HB2      ASP  42   7.613   2.577  -7.500
  299    H    LEU  43           H        LEU  43   4.596   1.981  -7.684
  300    HA   LEU  43           HA       LEU  43   4.789   0.225  -5.260
  301    HB2  LEU  43           HB3      LEU  43   2.507   1.261  -5.447
  302    HB3  LEU  43           HB2      LEU  43   2.351   0.534  -7.041
  303    HG   LEU  43           HG       LEU  43   2.827  -1.729  -5.851
  304   HD11  LEU  43          HD11      LEU  43   1.567  -0.771  -3.412
  305   HD12  LEU  43          HD12      LEU  43   3.159  -0.051  -3.638
  306   HD13  LEU  43          HD13      LEU  43   2.981  -1.806  -3.608
  307   HD21  LEU  43          HD21      LEU  43   0.653  -1.091  -6.776
  308   HD22  LEU  43          HD22      LEU  43   0.279  -0.192  -5.308
  309   HD23  LEU  43          HD23      LEU  43   0.447  -1.947  -5.251
  310    H    GLY  44           H        GLY  44   5.396  -1.825  -5.669
  311    HA2  GLY  44           HA3      GLY  44   5.291  -2.827  -8.484
  312    HA3  GLY  44           HA2      GLY  44   6.740  -3.035  -7.496
  313    H    GLY  45           H        GLY  45   4.896  -5.092  -8.633
  314    HA2  GLY  45           HA3      GLY  45   4.943  -7.202  -7.052
  315    HA3  GLY  45           HA2      GLY  45   3.752  -6.276  -6.150
  316    H    ASP  46           H        ASP  46   1.989  -7.633  -6.527
  317    HA   ASP  46           HA       ASP  46   1.274  -8.266  -9.338
  318    HB2  ASP  46           HB3      ASP  46   1.032  -9.693  -6.966
  319    HB3  ASP  46           HB2      ASP  46  -0.610  -9.128  -7.274
  320    H    THR  47           H        THR  47   1.097  -5.534  -8.118
  321    HA   THR  47           HA       THR  47  -1.330  -4.551  -7.360
  322    HB   THR  47           HB       THR  47  -0.651  -2.518  -8.169
  323    HG1  THR  47           HG1      THR  47   0.327  -3.748 -10.521
  324   HG21  THR  47          HG21      THR  47   1.745  -2.412  -8.371
  325   HG22  THR  47          HG22      THR  47   1.828  -4.090  -8.904
  326   HG23  THR  47          HG23      THR  47   1.372  -3.714  -7.243
  327    H    ALA  48           H        ALA  48  -0.673  -6.061 -10.447
  328    HA   ALA  48           HA       ALA  48  -3.067  -5.146 -11.780
  329    HB1  ALA  48           HB1      ALA  48  -2.388  -6.476 -13.534
  330    HB2  ALA  48           HB2      ALA  48  -1.891  -7.797 -12.476
  331    HB3  ALA  48           HB3      ALA  48  -0.856  -6.381 -12.664
  332    H    CYS  49           H        CYS  49  -3.105  -6.601  -8.997
  333    HA   CYS  49           HA       CYS  49  -5.311  -8.511  -9.688
  334    HB2  CYS  49           HB3      CYS  49  -4.638  -9.933  -7.932
  335    HB3  CYS  49           HB2      CYS  49  -3.101  -9.406  -8.619
  336    H    LEU  50           H        LEU  50  -4.254  -5.805  -7.765
  337    HA   LEU  50           HA       LEU  50  -6.339  -5.833  -5.801
  338    HB2  LEU  50           HB3      LEU  50  -4.878  -3.452  -6.973
  339    HB3  LEU  50           HB2      LEU  50  -5.771  -3.469  -5.457
  340    HG   LEU  50           HG       LEU  50  -3.474  -5.357  -5.999
  341   HD11  LEU  50          HD11      LEU  50  -2.007  -3.824  -4.821
  342   HD12  LEU  50          HD12      LEU  50  -3.339  -2.700  -4.552
  343   HD13  LEU  50          HD13      LEU  50  -2.732  -2.975  -6.185
  344   HD21  LEU  50          HD21      LEU  50  -3.413  -5.206  -3.418
  345   HD22  LEU  50          HD22      LEU  50  -4.730  -6.122  -4.145
  346   HD23  LEU  50          HD23      LEU  50  -5.017  -4.489  -3.548
  347    H    THR  51           H        THR  51  -6.649  -5.593  -9.094
  348    HA   THR  51           HA       THR  51  -8.575  -3.480  -9.365
  349    HB   THR  51           HB       THR  51  -9.280  -5.232 -11.334
  350    HG1  THR  51           HG1      THR  51  -6.679  -5.844 -10.427
  351   HG21  THR  51          HG21      THR  51  -7.538  -4.046 -12.707
  352   HG22  THR  51          HG22      THR  51  -6.907  -3.356 -11.212
  353   HG23  THR  51          HG23      THR  51  -8.544  -2.966 -11.741
  354    H    ARG  52           H        ARG  52  -8.799  -5.993  -7.379
  355    HA   ARG  52           HA       ARG  52 -11.688  -6.547  -7.903
  356    HB2  ARG  52           HB3      ARG  52 -11.436  -8.536  -6.597
  357    HB3  ARG  52           HB2      ARG  52 -10.032  -8.476  -7.663
  358    HG2  ARG  52           HG3      ARG  52  -8.998  -7.113  -5.615
  359    HG3  ARG  52           HG2      ARG  52 -10.192  -8.047  -4.714
  360    HD2  ARG  52           HD3      ARG  52  -8.070  -9.179  -6.559
  361    HD3  ARG  52           HD2      ARG  52  -8.066  -9.268  -4.798
  362    HE   ARG  52           HE       ARG  52 -10.493 -10.400  -5.885
  363   HH11  ARG  52          HH22      ARG  52  -7.124 -10.906  -5.358
  364   HH12  ARG  52          HH21      ARG  52  -7.258 -12.631  -5.292
  365   HH21  ARG  52          HH11      ARG  52 -10.688 -12.649  -5.799
  366   HH22  ARG  52          HH12      ARG  52  -9.275 -13.620  -5.540
  367    H    TRP  53           H        TRP  53  -9.446  -5.022  -5.733
  368    HA   TRP  53           HA       TRP  53 -11.671  -4.489  -3.790
  369    HB2  TRP  53           HB3      TRP  53  -8.670  -4.368  -3.350
  370    HB3  TRP  53           HB2      TRP  53  -9.902  -4.047  -2.131
  371    HD1  TRP  53           HD1      TRP  53 -11.866  -6.336  -2.362
  372    HE1  TRP  53           HE1      TRP  53 -11.186  -8.789  -1.950
  373    HE3  TRP  53           HE3      TRP  53  -6.830  -5.997  -3.122
  374    HZ2  TRP  53           HZ2      TRP  53  -8.817 -10.396  -1.941
  375    HZ3  TRP  53           HZ3      TRP  53  -5.386  -8.000  -2.906
  376    HH2  TRP  53           HH2      TRP  53  -6.371 -10.197  -2.317
  377    H    LEU  54           H        LEU  54  -9.064  -3.126  -5.710
  378    HA   LEU  54           HA       LEU  54  -9.877  -0.372  -4.944
  379    HB2  LEU  54           HB3      LEU  54  -7.525  -1.408  -6.552
  380    HB3  LEU  54           HB2      LEU  54  -7.781   0.279  -6.136
  381    HG   LEU  54           HG       LEU  54  -7.510  -1.962  -4.111
  382   HD11  LEU  54          HD11      LEU  54  -5.277  -1.418  -3.829
  383   HD12  LEU  54          HD12      LEU  54  -5.487   0.213  -4.466
  384   HD13  LEU  54          HD13      LEU  54  -5.450  -1.162  -5.562
  385   HD21  LEU  54          HD21      LEU  54  -6.967   0.359  -2.806
  386   HD22  LEU  54          HD22      LEU  54  -8.560  -0.395  -2.835
  387   HD23  LEU  54          HD23      LEU  54  -8.184   0.917  -3.953
  388    HA   PRO  55           HA       PRO  55 -11.945  -0.006  -8.871
  389    HB2  PRO  55           HB2      PRO  55 -11.898   2.673  -9.319
  390    HB3  PRO  55           HB3      PRO  55 -12.898   1.930  -8.058
  391    HG2  PRO  55           HG3      PRO  55 -10.348   3.410  -7.823
  392    HG3  PRO  55           HG2      PRO  55 -11.725   3.343  -6.714
  393    HD2  PRO  55           HD3      PRO  55  -9.345   1.923  -6.405
  394    HD3  PRO  55           HD2      PRO  55 -10.871   1.552  -5.588
  395    H    SER  56           H        SER  56  -8.654   0.909  -8.575
  396    HA   SER  56           HA       SER  56  -8.246   0.467 -11.455
  397    HB2  SER  56           HB3      SER  56  -8.149   3.128 -10.216
  398    HB3  SER  56           HB2      SER  56  -6.669   2.708 -11.074
  399    HG   SER  56           HG       SER  56  -9.320   2.561 -12.092
  400    H    GLU  57           H        GLU  57  -5.923   0.164 -11.940
  401    HA   GLU  57           HA       GLU  57  -4.583  -1.300  -9.872
  402    HB2  GLU  57           HB3      GLU  57  -4.298  -1.740 -12.305
  403    HB3  GLU  57           HB2      GLU  57  -3.433  -0.210 -12.455
  404    HG2  GLU  57           HG3      GLU  57  -1.699  -0.982 -10.935
  405    HG3  GLU  57           HG2      GLU  57  -2.597  -2.466 -10.610
  406    HA   PRO  58           HA       PRO  58  -2.733   2.457  -8.101
  407    HB2  PRO  58           HB2      PRO  58  -1.374   1.293  -6.048
  408    HB3  PRO  58           HB3      PRO  58  -3.116   1.598  -6.001
  409    HG2  PRO  58           HG3      PRO  58  -1.654  -0.923  -6.483
  410    HG3  PRO  58           HG2      PRO  58  -3.188  -0.643  -5.668
  411    HD2  PRO  58           HD3      PRO  58  -2.936  -1.613  -8.253
  412    HD3  PRO  58           HD2      PRO  58  -4.394  -0.835  -7.605
  413    H    ARG  59           H        ARG  59  -1.097   3.279  -9.278
  414    HA   ARG  59           HA       ARG  59   1.330   1.659  -9.774
  415    HB2  ARG  59           HB3      ARG  59   0.016   3.970 -11.037
  416    HB3  ARG  59           HB2      ARG  59   1.770   4.108 -10.942
  417    HG2  ARG  59           HG3      ARG  59   0.442   1.588 -11.939
  418    HG3  ARG  59           HG2      ARG  59   0.789   2.937 -13.023
  419    HD2  ARG  59           HD3      ARG  59   3.046   2.169 -11.286
  420    HD3  ARG  59           HD2      ARG  59   2.560   0.927 -12.441
  421    HE   ARG  59           HE       ARG  59   2.739   3.468 -13.767
  422   HH11  ARG  59          HH22      ARG  59   4.593   0.942 -12.329
  423   HH12  ARG  59          HH21      ARG  59   5.983   1.214 -13.327
  424   HH21  ARG  59          HH11      ARG  59   4.541   3.838 -15.078
  425   HH22  ARG  59          HH12      ARG  59   5.953   2.854 -14.884
  426    H    ALA  60           H        ALA  60   0.189   3.858  -7.494
  427    HA   ALA  60           HA       ALA  60   2.905   4.197  -6.415
  428    HB1  ALA  60           HB1      ALA  60   2.881   6.593  -6.366
  429    HB2  ALA  60           HB2      ALA  60   1.209   6.651  -6.924
  430    HB3  ALA  60           HB3      ALA  60   2.488   6.129  -8.021
  431    H    TRP  61           H        TRP  61   2.815   5.251  -4.246
  432    HA   TRP  61           HA       TRP  61   0.168   5.223  -2.915
  433    HB2  TRP  61           HB3      TRP  61   1.093   3.770  -1.074
  434    HB3  TRP  61           HB2      TRP  61   0.883   2.924  -2.604
  435    HD1  TRP  61           HD1      TRP  61   3.294   3.125  -4.208
  436    HE1  TRP  61           HE1      TRP  61   5.679   2.581  -3.405
  437    HE3  TRP  61           HE3      TRP  61   2.634   3.500   0.843
  438    HZ2  TRP  61           HZ2      TRP  61   7.118   2.326  -0.950
  439    HZ3  TRP  61           HZ3      TRP  61   4.527   3.086   2.389
  440    HH2  TRP  61           HH2      TRP  61   6.766   2.502   1.500
  441    H    ARG  62           H        ARG  62   0.286   6.367  -0.826
  442    HA   ARG  62           HA       ARG  62   2.821   7.893  -0.405
  443    HB2  ARG  62           HB3      ARG  62   1.216   9.231  -1.756
  444    HB3  ARG  62           HB2      ARG  62   0.058   9.117  -0.430
  445    HG2  ARG  62           HG3      ARG  62   1.667  10.220   1.079
  446    HG3  ARG  62           HG2      ARG  62   2.832  10.329  -0.241
  447    HD2  ARG  62           HD3      ARG  62   1.902  12.365  -0.626
  448    HD3  ARG  62           HD2      ARG  62   0.591  11.452  -1.374
  449    HE   ARG  62           HE       ARG  62  -0.116  11.507   1.295
  450   HH11  ARG  62          HH22      ARG  62   0.842  13.836  -1.061
  451   HH12  ARG  62          HH21      ARG  62  -0.104  15.116  -0.375
  452   HH21  ARG  62          HH11      ARG  62  -1.355  13.164   2.204
  453   HH22  ARG  62          HH12      ARG  62  -1.347  14.734   1.474
  454    HA   PRO  63           HA       PRO  63   1.600   6.286   3.733
  455    HB2  PRO  63           HB2      PRO  63   4.062   7.635   4.616
  456    HB3  PRO  63           HB3      PRO  63   3.599   5.933   4.768
  457    HG2  PRO  63           HG3      PRO  63   5.506   6.861   3.062
  458    HG3  PRO  63           HG2      PRO  63   4.597   5.365   2.831
  459    HD2  PRO  63           HD3      PRO  63   4.361   7.932   1.384
  460    HD3  PRO  63           HD2      PRO  63   3.894   6.295   0.873
  461    H    THR  64           H        THR  64   0.142   7.478   4.940
  462    HA   THR  64           HA       THR  64   0.544  10.427   5.106
  463    HB   THR  64           HB       THR  64  -1.921   9.981   6.184
  464    HG1  THR  64           HG1      THR  64  -1.779   7.756   5.783
  465   HG21  THR  64          HG21      THR  64  -2.806  10.565   3.952
  466   HG22  THR  64          HG22      THR  64  -1.244  10.169   3.234
  467   HG23  THR  64          HG23      THR  64  -1.384  11.531   4.346
  468    HA   PRO  65           HA       PRO  65   1.625  10.184   9.383
  469    HB2  PRO  65           HB2      PRO  65   0.226  12.313  10.452
  470    HB3  PRO  65           HB3      PRO  65   1.738  12.466   9.540
  471    HG2  PRO  65           HG3      PRO  65  -1.062  12.903   8.651
  472    HG3  PRO  65           HG2      PRO  65   0.413  13.782   8.220
  473    HD2  PRO  65           HD3      PRO  65  -0.743  11.956   6.559
  474    HD3  PRO  65           HD2      PRO  65   1.007  12.257   6.581
  475    H    ALA  66           H        ALA  66  -0.925   8.749   8.472
  476    HA   ALA  66           HA       ALA  66  -1.813   7.973  11.115
  477    HB1  ALA  66           HB1      ALA  66  -4.284   8.638  10.467
  478    HB2  ALA  66           HB2      ALA  66  -3.479   9.863   9.485
  479    HB3  ALA  66           HB3      ALA  66  -3.222   9.823  11.229
  480    H    GLY  67           H        GLY  67  -0.970   7.003   8.295
  481    HA2  GLY  67           HA3      GLY  67  -1.922   4.480   8.193
  482    HA3  GLY  67           HA2      GLY  67  -3.304   5.360   7.552
  483    H    ILE  68           H        ILE  68  -2.258   3.595   5.843
  484    HA   ILE  68           HA       ILE  68  -0.342   5.056   4.090
  485    HB   ILE  68           HB       ILE  68  -1.267   2.172   4.150
  486   HG12  ILE  68          HG13      ILE  68   1.512   3.339   4.464
  487   HG13  ILE  68          HG12      ILE  68   0.448   3.024   5.835
  488   HG21  ILE  68          HG21      ILE  68  -0.900   2.337   1.893
  489   HG22  ILE  68          HG22      ILE  68   0.785   2.183   2.392
  490   HG23  ILE  68          HG23      ILE  68   0.106   3.776   2.057
  491   HD11  ILE  68          HD11      ILE  68   2.133   1.170   5.157
  492   HD12  ILE  68          HD12      ILE  68   1.038   0.871   3.807
  493   HD13  ILE  68          HD13      ILE  68   0.464   0.695   5.466
  494    H    ALA  69           H        ALA  69  -0.916   5.613   1.968
  495    HA   ALA  69           HA       ALA  69  -3.781   5.146   1.210
  496    HB1  ALA  69           HB1      ALA  69  -2.253   7.610   1.480
  497    HB2  ALA  69           HB2      ALA  69  -3.990   7.392   1.263
  498    HB3  ALA  69           HB3      ALA  69  -2.923   7.434  -0.141
  499    H    LEU  70           H        LEU  70  -4.170   4.612  -0.954
  500    HA   LEU  70           HA       LEU  70  -1.735   3.967  -2.576
  501    HB2  LEU  70           HB3      LEU  70  -4.513   2.799  -2.555
  502    HB3  LEU  70           HB2      LEU  70  -3.307   2.391  -3.767
  503    HG   LEU  70           HG       LEU  70  -2.393   2.207  -0.957
  504   HD11  LEU  70          HD11      LEU  70  -4.495   1.246  -0.496
  505   HD12  LEU  70          HD12      LEU  70  -3.485  -0.146  -0.882
  506   HD13  LEU  70          HD13      LEU  70  -4.603   0.494  -2.087
  507   HD21  LEU  70          HD21      LEU  70  -1.157   0.364  -1.815
  508   HD22  LEU  70          HD22      LEU  70  -1.171   1.541  -3.129
  509   HD23  LEU  70          HD23      LEU  70  -2.261   0.154  -3.174
  510    H    LEU  71           H        LEU  71  -1.486   5.043  -4.509
  511    HA   LEU  71           HA       LEU  71  -3.792   6.700  -5.469
  512    HB2  LEU  71           HB3      LEU  71  -0.815   7.148  -5.853
  513    HB3  LEU  71           HB2      LEU  71  -2.101   8.199  -6.448
  514    HG   LEU  71           HG       LEU  71  -2.055   7.531  -3.528
  515   HD11  LEU  71          HD11      LEU  71  -0.573   9.570  -3.220
  516   HD12  LEU  71          HD12      LEU  71  -0.192   9.457  -4.937
  517   HD13  LEU  71          HD13      LEU  71   0.243   8.140  -3.848
  518   HD21  LEU  71          HD21      LEU  71  -2.523  10.235  -4.732
  519   HD22  LEU  71          HD22      LEU  71  -3.301   9.481  -3.340
  520   HD23  LEU  71          HD23      LEU  71  -3.749   8.990  -4.973
  521    H    GLU  72           H        GLU  72  -3.699   7.076  -7.903
  522    HA   GLU  72           HA       GLU  72  -2.856   4.548  -9.278
  523    HB2  GLU  72           HB3      GLU  72  -4.713   5.468 -10.951
  524    HB3  GLU  72           HB2      GLU  72  -5.150   4.515  -9.535
  525    HG2  GLU  72           HG3      GLU  72  -5.660   6.503  -8.263
  526    HG3  GLU  72           HG2      GLU  72  -5.009   7.541  -9.532
  527    H    ARG  73           H        ARG  73  -1.466   7.314  -8.884
  528    HA   ARG  73           HA       ARG  73   0.148   8.396 -10.212
  529    HB2  ARG  73           HB3      ARG  73  -0.230   6.189 -11.715
  530    HB3  ARG  73           HB2      ARG  73  -0.946   7.388 -12.790
  531    HG2  ARG  73           HG3      ARG  73   1.228   8.762 -12.255
  532    HG3  ARG  73           HG2      ARG  73   1.883   7.189 -11.796
  533    HD2  ARG  73           HD3      ARG  73   0.819   6.458 -14.121
  534    HD3  ARG  73           HD2      ARG  73   1.018   8.173 -14.485
  535    HE   ARG  73           HE       ARG  73   3.179   6.224 -14.140
  536   HH11  ARG  73          HH22      ARG  73   2.160   9.518 -14.084
  537   HH12  ARG  73          HH21      ARG  73   3.744  10.152 -14.382
  538   HH21  ARG  73          HH11      ARG  73   5.253   7.034 -14.526
  539   HH22  ARG  73          HH12      ARG  73   5.495   8.745 -14.632
  540    H    GLY  74           H        GLY  74  -2.522   9.350  -9.518
  541    HA2  GLY  74           HA3      GLY  74  -2.685  11.513 -11.536
  542    HA3  GLY  74           HA2      GLY  74  -4.159  10.601 -11.211
  543    H    GLY  75           H        GLY  75  -2.912  10.349  -8.335
  544    HA2  GLY  75           HA3      GLY  75  -2.685  11.862  -6.447
  545    HA3  GLY  75           HA2      GLY  75  -3.520  13.104  -7.378
  546    H    LEU  76           H        LEU  76  -5.234  10.416  -8.040
  547    HA   LEU  76           HA       LEU  76  -7.297  11.119  -6.054
  548    HB2  LEU  76           HB3      LEU  76  -7.204   9.757  -8.662
  549    HB3  LEU  76           HB2      LEU  76  -8.289   8.988  -7.506
  550    HG   LEU  76           HG       LEU  76  -9.388  10.772  -8.900
  551   HD11  LEU  76          HD11      LEU  76 -10.792  10.914  -7.152
  552   HD12  LEU  76          HD12      LEU  76  -9.721  12.084  -6.381
  553   HD13  LEU  76          HD13      LEU  76  -9.509  10.361  -6.075
  554   HD21  LEU  76          HD21      LEU  76  -8.585  12.900  -8.995
  555   HD22  LEU  76          HD22      LEU  76  -7.076  12.177  -8.441
  556   HD23  LEU  76          HD23      LEU  76  -8.175  12.921  -7.279
  557    H    THR  77           H        THR  77  -6.661  10.259  -4.078
  558    HA   THR  77           HA       THR  77  -5.310   7.857  -3.590
  559    HB   THR  77           HB       THR  77  -7.469   8.360  -1.665
  560    HG1  THR  77           HG1      THR  77  -5.761  10.407  -1.462
  561   HG21  THR  77          HG21      THR  77  -4.497   8.732  -1.312
  562   HG22  THR  77          HG22      THR  77  -5.224   7.127  -1.374
  563   HG23  THR  77          HG23      THR  77  -5.691   8.258  -0.106
  564    H    LEU  78           H        LEU  78  -5.854   5.736  -3.753
  565    HA   LEU  78           HA       LEU  78  -8.550   5.061  -4.748
  566    HB2  LEU  78           HB3      LEU  78  -6.179   3.246  -4.235
  567    HB3  LEU  78           HB2      LEU  78  -7.616   2.847  -5.165
  568    HG   LEU  78           HG       LEU  78  -5.703   5.098  -5.857
  569   HD11  LEU  78          HD11      LEU  78  -5.397   2.294  -6.222
  570   HD12  LEU  78          HD12      LEU  78  -4.395   3.588  -6.880
  571   HD13  LEU  78          HD13      LEU  78  -5.775   2.988  -7.799
  572   HD21  LEU  78          HD21      LEU  78  -7.662   5.707  -6.922
  573   HD22  LEU  78          HD22      LEU  78  -8.258   4.051  -7.008
  574   HD23  LEU  78          HD23      LEU  78  -7.019   4.598  -8.131
  575    H    MET  79           H        MET  79  -6.485   4.378  -1.928
  576    HA   MET  79           HA       MET  79  -8.889   3.846  -0.330
  577    HB2  MET  79           HB3      MET  79  -8.330   1.675  -1.477
  578    HB3  MET  79           HB2      MET  79  -6.800   1.668  -0.613
  579    HG2  MET  79           HG3      MET  79  -8.266   0.356   0.725
  580    HG3  MET  79           HG2      MET  79  -8.201   1.922   1.531
  581    HE1  MET  79           HE1      MET  79 -10.052  -0.316  -0.998
  582    HE2  MET  79           HE2      MET  79 -11.692  -0.222  -0.343
  583    HE3  MET  79           HE3      MET  79 -10.373  -0.820   0.660
  584    H    LEU  80           H        LEU  80  -8.508   4.183   1.852
  585    HA   LEU  80           HA       LEU  80  -5.747   5.064   2.573
  586    HB2  LEU  80           HB3      LEU  80  -7.483   6.792   2.802
  587    HB3  LEU  80           HB2      LEU  80  -8.432   5.722   3.829
  588    HG   LEU  80           HG       LEU  80  -6.633   5.716   5.513
  589   HD11  LEU  80          HD11      LEU  80  -5.222   7.241   3.353
  590   HD12  LEU  80          HD12      LEU  80  -4.600   5.985   4.424
  591   HD13  LEU  80          HD13      LEU  80  -4.851   7.619   5.036
  592   HD21  LEU  80          HD21      LEU  80  -7.117   8.590   4.725
  593   HD22  LEU  80          HD22      LEU  80  -7.018   7.899   6.345
  594   HD23  LEU  80          HD23      LEU  80  -8.424   7.573   5.331
  595    H    LEU  81           H        LEU  81  -4.790   3.190   3.340
  596    HA   LEU  81           HA       LEU  81  -6.257   1.347   5.090
  597    HB2  LEU  81           HB3      LEU  81  -3.674   1.388   3.677
  598    HB3  LEU  81           HB2      LEU  81  -3.594   0.648   5.274
  599    HG   LEU  81           HG       LEU  81  -5.465  -0.840   4.696
  600   HD11  LEU  81          HD11      LEU  81  -5.688   1.046   2.480
  601   HD12  LEU  81          HD12      LEU  81  -6.882  -0.094   3.102
  602   HD13  LEU  81          HD13      LEU  81  -5.682  -0.627   1.925
  603   HD21  LEU  81          HD21      LEU  81  -3.368  -0.866   2.504
  604   HD22  LEU  81          HD22      LEU  81  -4.283  -2.247   3.115
  605   HD23  LEU  81          HD23      LEU  81  -3.084  -1.459   4.141
  606    H    GLY  82           H        GLY  82  -6.516   1.817   7.223
  607    HA2  GLY  82           HA3      GLY  82  -4.798   3.834   8.496
  608    HA3  GLY  82           HA2      GLY  82  -6.205   3.069   9.225
  609    H    ARG  83           H        ARG  83  -3.142   3.397   9.873
  610    HA   ARG  83           HA       ARG  83  -2.138   0.707  10.141
  611    HB2  ARG  83           HB3      ARG  83  -0.689   2.722  10.180
  612    HB3  ARG  83           HB2      ARG  83  -1.409   3.189  11.717
  613    HG2  ARG  83           HG3      ARG  83  -0.578   0.458  11.924
  614    HG3  ARG  83           HG2      ARG  83   0.765   1.389  11.261
  615    HD2  ARG  83           HD3      ARG  83   0.902   1.436  13.690
  616    HD3  ARG  83           HD2      ARG  83   0.473   3.045  13.111
  617    HE   ARG  83           HE       ARG  83  -1.980   1.912  13.601
  618   HH11  ARG  83          HH22      ARG  83   0.974   2.180  15.358
  619   HH12  ARG  83          HH21      ARG  83   0.203   2.217  16.909
  620   HH21  ARG  83          HH11      ARG  83  -3.004   1.959  15.617
  621   HH22  ARG  83          HH12      ARG  83  -2.049   2.091  17.055
  622    H    GLN  84           H        GLN  84  -2.826  -0.827  11.550
  623    HA   GLN  84           HA       GLN  84  -4.198   0.053  14.039
  624    HB2  GLN  84           HB3      GLN  84  -5.661  -1.045  12.306
  625    HB3  GLN  84           HB2      GLN  84  -4.609  -2.453  12.381
  626    HG2  GLN  84           HG3      GLN  84  -6.661  -2.723  13.756
  627    HG3  GLN  84           HG2      GLN  84  -5.195  -2.818  14.715
  628   HE21  GLN  84          HE22      GLN  84  -7.090  -0.007  13.478
  629   HE22  GLN  84          HE21      GLN  84  -7.270   0.728  14.997
  630    H    GLY  85           H        GLY  85  -1.628  -0.002  14.377
  631    HA2  GLY  85           HA3      GLY  85  -0.358  -1.153  16.152
  632    HA3  GLY  85           HA2      GLY  85  -0.982  -2.683  15.538
  633    H    GLU  86           H        GLU  86   1.527  -0.404  15.335
  634    HA   GLU  86           HA       GLU  86   2.827  -0.186  13.085
  635    HB2  GLU  86           HB3      GLU  86   3.907  -0.092  15.359
  636    HB3  GLU  86           HB2      GLU  86   4.178  -1.831  15.235
  637    HG2  GLU  86           HG3      GLU  86   5.093  -0.801  12.795
  638    HG3  GLU  86           HG2      GLU  86   5.659   0.350  14.006
  639    H    GLY  87           H        GLY  87   2.629  -1.334  11.230
  640    HA2  GLY  87           HA3      GLY  87   3.270  -3.103   9.766
  641    HA3  GLY  87           HA2      GLY  87   3.661  -4.091  11.166
  642    H    ASP  88           H        ASP  88   0.627  -2.513  11.298
  643    HA   ASP  88           HA       ASP  88  -0.795  -4.831  10.121
  644    HB2  ASP  88           HB3      ASP  88  -1.421  -3.898  12.934
  645    HB3  ASP  88           HB2      ASP  88  -2.061  -5.315  12.101
  646    H    TYR  89           H        TYR  89  -1.706  -3.467   8.583
  647    HA   TYR  89           HA       TYR  89  -3.367  -1.195   9.597
  648    HB2  TYR  89           HB3      TYR  89  -2.500  -1.643   6.736
  649    HB3  TYR  89           HB2      TYR  89  -3.184  -0.197   7.414
  650    HD1  TYR  89           HD1      TYR  89  -0.181  -2.441   8.069
  651    HD2  TYR  89           HD2      TYR  89  -1.732   1.571   7.771
  652    HE1  TYR  89           HE1      TYR  89   2.068  -1.527   8.498
  653    HE2  TYR  89           HE2      TYR  89   0.533   2.465   8.199
  654    HH   TYR  89           HH       TYR  89   3.165   0.421   9.198
  655    H    ARG  90           H        ARG  90  -5.543  -1.135   8.968
  656    HA   ARG  90           HA       ARG  90  -6.538  -3.189   7.108
  657    HB2  ARG  90           HB3      ARG  90  -8.265  -3.129   9.444
  658    HB3  ARG  90           HB2      ARG  90  -7.577  -4.517   8.610
  659    HG2  ARG  90           HG3      ARG  90  -5.552  -4.394   9.904
  660    HG3  ARG  90           HG2      ARG  90  -6.008  -2.832  10.575
  661    HD2  ARG  90           HD3      ARG  90  -7.556  -5.396  11.010
  662    HD3  ARG  90           HD2      ARG  90  -6.428  -4.698  12.170
  663    HE   ARG  90           HE       ARG  90  -8.355  -2.716  11.446
  664   HH11  ARG  90          HH22      ARG  90  -7.993  -5.697  13.138
  665   HH12  ARG  90          HH21      ARG  90  -9.266  -5.364  14.264
  666   HH21  ARG  90          HH11      ARG  90 -10.017  -2.263  12.906
  667   HH22  ARG  90          HH12      ARG  90 -10.412  -3.421  14.132
  668    H    VAL  91           H        VAL  91  -8.798  -2.745   6.495
  669    HA   VAL  91           HA       VAL  91  -9.772  -0.032   7.245
  670    HB   VAL  91           HB       VAL  91  -8.433   0.092   5.096
  671   HG11  VAL  91          HG11      VAL  91  -9.376  -2.275   4.447
  672   HG12  VAL  91          HG12      VAL  91  -9.105  -1.074   3.183
  673   HG13  VAL  91          HG13      VAL  91 -10.733  -1.353   3.801
  674   HG21  VAL  91          HG21      VAL  91 -10.155   1.376   3.898
  675   HG22  VAL  91          HG22      VAL  91 -10.261   1.688   5.630
  676   HG23  VAL  91          HG23      VAL  91 -11.418   0.604   4.858
  677    H    GLN  92           H        GLN  92 -11.865  -0.235   7.842
  678    HA   GLN  92           HA       GLN  92 -13.347  -2.616   7.747
  679    HB2  GLN  92           HB3      GLN  92 -13.946   0.234   8.241
  680    HB3  GLN  92           HB2      GLN  92 -15.325  -0.728   7.709
  681    HG2  GLN  92           HG3      GLN  92 -15.029  -2.297   9.511
  682    HG3  GLN  92           HG2      GLN  92 -13.481  -1.574   9.957
  683   HE21  GLN  92          HE22      GLN  92 -13.515   0.262  11.335
  684   HE22  GLN  92          HE21      GLN  92 -14.944   0.975  11.911
  685    H    LYS  93           H        LYS  93 -14.017  -3.721   5.990
  686    HA   LYS  93           HA       LYS  93 -15.190  -2.202   3.707
  687    HB2  LYS  93           HB3      LYS  93 -13.007  -2.712   2.890
  688    HB3  LYS  93           HB2      LYS  93 -13.047  -4.333   3.584
  689    HG2  LYS  93           HG3      LYS  93 -14.567  -5.123   1.972
  690    HG3  LYS  93           HG2      LYS  93 -15.086  -3.496   1.531
  691    HD2  LYS  93           HD3      LYS  93 -12.881  -3.046   0.542
  692    HD3  LYS  93           HD2      LYS  93 -12.335  -4.658   1.001
  693    HE2  LYS  93           HE3      LYS  93 -13.067  -4.540  -1.381
  694    HE3  LYS  93           HE2      LYS  93 -14.020  -5.682  -0.434
  695    HZ1  LYS  93           HZ1      LYS  93 -14.866  -2.873  -0.802
  696    HZ2  LYS  93           HZ2      LYS  93 -15.801  -4.201  -0.309
  697    HZ3  LYS  93           HZ3      LYS  93 -15.276  -4.084  -1.921
  698    H    GLY  94           H        GLY  94 -17.173  -3.018   3.235
  699    HA2  GLY  94           HA3      GLY  94 -18.962  -4.532   3.094
  700    HA3  GLY  94           HA2      GLY  94 -17.764  -5.825   3.141
  701    H    ASP  95           H        ASP  95 -19.687  -6.720   4.508
  702    HA   ASP  95           HA       ASP  95 -19.677  -5.693   7.286
  703    HB2  ASP  95           HB3      ASP  95 -21.327  -7.753   5.816
  704    HB3  ASP  95           HB2      ASP  95 -21.405  -7.581   7.570
  705    H    GLY  96           H        GLY  96 -17.991  -7.942   5.424
  706    HA2  GLY  96           HA3      GLY  96 -17.049  -9.336   7.895
  707    HA3  GLY  96           HA2      GLY  96 -17.419 -10.260   6.440
  708    H    GLY  97           H        GLY  97 -16.388  -7.981   4.758
  709    HA2  GLY  97           HA3      GLY  97 -13.881  -8.866   4.058
  710    HA3  GLY  97           HA2      GLY  97 -14.327  -7.166   3.923
  711    H    GLN  98           H        GLN  98 -11.712  -7.778   4.439
  712    HA   GLN  98           HA       GLN  98 -11.087  -6.247   6.704
  713    HB2  GLN  98           HB3      GLN  98 -11.930  -8.616   7.726
  714    HB3  GLN  98           HB2      GLN  98 -10.256  -9.030   7.403
  715    HG2  GLN  98           HG3      GLN  98  -9.491  -7.074   8.672
  716    HG3  GLN  98           HG2      GLN  98 -11.166  -6.621   8.996
  717   HE21  GLN  98          HE22      GLN  98 -10.872 -10.010   8.948
  718   HE22  GLN  98          HE21      GLN  98 -10.745 -10.267  10.621
  719    H    LEU  99           H        LEU  99  -9.624  -5.403   5.254
  720    HA   LEU  99           HA       LEU  99  -7.661  -7.122   3.945
  721    HB2  LEU  99           HB3      LEU  99  -7.563  -4.121   4.222
  722    HB3  LEU  99           HB2      LEU  99  -6.834  -5.115   2.973
  723    HG   LEU  99           HG       LEU  99  -9.804  -4.789   3.432
  724   HD11  LEU  99          HD11      LEU  99  -8.797  -3.955   0.850
  725   HD12  LEU  99          HD12      LEU  99  -7.970  -3.085   2.142
  726   HD13  LEU  99          HD13      LEU  99  -9.728  -3.030   2.027
  727   HD21  LEU  99          HD21      LEU  99  -9.709  -5.891   1.042
  728   HD22  LEU  99          HD22      LEU  99  -9.595  -6.909   2.477
  729   HD23  LEU  99          HD23      LEU  99  -8.137  -6.476   1.586
  730    H    VAL 100           H        VAL 100  -5.575  -7.493   4.667
  731    HA   VAL 100           HA       VAL 100  -4.697  -6.060   7.142
  732    HB   VAL 100           HB       VAL 100  -4.393  -9.030   6.624
  733   HG11  VAL 100          HG11      VAL 100  -3.670  -7.235   8.955
  734   HG12  VAL 100          HG12      VAL 100  -2.563  -8.170   7.948
  735   HG13  VAL 100          HG13      VAL 100  -3.675  -8.996   9.040
  736   HG21  VAL 100          HG21      VAL 100  -6.007  -9.270   8.492
  737   HG22  VAL 100          HG22      VAL 100  -6.729  -8.428   7.121
  738   HG23  VAL 100          HG23      VAL 100  -6.200  -7.518   8.536
  739    H    LEU 101           H        LEU 101  -3.070  -4.829   6.169
  740    HA   LEU 101           HA       LEU 101  -1.156  -6.168   4.334
  741    HB2  LEU 101           HB3      LEU 101  -2.020  -3.815   3.913
  742    HB3  LEU 101           HB2      LEU 101  -1.153  -3.327   5.351
  743    HG   LEU 101           HG       LEU 101   0.624  -4.828   3.671
  744   HD11  LEU 101          HD11      LEU 101   0.709  -3.126   1.813
  745   HD12  LEU 101          HD12      LEU 101  -0.822  -2.483   2.405
  746   HD13  LEU 101          HD13      LEU 101  -0.737  -4.131   1.789
  747   HD21  LEU 101          HD21      LEU 101   1.994  -2.842   3.935
  748   HD22  LEU 101          HD22      LEU 101   1.167  -3.136   5.464
  749   HD23  LEU 101          HD23      LEU 101   0.585  -1.879   4.375
  750    H    ARG 102           H        ARG 102   0.594  -7.232   5.309
  751    HA   ARG 102           HA       ARG 102   1.842  -5.902   7.652
  752    HB2  ARG 102           HB3      ARG 102   0.271  -7.740   8.414
  753    HB3  ARG 102           HB2      ARG 102   1.284  -8.877   7.523
  754    HG2  ARG 102           HG3      ARG 102   3.118  -7.403   8.998
  755    HG3  ARG 102           HG2      ARG 102   1.763  -7.602  10.111
  756    HD2  ARG 102           HD3      ARG 102   1.774 -10.066   9.534
  757    HD3  ARG 102           HD2      ARG 102   3.281  -9.787   8.662
  758    HE   ARG 102           HE       ARG 102   2.957  -9.822  11.573
  759   HH11  ARG 102          HH22      ARG 102   4.782  -8.791   8.835
  760   HH12  ARG 102          HH21      ARG 102   6.260  -8.615   9.721
  761   HH21  ARG 102          HH11      ARG 102   4.875  -9.595  12.744
  762   HH22  ARG 102          HH12      ARG 102   6.312  -9.069  11.933
  763    H    ARG 103           H        ARG 103   4.037  -5.971   7.532
  764    HA   ARG 103           HA       ARG 103   5.478  -6.398   5.231
  765    HB2  ARG 103           HB3      ARG 103   7.136  -7.374   7.351
  766    HB3  ARG 103           HB2      ARG 103   7.167  -5.788   6.581
  767    HG2  ARG 103           HG3      ARG 103   5.416  -4.991   8.108
  768    HG3  ARG 103           HG2      ARG 103   5.331  -6.584   8.861
  769    HD2  ARG 103           HD3      ARG 103   7.707  -4.705   8.855
  770    HD3  ARG 103           HD2      ARG 103   6.728  -5.167  10.246
  771    HE   ARG 103           HE       ARG 103   7.806  -7.531   9.060
  772   HH11  ARG 103          HH22      ARG 103   8.699  -4.685  10.791
  773   HH12  ARG 103          HH21      ARG 103  10.070  -5.419  11.554
  774   HH21  ARG 103          HH11      ARG 103   9.590  -8.505  10.046
  775   HH22  ARG 103          HH12      ARG 103  10.575  -7.581  11.132
  776    H    ALA 104           H        ALA 104   6.084  -8.132   4.020
  777    HA   ALA 104           HA       ALA 104   5.032 -10.720   4.423
  778    HB1  ALA 104           HB1      ALA 104   6.060 -11.216   2.452
  779    HB2  ALA 104           HB2      ALA 104   7.624 -10.625   3.012
  780    HB3  ALA 104           HB3      ALA 104   6.417  -9.490   2.408
  781    H    THR 105           H        THR 105   5.809 -12.553   5.460
  782    HA   THR 105           HA       THR 105   8.027 -12.106   7.361
  783    HB   THR 105           HB       THR 105   6.885 -14.755   7.492
  784    HG1  THR 105           HG1      THR 105   4.770 -14.225   7.752
  785   HG21  THR 105          HG21      THR 105   7.984 -13.517   9.337
  786   HG22  THR 105          HG22      THR 105   6.353 -14.026   9.773
  787   HG23  THR 105          HG23      THR 105   6.663 -12.349   9.322
  788    HA   PRO 106           HA       PRO 106   9.396 -16.069   4.810
  789    HB2  PRO 106           HB2      PRO 106   8.224 -15.379   2.175
  790    HB3  PRO 106           HB3      PRO 106   8.290 -16.945   3.004
  791    HG2  PRO 106           HG3      PRO 106   6.018 -15.557   2.776
  792    HG3  PRO 106           HG2      PRO 106   6.382 -16.541   4.202
  793    HD2  PRO 106           HD3      PRO 106   6.500 -13.565   3.884
  794    HD3  PRO 106           HD2      PRO 106   6.016 -14.531   5.296
  Start of MODEL    5
    1    H1   SER   1           H        SER   1  12.606  21.700  -7.606
    2    H2   SER   1           H2       SER   1  13.280  23.165  -8.140
    3    H3   SER   1           1HT      SER   1  14.070  21.696  -8.462
    4    HA   SER   1           HA       SER   1  15.304  22.362  -6.694
    5    HB2  SER   1           HB3      SER   1  12.786  23.582  -5.525
    6    HB3  SER   1           HB2      SER   1  14.416  23.741  -4.874
    7    HG   SER   1           HG       SER   1  14.820  24.531  -7.191
    8    H    SER   2           H        SER   2  12.852  20.264  -7.019
    9    HA   SER   2           HA       SER   2  12.679  19.299  -4.252
   10    HB2  SER   2           HB3      SER   2  11.369  17.432  -5.299
   11    HB3  SER   2           HB2      SER   2  10.730  19.028  -5.679
   12    HG   SER   2           HG       SER   2  11.172  18.680  -7.700
   13    H    LEU   3           H        LEU   3  14.234  18.274  -7.288
   14    HA   LEU   3           HA       LEU   3  15.942  16.709  -7.665
   15    HB2  LEU   3           HB3      LEU   3  16.689  17.217  -4.776
   16    HB3  LEU   3           HB2      LEU   3  17.754  16.756  -6.103
   17    HG   LEU   3           HG       LEU   3  16.252  19.380  -5.859
   18   HD11  LEU   3          HD11      LEU   3  18.634  20.272  -5.785
   19   HD12  LEU   3          HD12      LEU   3  19.165  18.607  -5.551
   20   HD13  LEU   3          HD13      LEU   3  18.123  19.375  -4.353
   21   HD21  LEU   3          HD21      LEU   3  17.884  19.874  -7.854
   22   HD22  LEU   3          HD22      LEU   3  16.385  19.000  -8.170
   23   HD23  LEU   3          HD23      LEU   3  17.907  18.120  -8.036
   24    H    ILE   4           H        ILE   4  17.106  14.790  -6.030
   25    HA   ILE   4           HA       ILE   4  14.873  12.909  -5.737
   26    HB   ILE   4           HB       ILE   4  17.000  12.160  -6.733
   27   HG12  ILE   4          HG13      ILE   4  16.924  10.777  -4.077
   28   HG13  ILE   4          HG12      ILE   4  15.475  10.738  -5.081
   29   HG21  ILE   4          HG21      ILE   4  18.184  12.653  -3.985
   30   HG22  ILE   4          HG22      ILE   4  18.435  13.710  -5.374
   31   HG23  ILE   4          HG23      ILE   4  19.033  12.051  -5.409
   32   HD11  ILE   4          HD11      ILE   4  17.001   8.798  -5.496
   33   HD12  ILE   4          HD12      ILE   4  18.238   9.933  -6.036
   34   HD13  ILE   4          HD13      ILE   4  16.728   9.781  -6.936
   35    H    LEU   5           H        LEU   5  14.594  11.646  -3.716
   36    HA   LEU   5           HA       LEU   5  15.773  12.541  -1.237
   37    HB2  LEU   5           HB3      LEU   5  14.011  14.367  -2.025
   38    HB3  LEU   5           HB2      LEU   5  12.858  13.214  -1.352
   39    HG   LEU   5           HG       LEU   5  15.231  14.413   0.104
   40   HD11  LEU   5          HD11      LEU   5  13.662  15.692   1.330
   41   HD12  LEU   5          HD12      LEU   5  12.303  14.716   0.770
   42   HD13  LEU   5          HD13      LEU   5  13.112  15.823  -0.340
   43   HD21  LEU   5          HD21      LEU   5  13.201  12.301   0.837
   44   HD22  LEU   5          HD22      LEU   5  14.025  13.248   2.075
   45   HD23  LEU   5          HD23      LEU   5  14.958  12.227   0.980
   46    H    LEU   6           H        LEU   6  15.979  10.376  -0.686
   47    HA   LEU   6           HA       LEU   6  13.564   8.650  -0.779
   48    HB2  LEU   6           HB3      LEU   6  16.345   7.853   0.103
   49    HB3  LEU   6           HB2      LEU   6  15.047   6.806  -0.470
   50    HG   LEU   6           HG       LEU   6  15.337   8.566  -2.568
   51   HD11  LEU   6          HD11      LEU   6  18.096   7.909  -1.486
   52   HD12  LEU   6          HD12      LEU   6  17.367   9.516  -1.501
   53   HD13  LEU   6          HD13      LEU   6  17.747   8.706  -3.020
   54   HD21  LEU   6          HD21      LEU   6  16.473   6.661  -3.688
   55   HD22  LEU   6          HD22      LEU   6  15.098   6.122  -2.723
   56   HD23  LEU   6          HD23      LEU   6  16.739   5.911  -2.115
   57    H    SER   7           H        SER   7  12.356   8.376   1.024
   58    HA   SER   7           HA       SER   7  13.652   8.728   3.695
   59    HB2  SER   7           HB3      SER   7  10.834   9.574   3.515
   60    HB3  SER   7           HB2      SER   7  12.184  10.330   4.356
   61    HG   SER   7           HG       SER   7  12.622  11.485   2.628
   62    H    ALA   8           H        ALA   8  11.928   6.759   1.630
   63    HA   ALA   8           HA       ALA   8  10.368   5.429   3.770
   64    HB1  ALA   8           HB1      ALA   8  10.521   5.125   0.772
   65    HB2  ALA   8           HB2      ALA   8   9.128   5.563   1.761
   66    HB3  ALA   8           HB3      ALA   8   9.733   3.906   1.773
   67    H    SER   9           H        SER   9  13.440   5.433   3.404
   68    HA   SER   9           HA       SER   9  14.271   2.807   2.666
   69    HB2  SER   9           HB3      SER   9  16.007   3.664   4.700
   70    HB3  SER   9           HB2      SER   9  16.227   3.881   2.965
   71    HG   SER   9           HG       SER   9  15.294   5.869   3.102
   72    H    ASP  10           H        ASP  10  12.725   4.020   5.541
   73    HA   ASP  10           HA       ASP  10  13.392   1.572   7.067
   74    HB2  ASP  10           HB3      ASP  10  11.599   2.934   8.620
   75    HB3  ASP  10           HB2      ASP  10  13.342   3.201   8.663
   76    H    LEU  11           H        LEU  11  10.677   3.080   5.394
   77    HA   LEU  11           HA       LEU  11   8.812   0.995   6.314
   78    HB2  LEU  11           HB3      LEU  11   8.401   3.144   4.214
   79    HB3  LEU  11           HB2      LEU  11   7.145   2.191   5.007
   80    HG   LEU  11           HG       LEU  11   9.037   4.111   6.400
   81   HD11  LEU  11          HD11      LEU  11   6.222   4.319   5.383
   82   HD12  LEU  11          HD12      LEU  11   7.517   5.514   5.329
   83   HD13  LEU  11          HD13      LEU  11   6.673   5.197   6.845
   84   HD21  LEU  11          HD21      LEU  11   8.517   2.548   8.049
   85   HD22  LEU  11          HD22      LEU  11   6.948   2.168   7.339
   86   HD23  LEU  11          HD23      LEU  11   7.173   3.676   8.226
   87    H    ALA  12           H        ALA  12  11.254   1.016   4.122
   88    HA   ALA  12           HA       ALA  12   9.923  -0.256   1.860
   89    HB1  ALA  12           HB1      ALA  12  12.868  -0.274   2.594
   90    HB2  ALA  12           HB2      ALA  12  12.084   1.005   1.667
   91    HB3  ALA  12           HB3      ALA  12  12.177  -0.629   1.012
   92    H    GLY  13           H        GLY  13  10.356  -2.536   1.241
   93    HA2  GLY  13           HA3      GLY  13  11.526  -4.613   2.439
   94    HA3  GLY  13           HA2      GLY  13  10.276  -4.281   3.633
   95    H    GLN  14           H        GLN  14   9.365  -6.390   3.165
   96    HA   GLN  14           HA       GLN  14   7.884  -6.503   0.564
   97    HB2  GLN  14           HB3      GLN  14   9.672  -8.354   1.440
   98    HB3  GLN  14           HB2      GLN  14   8.196  -8.971   2.184
   99    HG2  GLN  14           HG3      GLN  14   7.067  -8.866  -0.034
  100    HG3  GLN  14           HG2      GLN  14   8.591  -8.349  -0.757
  101   HE21  GLN  14          HE22      GLN  14  10.522  -9.938  -0.135
  102   HE22  GLN  14          HE21      GLN  14  10.155 -11.593  -0.229
  103    H    TRP  15           H        TRP  15   5.654  -7.102   0.717
  104    HA   TRP  15           HA       TRP  15   4.520  -7.428   3.429
  105    HB2  TRP  15           HB3      TRP  15   3.712  -5.197   1.541
  106    HB3  TRP  15           HB2      TRP  15   2.823  -5.647   2.986
  107    HD1  TRP  15           HD1      TRP  15   6.385  -4.427   2.012
  108    HE1  TRP  15           HE1      TRP  15   7.294  -3.026   3.971
  109    HE3  TRP  15           HE3      TRP  15   2.554  -4.974   5.359
  110    HZ2  TRP  15           HZ2      TRP  15   6.509  -2.230   6.599
  111    HZ3  TRP  15           HZ3      TRP  15   2.664  -3.876   7.579
  112    HH2  TRP  15           HH2      TRP  15   4.634  -2.506   8.202
  113    H    THR  16           H        THR  16   2.021  -7.696   3.141
  114    HA   THR  16           HA       THR  16   1.325  -8.943   0.534
  115    HB   THR  16           HB       THR  16   0.275 -10.770   2.286
  116    HG1  THR  16           HG1      THR  16   2.848 -10.787   3.188
  117   HG21  THR  16          HG21      THR  16   2.839 -10.730   0.705
  118   HG22  THR  16          HG22      THR  16   1.311 -11.508   0.296
  119   HG23  THR  16          HG23      THR  16   2.323 -12.173   1.578
  120    H    LEU  17           H        LEU  17  -1.080  -9.467   0.525
  121    HA   LEU  17           HA       LEU  17  -2.612  -7.780   2.464
  122    HB2  LEU  17           HB3      LEU  17  -2.164  -6.992  -0.134
  123    HB3  LEU  17           HB2      LEU  17  -3.679  -7.873  -0.289
  124    HG   LEU  17           HG       LEU  17  -4.601  -6.508   1.607
  125   HD11  LEU  17          HD11      LEU  17  -3.191  -5.279   2.849
  126   HD12  LEU  17          HD12      LEU  17  -2.850  -4.277   1.439
  127   HD13  LEU  17          HD13      LEU  17  -1.851  -5.690   1.780
  128   HD21  LEU  17          HD21      LEU  17  -3.642  -5.240  -0.949
  129   HD22  LEU  17          HD22      LEU  17  -4.583  -4.309   0.215
  130   HD23  LEU  17          HD23      LEU  17  -5.272  -5.757  -0.521
  131    H    GLN  18           H        GLN  18  -4.703  -8.591   2.927
  132    HA   GLN  18           HA       GLN  18  -5.480 -11.144   1.607
  133    HB2  GLN  18           HB3      GLN  18  -4.322 -11.011   4.175
  134    HB3  GLN  18           HB2      GLN  18  -6.050 -11.242   4.444
  135    HG2  GLN  18           HG3      GLN  18  -5.985 -13.127   2.778
  136    HG3  GLN  18           HG2      GLN  18  -4.230 -12.957   2.731
  137   HE21  GLN  18          HE22      GLN  18  -6.677 -14.674   4.258
  138   HE22  GLN  18          HE21      GLN  18  -5.847 -15.117   5.671
  139    H    GLN  19           H        GLN  19  -7.677 -11.295   1.317
  140    HA   GLN  19           HA       GLN  19  -9.279  -8.932   1.876
  141    HB2  GLN  19           HB3      GLN  19  -9.716 -10.200  -0.150
  142    HB3  GLN  19           HB2      GLN  19 -10.018 -11.667   0.776
  143    HG2  GLN  19           HG3      GLN  19 -12.030 -10.813   1.689
  144    HG3  GLN  19           HG2      GLN  19 -11.632  -9.158   1.225
  145   HE21  GLN  19          HE22      GLN  19 -12.366  -8.448  -0.807
  146   HE22  GLN  19          HE21      GLN  19 -13.065  -9.460  -1.976
  147    H    ASP  20           H        ASP  20  -8.731 -12.025   3.394
  148    HA   ASP  20           HA       ASP  20  -9.859 -11.250   5.883
  149    HB2  ASP  20           HB3      ASP  20 -11.809 -12.959   5.770
  150    HB3  ASP  20           HB2      ASP  20 -12.051 -11.393   4.993
  151    H    GLU  21           H        GLU  21 -10.788 -14.437   5.027
  152    HA   GLU  21           HA       GLU  21  -8.124 -15.545   5.766
  153    HB2  GLU  21           HB3      GLU  21 -10.745 -16.404   7.033
  154    HB3  GLU  21           HB2      GLU  21  -9.144 -17.058   7.386
  155    HG2  GLU  21           HG3      GLU  21  -8.412 -14.848   8.198
  156    HG3  GLU  21           HG2      GLU  21 -10.010 -14.188   7.845
  157    H    ALA  22           H        ALA  22  -9.630 -15.380   3.233
  158    HA   ALA  22           HA       ALA  22  -9.956 -18.312   2.733
  159    HB1  ALA  22           HB1      ALA  22 -12.060 -17.939   2.033
  160    HB2  ALA  22           HB2      ALA  22 -11.446 -16.829   0.807
  161    HB3  ALA  22           HB3      ALA  22 -11.886 -16.224   2.403
  162    HA   PRO  23           HA       PRO  23  -6.953 -18.315  -0.503
  163    HB2  PRO  23           HB2      PRO  23  -9.204 -18.787  -2.420
  164    HB3  PRO  23           HB3      PRO  23  -7.666 -19.651  -2.251
  165    HG2  PRO  23           HG3      PRO  23 -10.013 -20.590  -1.299
  166    HG3  PRO  23           HG2      PRO  23  -8.441 -20.977  -0.585
  167    HD2  PRO  23           HD3      PRO  23 -10.604 -19.343   0.525
  168    HD3  PRO  23           HD2      PRO  23  -9.156 -19.987   1.327
  169    H    ALA  24           H        ALA  24  -6.440 -16.049  -0.498
  170    HA   ALA  24           HA       ALA  24  -6.888 -14.656  -2.934
  171    HB1  ALA  24           HB1      ALA  24  -8.833 -14.080  -0.726
  172    HB2  ALA  24           HB2      ALA  24  -9.105 -14.139  -2.469
  173    HB3  ALA  24           HB3      ALA  24  -8.293 -12.749  -1.749
  174    H    ILE  25           H        ILE  25  -4.516 -14.719  -2.123
  175    HA   ILE  25           HA       ILE  25  -3.980 -12.339  -0.386
  176    HB   ILE  25           HB       ILE  25  -3.309 -14.563   0.574
  177   HG12  ILE  25          HG13      ILE  25  -0.982 -12.764  -0.180
  178   HG13  ILE  25          HG12      ILE  25  -2.111 -12.442   1.138
  179   HG21  ILE  25          HG21      ILE  25  -1.097 -14.668  -1.441
  180   HG22  ILE  25          HG22      ILE  25  -2.676 -15.312  -1.894
  181   HG23  ILE  25          HG23      ILE  25  -1.819 -15.973  -0.501
  182   HD11  ILE  25          HD11      ILE  25   0.223 -14.085   1.191
  183   HD12  ILE  25          HD12      ILE  25  -1.178 -15.136   1.401
  184   HD13  ILE  25          HD13      ILE  25  -0.921 -13.780   2.499
  185    H    CYS  26           H        CYS  26  -3.040 -10.684  -1.480
  186    HA   CYS  26           HA       CYS  26  -1.665 -11.281  -4.069
  187    HB2  CYS  26           HB3      CYS  26  -3.220  -8.962  -3.025
  188    HB3  CYS  26           HB2      CYS  26  -1.860  -8.599  -4.079
  189    H    HIS  27           H        HIS  27   0.539 -11.328  -3.908
  190    HA   HIS  27           HA       HIS  27   1.975 -10.338  -1.624
  191    HB2  HIS  27           HB3      HIS  27   3.721 -10.411  -3.878
  192    HB3  HIS  27           HB2      HIS  27   3.583 -11.599  -2.582
  193    HD1  HIS  27           HD1      HIS  27   1.684 -13.492  -2.959
  194    HD2  HIS  27           HD2      HIS  27   2.761 -11.296  -6.337
  195    HE1  HIS  27           HE1      HIS  27   0.847 -14.801  -4.962
  196    HE2  HIS  27           HE2      HIS  27   1.498 -13.472  -7.022
  197    H    LEU  28           H        LEU  28   2.853  -8.307  -1.271
  198    HA   LEU  28           HA       LEU  28   2.552  -6.297  -3.474
  199    HB2  LEU  28           HB3      LEU  28   1.486  -6.339  -0.752
  200    HB3  LEU  28           HB2      LEU  28   2.445  -4.898  -1.064
  201    HG   LEU  28           HG       LEU  28   0.030  -4.604  -1.636
  202   HD11  LEU  28          HD11      LEU  28   0.799  -3.097  -3.109
  203   HD12  LEU  28          HD12      LEU  28   0.995  -4.363  -4.319
  204   HD13  LEU  28          HD13      LEU  28   2.320  -3.982  -3.218
  205   HD21  LEU  28          HD21      LEU  28   0.314  -6.222  -4.097
  206   HD22  LEU  28          HD22      LEU  28  -1.089  -5.980  -3.062
  207   HD23  LEU  28          HD23      LEU  28   0.154  -7.139  -2.602
  208    H    GLU  29           H        GLU  29   4.155  -4.572  -3.436
  209    HA   GLU  29           HA       GLU  29   6.552  -5.113  -1.741
  210    HB2  GLU  29           HB3      GLU  29   6.324  -5.512  -4.595
  211    HB3  GLU  29           HB2      GLU  29   7.488  -4.230  -4.260
  212    HG2  GLU  29           HG3      GLU  29   8.727  -5.679  -2.750
  213    HG3  GLU  29           HG2      GLU  29   7.511  -6.947  -2.914
  214    H    LEU  30           H        LEU  30   6.807  -3.281  -0.605
  215    HA   LEU  30           HA       LEU  30   5.888  -0.702  -1.677
  216    HB2  LEU  30           HB3      LEU  30   6.765  -1.780   0.943
  217    HB3  LEU  30           HB2      LEU  30   7.173  -0.092   0.645
  218    HG   LEU  30           HG       LEU  30   4.851   0.451   0.189
  219   HD11  LEU  30          HD11      LEU  30   4.629  -2.508   0.063
  220   HD12  LEU  30          HD12      LEU  30   3.770  -1.275  -0.860
  221   HD13  LEU  30          HD13      LEU  30   3.264  -1.656   0.786
  222   HD21  LEU  30          HD21      LEU  30   4.032   0.291   2.377
  223   HD22  LEU  30          HD22      LEU  30   5.764   0.053   2.621
  224   HD23  LEU  30          HD23      LEU  30   4.678  -1.336   2.603
  225    H    ARG  31           H        ARG  31   7.270  -0.049  -3.321
  226    HA   ARG  31           HA       ARG  31  10.111  -0.474  -3.281
  227    HB2  ARG  31           HB3      ARG  31   8.165   0.922  -4.973
  228    HB3  ARG  31           HB2      ARG  31   9.744   1.709  -4.929
  229    HG2  ARG  31           HG3      ARG  31  10.835  -0.419  -5.516
  230    HG3  ARG  31           HG2      ARG  31   9.267  -1.226  -5.530
  231    HD2  ARG  31           HD3      ARG  31   9.937  -0.643  -7.817
  232    HD3  ARG  31           HD2      ARG  31   8.518   0.289  -7.342
  233    HE   ARG  31           HE       ARG  31  10.833   1.817  -6.706
  234   HH11  ARG  31          HH22      ARG  31   9.084   0.536  -9.388
  235   HH12  ARG  31          HH21      ARG  31   9.561   1.801 -10.472
  236   HH21  ARG  31          HH11      ARG  31  11.465   3.474  -8.107
  237   HH22  ARG  31          HH12      ARG  31  10.907   3.463  -9.747
  238    H    ASP  32           H        ASP  32  11.742   1.319  -3.198
  239    HA   ASP  32           HA       ASP  32  11.019   3.293  -1.066
  240    HB2  ASP  32           HB3      ASP  32  13.240   3.148  -0.263
  241    HB3  ASP  32           HB2      ASP  32  12.817   1.479  -0.645
  242    H    SER  33           H        SER  33  11.242   3.196  -4.275
  243    HA   SER  33           HA       SER  33  13.087   5.391  -4.799
  244    HB2  SER  33           HB3      SER  33  11.079   5.072  -6.850
  245    HB3  SER  33           HB2      SER  33  12.802   4.720  -6.931
  246    HG   SER  33           HG       SER  33  12.326   2.714  -5.901
  247    H    GLU  34           H        GLU  34  12.404   7.546  -5.502
  248    HA   GLU  34           HA       GLU  34  10.034   8.461  -4.000
  249    HB2  GLU  34           HB3      GLU  34  10.879  10.746  -4.765
  250    HB3  GLU  34           HB2      GLU  34  11.973   9.837  -3.721
  251    HG2  GLU  34           HG3      GLU  34  13.500   9.498  -5.387
  252    HG3  GLU  34           HG2      GLU  34  12.258   9.332  -6.629
  253    H    VAL  35           H        VAL  35   8.278   9.565  -4.987
  254    HA   VAL  35           HA       VAL  35   8.162   9.498  -7.968
  255    HB   VAL  35           HB       VAL  35   6.168   8.286  -6.042
  256   HG11  VAL  35          HG11      VAL  35   4.652   9.294  -7.450
  257   HG12  VAL  35          HG12      VAL  35   5.021   7.877  -8.434
  258   HG13  VAL  35          HG13      VAL  35   5.810   9.418  -8.777
  259   HG21  VAL  35          HG21      VAL  35   7.961   6.798  -6.783
  260   HG22  VAL  35          HG22      VAL  35   7.671   7.244  -8.464
  261   HG23  VAL  35          HG23      VAL  35   6.455   6.330  -7.573
  262    H    ALA  36           H        ALA  36   7.993  11.672  -8.365
  263    HA   ALA  36           HA       ALA  36   6.520  13.437  -6.559
  264    HB1  ALA  36           HB1      ALA  36   8.593  14.046  -7.962
  265    HB2  ALA  36           HB2      ALA  36   7.269  15.211  -7.948
  266    HB3  ALA  36           HB3      ALA  36   7.487  14.140  -9.332
  267    H    GLU  37           H        GLU  37   5.922  11.840  -9.653
  268    HA   GLU  37           HA       GLU  37   3.703  13.276 -10.584
  269    HB2  GLU  37           HB3      GLU  37   4.767  11.267 -11.696
  270    HB3  GLU  37           HB2      GLU  37   3.891  10.250 -10.553
  271    HG2  GLU  37           HG3      GLU  37   2.565  10.373 -12.563
  272    HG3  GLU  37           HG2      GLU  37   1.758  11.359 -11.342
  273    H    ALA  38           H        ALA  38   3.963  11.082  -7.869
  274    HA   ALA  38           HA       ALA  38   1.100  11.640  -7.192
  275    HB1  ALA  38           HB1      ALA  38   2.211   9.158  -7.709
  276    HB2  ALA  38           HB2      ALA  38   0.736   9.439  -6.785
  277    HB3  ALA  38           HB3      ALA  38   2.279   9.261  -5.950
  278    H    SER  39           H        SER  39   4.213  12.326  -6.382
  279    HA   SER  39           HA       SER  39   5.177  13.241  -4.460
  280    HB2  SER  39           HB3      SER  39   2.494  13.364  -3.134
  281    HB3  SER  39           HB2      SER  39   3.801  14.542  -3.112
  282    HG   SER  39           HG       SER  39   1.710  14.275  -4.834
  283    H    GLY  40           H        GLY  40   5.118  10.435  -4.649
  284    HA2  GLY  40           HA3      GLY  40   5.299   9.739  -1.799
  285    HA3  GLY  40           HA2      GLY  40   4.087   8.832  -2.705
  286    H    TYR  41           H        TYR  41   5.190   6.844  -2.551
  287    HA   TYR  41           HA       TYR  41   7.769   6.681  -4.059
  288    HB2  TYR  41           HB3      TYR  41   6.794   4.872  -1.832
  289    HB3  TYR  41           HB2      TYR  41   8.360   4.789  -2.639
  290    HD1  TYR  41           HD1      TYR  41   6.181   7.109  -0.665
  291    HD2  TYR  41           HD2      TYR  41  10.170   6.051  -1.841
  292    HE1  TYR  41           HE1      TYR  41   7.091   8.802   0.900
  293    HE2  TYR  41           HE2      TYR  41  11.084   7.739  -0.269
  294    HH   TYR  41           HH       TYR  41   8.943   9.925   1.519
  295    H    ASP  42           H        ASP  42   8.014   4.819  -5.426
  296    HA   ASP  42           HA       ASP  42   5.687   4.104  -6.886
  297    HB2  ASP  42           HB3      ASP  42   8.046   4.027  -7.735
  298    HB3  ASP  42           HB2      ASP  42   8.288   2.557  -6.796
  299    H    LEU  43           H        LEU  43   4.872   1.909  -7.227
  300    HA   LEU  43           HA       LEU  43   4.918   0.195  -4.773
  301    HB2  LEU  43           HB3      LEU  43   2.815   1.561  -4.806
  302    HB3  LEU  43           HB2      LEU  43   2.438   0.882  -6.385
  303    HG   LEU  43           HG       LEU  43   2.392  -1.386  -5.413
  304   HD11  LEU  43          HD11      LEU  43   3.770  -1.515  -3.576
  305   HD12  LEU  43          HD12      LEU  43   2.242  -1.227  -2.743
  306   HD13  LEU  43          HD13      LEU  43   3.361   0.109  -3.020
  307   HD21  LEU  43          HD21      LEU  43   0.683   0.789  -4.230
  308   HD22  LEU  43          HD22      LEU  43   0.427  -0.897  -3.780
  309   HD23  LEU  43          HD23      LEU  43   0.279  -0.402  -5.462
  310    H    GLY  44           H        GLY  44   6.273  -1.345  -5.865
  311    HA2  GLY  44           HA3      GLY  44   5.337  -2.455  -8.425
  312    HA3  GLY  44           HA2      GLY  44   6.797  -2.936  -7.562
  313    H    GLY  45           H        GLY  45   5.833  -5.151  -8.176
  314    HA2  GLY  45           HA3      GLY  45   5.222  -7.113  -6.905
  315    HA3  GLY  45           HA2      GLY  45   4.215  -6.106  -5.877
  316    H    ASP  46           H        ASP  46   2.282  -7.196  -6.173
  317    HA   ASP  46           HA       ASP  46   1.254  -7.488  -8.942
  318    HB2  ASP  46           HB3      ASP  46   1.297  -9.417  -7.153
  319    HB3  ASP  46           HB2      ASP  46  -0.128  -8.600  -6.514
  320    H    THR  47           H        THR  47   0.801  -5.241  -9.107
  321    HA   THR  47           HA       THR  47  -1.306  -4.149  -7.309
  322    HB   THR  47           HB       THR  47  -0.876  -2.015  -8.339
  323    HG1  THR  47           HG1      THR  47   0.141  -1.818 -10.244
  324   HG21  THR  47          HG21      THR  47   1.923  -2.924  -8.466
  325   HG22  THR  47          HG22      THR  47   1.070  -3.402  -7.000
  326   HG23  THR  47          HG23      THR  47   1.183  -1.699  -7.438
  327    H    ALA  48           H        ALA  48  -0.746  -5.647 -10.292
  328    HA   ALA  48           HA       ALA  48  -3.160  -4.746 -11.662
  329    HB1  ALA  48           HB1      ALA  48  -1.530  -7.234 -12.236
  330    HB2  ALA  48           HB2      ALA  48  -1.082  -5.626 -12.807
  331    HB3  ALA  48           HB3      ALA  48  -2.586  -6.367 -13.351
  332    H    CYS  49           H        CYS  49  -3.095  -6.284  -8.906
  333    HA   CYS  49           HA       CYS  49  -5.238  -8.253  -9.630
  334    HB2  CYS  49           HB3      CYS  49  -4.490  -9.705  -7.953
  335    HB3  CYS  49           HB2      CYS  49  -2.969  -9.046  -8.552
  336    H    LEU  50           H        LEU  50  -4.242  -5.624  -7.539
  337    HA   LEU  50           HA       LEU  50  -6.385  -5.764  -5.655
  338    HB2  LEU  50           HB3      LEU  50  -4.963  -3.281  -6.653
  339    HB3  LEU  50           HB2      LEU  50  -5.847  -3.437  -5.143
  340    HG   LEU  50           HG       LEU  50  -3.524  -5.252  -5.785
  341   HD11  LEU  50          HD11      LEU  50  -2.751  -2.911  -5.969
  342   HD12  LEU  50          HD12      LEU  50  -2.067  -3.708  -4.554
  343   HD13  LEU  50          HD13      LEU  50  -3.406  -2.575  -4.370
  344   HD21  LEU  50          HD21      LEU  50  -3.396  -5.278  -3.270
  345   HD22  LEU  50          HD22      LEU  50  -4.885  -5.958  -3.914
  346   HD23  LEU  50          HD23      LEU  50  -4.883  -4.334  -3.232
  347    H    THR  51           H        THR  51  -6.663  -5.450  -8.913
  348    HA   THR  51           HA       THR  51  -8.543  -3.307  -9.202
  349    HB   THR  51           HB       THR  51  -9.271  -5.101 -11.151
  350    HG1  THR  51           HG1      THR  51  -7.497  -6.406 -10.079
  351   HG21  THR  51          HG21      THR  51  -6.967  -3.141 -11.042
  352   HG22  THR  51          HG22      THR  51  -8.609  -2.835 -11.611
  353   HG23  THR  51          HG23      THR  51  -7.537  -3.889 -12.535
  354    H    ARG  52           H        ARG  52  -8.879  -5.783  -7.178
  355    HA   ARG  52           HA       ARG  52 -11.788  -6.210  -7.745
  356    HB2  ARG  52           HB3      ARG  52 -11.575  -8.166  -6.202
  357    HB3  ARG  52           HB2      ARG  52 -10.552  -8.303  -7.632
  358    HG2  ARG  52           HG3      ARG  52  -8.615  -7.528  -6.358
  359    HG3  ARG  52           HG2      ARG  52  -9.619  -7.296  -4.930
  360    HD2  ARG  52           HD3      ARG  52  -8.388  -9.447  -4.840
  361    HD3  ARG  52           HD2      ARG  52 -10.134  -9.693  -4.872
  362    HE   ARG  52           HE       ARG  52  -8.969  -9.736  -7.534
  363   HH11  ARG  52          HH22      ARG  52  -9.572 -11.498  -4.634
  364   HH12  ARG  52          HH21      ARG  52  -9.562 -13.045  -5.416
  365   HH21  ARG  52          HH11      ARG  52  -8.953 -11.744  -8.571
  366   HH22  ARG  52          HH12      ARG  52  -9.211 -13.184  -7.643
  367    H    TRP  53           H        TRP  53  -9.506  -4.815  -5.546
  368    HA   TRP  53           HA       TRP  53 -11.705  -4.291  -3.572
  369    HB2  TRP  53           HB3      TRP  53  -8.714  -4.110  -3.110
  370    HB3  TRP  53           HB2      TRP  53  -9.982  -4.002  -1.892
  371    HD1  TRP  53           HD1      TRP  53 -11.770  -6.446  -2.765
  372    HE1  TRP  53           HE1      TRP  53 -10.910  -8.849  -2.446
  373    HE3  TRP  53           HE3      TRP  53  -6.742  -5.557  -2.484
  374    HZ2  TRP  53           HZ2      TRP  53  -8.421 -10.220  -2.101
  375    HZ3  TRP  53           HZ3      TRP  53  -5.156  -7.436  -2.149
  376    HH2  TRP  53           HH2      TRP  53  -5.987  -9.759  -1.959
  377    H    LEU  54           H        LEU  54  -9.168  -2.926  -5.555
  378    HA   LEU  54           HA       LEU  54  -9.954  -0.183  -4.713
  379    HB2  LEU  54           HB3      LEU  54  -7.543  -1.306  -6.153
  380    HB3  LEU  54           HB2      LEU  54  -7.814   0.423  -5.989
  381    HG   LEU  54           HG       LEU  54  -7.711  -1.493  -3.637
  382   HD11  LEU  54          HD11      LEU  54  -5.557   0.483  -4.311
  383   HD12  LEU  54          HD12      LEU  54  -5.539  -1.121  -5.044
  384   HD13  LEU  54          HD13      LEU  54  -5.466  -0.952  -3.291
  385   HD21  LEU  54          HD21      LEU  54  -8.541   0.279  -2.519
  386   HD22  LEU  54          HD22      LEU  54  -8.413   1.312  -3.940
  387   HD23  LEU  54          HD23      LEU  54  -7.029   1.117  -2.873
  388    HA   PRO  55           HA       PRO  55 -12.081   0.317  -8.555
  389    HB2  PRO  55           HB2      PRO  55 -11.755   2.981  -9.082
  390    HB3  PRO  55           HB3      PRO  55 -12.846   2.349  -7.834
  391    HG2  PRO  55           HG3      PRO  55 -10.155   3.564  -7.558
  392    HG3  PRO  55           HG2      PRO  55 -11.564   3.675  -6.490
  393    HD2  PRO  55           HD3      PRO  55  -9.389   2.048  -6.017
  394    HD3  PRO  55           HD2      PRO  55 -11.003   1.766  -5.348
  395    H    SER  56           H        SER  56  -8.687   0.898  -8.472
  396    HA   SER  56           HA       SER  56  -8.586   0.476 -11.402
  397    HB2  SER  56           HB3      SER  56  -7.245   2.813 -10.016
  398    HB3  SER  56           HB2      SER  56  -6.969   2.342 -11.691
  399    HG   SER  56           HG       SER  56  -8.656   4.021 -11.133
  400    H    GLU  57           H        GLU  57  -5.665   1.661 -10.529
  401    HA   GLU  57           HA       GLU  57  -4.651  -0.835  -9.299
  402    HB2  GLU  57           HB3      GLU  57  -4.451  -1.355 -11.636
  403    HB3  GLU  57           HB2      GLU  57  -3.784   0.237 -11.994
  404    HG2  GLU  57           HG3      GLU  57  -1.732  -0.252 -10.933
  405    HG3  GLU  57           HG2      GLU  57  -2.411  -1.628 -10.062
  406    HA   PRO  58           HA       PRO  58  -2.454   2.724  -7.513
  407    HB2  PRO  58           HB2      PRO  58  -1.228   1.381  -5.460
  408    HB3  PRO  58           HB3      PRO  58  -2.869   2.024  -5.401
  409    HG2  PRO  58           HG3      PRO  58  -1.952  -0.744  -5.723
  410    HG3  PRO  58           HG2      PRO  58  -3.445  -0.116  -5.044
  411    HD2  PRO  58           HD3      PRO  58  -3.169  -1.267  -7.576
  412    HD3  PRO  58           HD2      PRO  58  -4.547  -0.289  -7.029
  413    H    ARG  59           H        ARG  59  -0.751   3.342  -8.730
  414    HA   ARG  59           HA       ARG  59   1.557   1.510  -9.068
  415    HB2  ARG  59           HB3      ARG  59   0.344   3.589 -10.645
  416    HB3  ARG  59           HB2      ARG  59   2.028   4.008 -10.334
  417    HG2  ARG  59           HG3      ARG  59   1.116   1.305 -11.364
  418    HG3  ARG  59           HG2      ARG  59   1.698   2.609 -12.399
  419    HD2  ARG  59           HD3      ARG  59   3.560   2.242 -10.243
  420    HD3  ARG  59           HD2      ARG  59   3.247   0.679 -11.000
  421    HE   ARG  59           HE       ARG  59   4.762   2.814 -12.179
  422   HH11  ARG  59          HH22      ARG  59   2.380   0.408 -12.828
  423   HH12  ARG  59          HH21      ARG  59   2.811   0.242 -14.498
  424   HH21  ARG  59          HH11      ARG  59   5.338   2.612 -14.356
  425   HH22  ARG  59          HH12      ARG  59   4.485   1.490 -15.363
  426    H    ALA  60           H        ALA  60   0.529   3.847  -6.916
  427    HA   ALA  60           HA       ALA  60   3.276   4.183  -5.901
  428    HB1  ALA  60           HB1      ALA  60   2.899   6.690  -5.689
  429    HB2  ALA  60           HB2      ALA  60   1.539   6.495  -6.794
  430    HB3  ALA  60           HB3      ALA  60   3.173   6.105  -7.330
  431    H    TRP  61           H        TRP  61   3.258   5.170  -3.720
  432    HA   TRP  61           HA       TRP  61   0.633   5.215  -2.340
  433    HB2  TRP  61           HB3      TRP  61   1.455   3.703  -0.557
  434    HB3  TRP  61           HB2      TRP  61   1.381   2.881  -2.112
  435    HD1  TRP  61           HD1      TRP  61   3.894   3.174  -3.526
  436    HE1  TRP  61           HE1      TRP  61   6.225   2.661  -2.559
  437    HE3  TRP  61           HE3      TRP  61   2.850   3.440   1.458
  438    HZ2  TRP  61           HZ2      TRP  61   7.482   2.388  -0.003
  439    HZ3  TRP  61           HZ3      TRP  61   4.627   3.041   3.139
  440    HH2  TRP  61           HH2      TRP  61   6.940   2.516   2.415
  441    H    ARG  62           H        ARG  62   0.804   6.362  -0.263
  442    HA   ARG  62           HA       ARG  62   3.380   7.836   0.114
  443    HB2  ARG  62           HB3      ARG  62   2.090   9.433  -1.009
  444    HB3  ARG  62           HB2      ARG  62   0.603   8.931  -0.205
  445    HG2  ARG  62           HG3      ARG  62   1.139  10.035   1.776
  446    HG3  ARG  62           HG2      ARG  62   2.871  10.003   1.442
  447    HD2  ARG  62           HD3      ARG  62   2.712  11.751  -0.150
  448    HD3  ARG  62           HD2      ARG  62   0.964  11.574  -0.291
  449    HE   ARG  62           HE       ARG  62   1.648  12.275   2.407
  450   HH11  ARG  62          HH22      ARG  62   1.479  13.480  -0.818
  451   HH12  ARG  62          HH21      ARG  62   1.189  15.116  -0.334
  452   HH21  ARG  62          HH11      ARG  62   1.270  14.407   3.059
  453   HH22  ARG  62          HH12      ARG  62   1.073  15.642   1.862
  454    HA   PRO  63           HA       PRO  63   2.265   6.126   4.234
  455    HB2  PRO  63           HB2      PRO  63   4.758   7.311   5.173
  456    HB3  PRO  63           HB3      PRO  63   4.282   5.608   5.115
  457    HG2  PRO  63           HG3      PRO  63   6.156   6.823   3.494
  458    HG3  PRO  63           HG2      PRO  63   5.376   5.268   3.196
  459    HD2  PRO  63           HD3      PRO  63   4.965   7.831   1.832
  460    HD3  PRO  63           HD2      PRO  63   4.491   6.196   1.324
  461    H    THR  64           H        THR  64   0.953   7.259   5.621
  462    HA   THR  64           HA       THR  64   1.339  10.200   5.838
  463    HB   THR  64           HB       THR  64  -0.960   9.676   7.210
  464    HG1  THR  64           HG1      THR  64  -0.474   7.396   6.404
  465   HG21  THR  64          HG21      THR  64  -0.426  10.162   4.286
  466   HG22  THR  64          HG22      THR  64  -0.988  11.303   5.508
  467   HG23  THR  64          HG23      THR  64  -2.077  10.057   4.899
  468    HA   PRO  65           HA       PRO  65   2.953   9.887   9.941
  469    HB2  PRO  65           HB2      PRO  65   1.695  11.988  11.214
  470    HB3  PRO  65           HB3      PRO  65   3.069  12.169  10.111
  471    HG2  PRO  65           HG3      PRO  65   0.171  12.589   9.609
  472    HG3  PRO  65           HG2      PRO  65   1.569  13.492   9.001
  473    HD2  PRO  65           HD3      PRO  65   0.219  11.673   7.480
  474    HD3  PRO  65           HD2      PRO  65   1.953  12.002   7.271
  475    H    ALA  66           H        ALA  66   0.374   8.395   9.346
  476    HA   ALA  66           HA       ALA  66  -0.224   7.678  12.105
  477    HB1  ALA  66           HB1      ALA  66  -2.404   8.475  12.313
  478    HB2  ALA  66           HB2      ALA  66  -2.618   8.638  10.571
  479    HB3  ALA  66           HB3      ALA  66  -1.634   9.806  11.450
  480    H    GLY  67           H        GLY  67  -0.370   7.172   8.724
  481    HA2  GLY  67           HA3      GLY  67  -0.884   4.351   9.064
  482    HA3  GLY  67           HA2      GLY  67  -2.284   5.169   8.379
  483    H    ILE  68           H        ILE  68  -2.142   4.299   6.291
  484    HA   ILE  68           HA       ILE  68   0.113   5.333   4.654
  485    HB   ILE  68           HB       ILE  68  -0.875   2.490   4.342
  486   HG12  ILE  68          HG13      ILE  68   1.347   3.602   6.058
  487   HG13  ILE  68          HG12      ILE  68   0.111   2.424   6.491
  488   HG21  ILE  68          HG21      ILE  68   0.943   2.238   2.871
  489   HG22  ILE  68          HG22      ILE  68   1.785   3.643   3.526
  490   HG23  ILE  68          HG23      ILE  68   0.364   3.863   2.506
  491   HD11  ILE  68          HD11      ILE  68   2.001   1.075   6.173
  492   HD12  ILE  68          HD12      ILE  68   2.575   2.037   4.812
  493   HD13  ILE  68          HD13      ILE  68   1.187   0.966   4.613
  494    H    ALA  69           H        ALA  69  -0.479   5.735   2.479
  495    HA   ALA  69           HA       ALA  69  -3.371   5.322   1.814
  496    HB1  ALA  69           HB1      ALA  69  -3.666   7.527   1.320
  497    HB2  ALA  69           HB2      ALA  69  -2.038   7.696   0.661
  498    HB3  ALA  69           HB3      ALA  69  -2.296   7.761   2.404
  499    H    LEU  70           H        LEU  70  -3.804   4.849  -0.372
  500    HA   LEU  70           HA       LEU  70  -1.396   4.160  -2.012
  501    HB2  LEU  70           HB3      LEU  70  -4.185   3.064  -1.873
  502    HB3  LEU  70           HB2      LEU  70  -3.132   2.713  -3.231
  503    HG   LEU  70           HG       LEU  70  -1.925   2.342  -0.554
  504   HD11  LEU  70          HD11      LEU  70  -4.156   1.466  -0.105
  505   HD12  LEU  70          HD12      LEU  70  -3.032   0.119  -0.284
  506   HD13  LEU  70          HD13      LEU  70  -4.125   0.536  -1.604
  507   HD21  LEU  70          HD21      LEU  70  -2.062   0.612  -3.046
  508   HD22  LEU  70          HD22      LEU  70  -0.983   0.369  -1.673
  509   HD23  LEU  70          HD23      LEU  70  -0.794   1.788  -2.703
  510    H    LEU  71           H        LEU  71  -1.109   5.266  -3.942
  511    HA   LEU  71           HA       LEU  71  -3.303   7.109  -4.778
  512    HB2  LEU  71           HB3      LEU  71  -0.345   7.174  -5.430
  513    HB3  LEU  71           HB2      LEU  71  -1.529   8.390  -5.902
  514    HG   LEU  71           HG       LEU  71  -1.252   7.675  -2.995
  515   HD11  LEU  71          HD11      LEU  71   0.494   9.368  -2.728
  516   HD12  LEU  71          HD12      LEU  71   0.514   9.646  -4.467
  517   HD13  LEU  71          HD13      LEU  71   1.054   8.099  -3.817
  518   HD21  LEU  71          HD21      LEU  71  -1.892  10.062  -2.754
  519   HD22  LEU  71          HD22      LEU  71  -3.070   9.170  -3.715
  520   HD23  LEU  71          HD23      LEU  71  -1.903  10.226  -4.509
  521    H    GLU  72           H        GLU  72  -3.485   7.455  -7.180
  522    HA   GLU  72           HA       GLU  72  -3.182   4.845  -8.598
  523    HB2  GLU  72           HB3      GLU  72  -4.762   6.275 -10.245
  524    HB3  GLU  72           HB2      GLU  72  -5.397   5.347  -8.891
  525    HG2  GLU  72           HG3      GLU  72  -5.586   7.270  -7.514
  526    HG3  GLU  72           HG2      GLU  72  -4.534   8.219  -8.563
  527    H    ARG  73           H        ARG  73  -1.216   7.297  -8.257
  528    HA   ARG  73           HA       ARG  73   0.586   7.986  -9.610
  529    HB2  ARG  73           HB3      ARG  73  -0.234   5.816 -11.023
  530    HB3  ARG  73           HB2      ARG  73  -0.621   7.097 -12.170
  531    HG2  ARG  73           HG3      ARG  73   1.760   7.985 -11.662
  532    HG3  ARG  73           HG2      ARG  73   2.058   6.386 -10.983
  533    HD2  ARG  73           HD3      ARG  73   2.645   5.897 -13.141
  534    HD3  ARG  73           HD2      ARG  73   0.904   5.675 -13.325
  535    HE   ARG  73           HE       ARG  73   1.344   8.391 -13.808
  536   HH11  ARG  73          HH22      ARG  73   2.443   5.357 -15.022
  537   HH12  ARG  73          HH21      ARG  73   2.697   5.943 -16.633
  538   HH21  ARG  73          HH11      ARG  73   1.672   9.174 -15.903
  539   HH22  ARG  73          HH12      ARG  73   2.262   8.103 -17.131
  540    H    GLY  74           H        GLY  74  -1.858   9.462  -9.017
  541    HA2  GLY  74           HA3      GLY  74  -1.566  11.539 -11.097
  542    HA3  GLY  74           HA2      GLY  74  -3.192  10.896 -10.856
  543    H    GLY  75           H        GLY  75  -1.879  10.593  -7.914
  544    HA2  GLY  75           HA3      GLY  75  -1.530  12.175  -6.105
  545    HA3  GLY  75           HA2      GLY  75  -2.342  13.408  -7.066
  546    H    LEU  76           H        LEU  76  -4.246  10.857  -7.596
  547    HA   LEU  76           HA       LEU  76  -6.186  11.714  -5.561
  548    HB2  LEU  76           HB3      LEU  76  -6.290  10.441  -8.138
  549    HB3  LEU  76           HB2      LEU  76  -7.127   9.425  -6.963
  550    HG   LEU  76           HG       LEU  76  -7.614  12.398  -7.295
  551   HD11  LEU  76          HD11      LEU  76  -9.896  11.348  -8.141
  552   HD12  LEU  76          HD12      LEU  76  -8.863   9.976  -8.545
  553   HD13  LEU  76          HD13      LEU  76  -8.544  11.559  -9.252
  554   HD21  LEU  76          HD21      LEU  76  -8.833  12.213  -5.408
  555   HD22  LEU  76          HD22      LEU  76  -8.236  10.563  -5.225
  556   HD23  LEU  76          HD23      LEU  76  -9.742  10.864  -6.093
  557    H    THR  77           H        THR  77  -6.930  10.393  -3.852
  558    HA   THR  77           HA       THR  77  -5.102   8.154  -3.145
  559    HB   THR  77           HB       THR  77  -7.158   8.833  -1.187
  560    HG1  THR  77           HG1      THR  77  -7.009  10.906  -1.293
  561   HG21  THR  77          HG21      THR  77  -5.277   8.880   0.292
  562   HG22  THR  77          HG22      THR  77  -4.154   9.139  -1.043
  563   HG23  THR  77          HG23      THR  77  -4.968   7.584  -0.865
  564    H    LEU  78           H        LEU  78  -5.774   6.099  -3.499
  565    HA   LEU  78           HA       LEU  78  -8.586   5.607  -4.212
  566    HB2  LEU  78           HB3      LEU  78  -6.388   3.545  -3.921
  567    HB3  LEU  78           HB2      LEU  78  -7.895   3.381  -4.801
  568    HG   LEU  78           HG       LEU  78  -5.983   5.561  -5.585
  569   HD11  LEU  78          HD11      LEU  78  -5.625   2.624  -5.910
  570   HD12  LEU  78          HD12      LEU  78  -4.416   3.907  -5.867
  571   HD13  LEU  78          HD13      LEU  78  -5.339   3.613  -7.339
  572   HD21  LEU  78          HD21      LEU  78  -8.467   4.949  -6.440
  573   HD22  LEU  78          HD22      LEU  78  -7.541   3.875  -7.485
  574   HD23  LEU  78          HD23      LEU  78  -7.241   5.610  -7.516
  575    H    MET  79           H        MET  79  -6.332   4.703  -1.596
  576    HA   MET  79           HA       MET  79  -8.672   4.218   0.141
  577    HB2  MET  79           HB3      MET  79  -8.110   2.050  -1.037
  578    HB3  MET  79           HB2      MET  79  -6.567   2.069  -0.194
  579    HG2  MET  79           HG3      MET  79  -8.061   0.735   1.136
  580    HG3  MET  79           HG2      MET  79  -7.874   2.276   1.973
  581    HE1  MET  79           HE1      MET  79 -11.438   0.533  -0.223
  582    HE2  MET  79           HE2      MET  79 -10.559  -0.281   1.079
  583    HE3  MET  79           HE3      MET  79  -9.729   0.150  -0.412
  584    H    LEU  80           H        LEU  80  -8.229   4.642   2.273
  585    HA   LEU  80           HA       LEU  80  -5.447   5.509   2.916
  586    HB2  LEU  80           HB3      LEU  80  -7.044   7.264   3.299
  587    HB3  LEU  80           HB2      LEU  80  -8.146   6.167   4.127
  588    HG   LEU  80           HG       LEU  80  -6.656   5.965   6.011
  589   HD11  LEU  80          HD11      LEU  80  -4.487   7.392   5.916
  590   HD12  LEU  80          HD12      LEU  80  -4.703   7.338   4.168
  591   HD13  LEU  80          HD13      LEU  80  -4.495   5.842   5.077
  592   HD21  LEU  80          HD21      LEU  80  -6.791   8.842   5.058
  593   HD22  LEU  80          HD22      LEU  80  -6.448   8.343   6.714
  594   HD23  LEU  80          HD23      LEU  80  -8.020   7.997   5.997
  595    H    LEU  81           H        LEU  81  -4.450   3.610   3.600
  596    HA   LEU  81           HA       LEU  81  -5.832   1.705   5.336
  597    HB2  LEU  81           HB3      LEU  81  -3.242   1.872   3.943
  598    HB3  LEU  81           HB2      LEU  81  -3.149   1.093   5.521
  599    HG   LEU  81           HG       LEU  81  -4.984  -0.431   4.881
  600   HD11  LEU  81          HD11      LEU  81  -6.348   0.599   3.330
  601   HD12  LEU  81          HD12      LEU  81  -5.349  -0.354   2.233
  602   HD13  LEU  81          HD13      LEU  81  -4.996   1.355   2.486
  603   HD21  LEU  81          HD21      LEU  81  -2.569  -0.973   4.388
  604   HD22  LEU  81          HD22      LEU  81  -2.827  -0.373   2.750
  605   HD23  LEU  81          HD23      LEU  81  -3.717  -1.784   3.324
  606    H    GLY  82           H        GLY  82  -5.974   1.889   7.526
  607    HA2  GLY  82           HA3      GLY  82  -4.208   3.888   8.877
  608    HA3  GLY  82           HA2      GLY  82  -5.778   3.353   9.477
  609    H    ARG  83           H        ARG  83  -2.909   3.238  10.595
  610    HA   ARG  83           HA       ARG  83  -2.289   0.407  10.802
  611    HB2  ARG  83           HB3      ARG  83  -0.626   2.291  11.113
  612    HB3  ARG  83           HB2      ARG  83  -1.408   2.640  12.652
  613    HG2  ARG  83           HG3      ARG  83  -0.911  -0.164  12.583
  614    HG3  ARG  83           HG2      ARG  83   0.571   0.643  12.070
  615    HD2  ARG  83           HD3      ARG  83  -0.999   1.344  14.569
  616    HD3  ARG  83           HD2      ARG  83   0.459   0.353  14.540
  617    HE   ARG  83           HE       ARG  83   0.768   2.995  13.302
  618   HH11  ARG  83          HH22      ARG  83   0.943   1.034  16.135
  619   HH12  ARG  83          HH21      ARG  83   2.078   2.066  16.939
  620   HH21  ARG  83          HH11      ARG  83   2.245   4.352  14.337
  621   HH22  ARG  83          HH12      ARG  83   2.815   3.944  15.922
  622    H    GLN  84           H        GLN  84  -3.260  -1.053  12.208
  623    HA   GLN  84           HA       GLN  84  -5.192   0.030  14.170
  624    HB2  GLN  84           HB3      GLN  84  -4.932  -2.419  12.625
  625    HB3  GLN  84           HB2      GLN  84  -5.171  -2.771  14.335
  626    HG2  GLN  84           HG3      GLN  84  -6.908  -0.894  12.704
  627    HG3  GLN  84           HG2      GLN  84  -7.321  -2.559  13.096
  628   HE21  GLN  84          HE22      GLN  84  -7.171  -3.039  15.604
  629   HE22  GLN  84          HE21      GLN  84  -7.807  -1.834  16.618
  630    H    GLY  85           H        GLY  85  -2.109  -1.594  13.970
  631    HA2  GLY  85           HA3      GLY  85  -1.235  -0.902  16.553
  632    HA3  GLY  85           HA2      GLY  85  -1.950  -2.512  16.687
  633    H    GLU  86           H        GLU  86   0.905  -0.907  16.064
  634    HA   GLU  86           HA       GLU  86   2.994  -1.640  15.266
  635    HB2  GLU  86           HB3      GLU  86   1.972  -3.726  16.662
  636    HB3  GLU  86           HB2      GLU  86   2.096  -4.467  15.066
  637    HG2  GLU  86           HG3      GLU  86   4.489  -3.557  14.991
  638    HG3  GLU  86           HG2      GLU  86   4.305  -3.225  16.715
  639    H    GLY  87           H        GLY  87   3.320  -4.023  13.516
  640    HA2  GLY  87           HA3      GLY  87   2.686  -2.717  10.994
  641    HA3  GLY  87           HA2      GLY  87   3.446  -4.299  11.171
  642    H    ASP  88           H        ASP  88   0.298  -2.695  11.588
  643    HA   ASP  88           HA       ASP  88  -1.013  -4.933  10.204
  644    HB2  ASP  88           HB3      ASP  88  -0.865  -4.970  13.013
  645    HB3  ASP  88           HB2      ASP  88  -2.493  -4.400  12.644
  646    H    TYR  89           H        TYR  89  -1.872  -3.557   8.681
  647    HA   TYR  89           HA       TYR  89  -3.462  -1.226   9.651
  648    HB2  TYR  89           HB3      TYR  89  -2.413  -1.754   6.879
  649    HB3  TYR  89           HB2      TYR  89  -3.174  -0.283   7.420
  650    HD1  TYR  89           HD1      TYR  89  -0.265  -2.523   8.169
  651    HD2  TYR  89           HD2      TYR  89  -1.858   1.466   8.265
  652    HE1  TYR  89           HE1      TYR  89   1.933  -1.660   8.917
  653    HE2  TYR  89           HE2      TYR  89   0.347   2.328   9.004
  654    HH   TYR  89           HH       TYR  89   3.146   0.688   8.729
  655    H    ARG  90           H        ARG  90  -5.628  -1.115   9.126
  656    HA   ARG  90           HA       ARG  90  -6.718  -3.155   7.268
  657    HB2  ARG  90           HB3      ARG  90  -8.153  -2.582   9.847
  658    HB3  ARG  90           HB2      ARG  90  -8.274  -3.996   8.802
  659    HG2  ARG  90           HG3      ARG  90  -6.018  -4.707   9.478
  660    HG3  ARG  90           HG2      ARG  90  -5.862  -3.280  10.494
  661    HD2  ARG  90           HD3      ARG  90  -6.547  -4.901  12.032
  662    HD3  ARG  90           HD2      ARG  90  -8.069  -4.124  11.600
  663    HE   ARG  90           HE       ARG  90  -7.938  -6.176   9.792
  664   HH11  ARG  90          HH22      ARG  90  -7.475  -5.925  13.201
  665   HH12  ARG  90          HH21      ARG  90  -8.020  -7.536  13.527
  666   HH21  ARG  90          HH11      ARG  90  -8.656  -8.282  10.202
  667   HH22  ARG  90          HH12      ARG  90  -8.689  -8.868  11.831
  668    H    VAL  91           H        VAL  91  -8.748  -2.511   6.355
  669    HA   VAL  91           HA       VAL  91  -9.667   0.245   6.991
  670    HB   VAL  91           HB       VAL  91  -8.002   0.385   5.119
  671   HG11  VAL  91          HG11      VAL  91  -8.198  -0.835   3.189
  672   HG12  VAL  91          HG12      VAL  91  -9.957  -0.892   3.276
  673   HG13  VAL  91          HG13      VAL  91  -8.988  -1.967   4.285
  674   HG21  VAL  91          HG21      VAL  91 -10.829   0.924   4.170
  675   HG22  VAL  91          HG22      VAL  91  -9.364   1.808   3.742
  676   HG23  VAL  91          HG23      VAL  91 -10.016   1.922   5.376
  677    H    GLN  92           H        GLN  92 -11.759  -0.174   7.548
  678    HA   GLN  92           HA       GLN  92 -13.320  -2.370   6.723
  679    HB2  GLN  92           HB3      GLN  92 -14.315   0.430   7.354
  680    HB3  GLN  92           HB2      GLN  92 -15.272  -1.051   7.414
  681    HG2  GLN  92           HG3      GLN  92 -14.677  -1.067   9.612
  682    HG3  GLN  92           HG2      GLN  92 -13.164  -1.739   9.004
  683   HE21  GLN  92          HE22      GLN  92 -11.449  -0.684  10.012
  684   HE22  GLN  92          HE21      GLN  92 -11.371   0.986  10.309
  685    H    LYS  93           H        LYS  93 -14.101  -2.896   4.733
  686    HA   LYS  93           HA       LYS  93 -14.074  -0.798   2.627
  687    HB2  LYS  93           HB3      LYS  93 -14.345  -2.687   1.043
  688    HB3  LYS  93           HB2      LYS  93 -12.916  -2.870   2.049
  689    HG2  LYS  93           HG3      LYS  93 -15.547  -4.146   2.832
  690    HG3  LYS  93           HG2      LYS  93 -14.459  -4.931   1.703
  691    HD2  LYS  93           HD3      LYS  93 -13.164  -5.663   3.374
  692    HD3  LYS  93           HD2      LYS  93 -12.953  -4.042   3.998
  693    HE2  LYS  93           HE3      LYS  93 -15.210  -4.253   5.115
  694    HE3  LYS  93           HE2      LYS  93 -15.216  -5.948   4.627
  695    HZ1  LYS  93           HZ1      LYS  93 -14.328  -5.371   6.928
  696    HZ2  LYS  93           HZ2      LYS  93 -12.952  -4.787   6.127
  697    HZ3  LYS  93           HZ3      LYS  93 -13.397  -6.419   5.969
  698    H    GLY  94           H        GLY  94 -15.943  -0.583   1.192
  699    HA2  GLY  94           HA3      GLY  94 -18.441  -0.558   2.664
  700    HA3  GLY  94           HA2      GLY  94 -18.245  -0.139   0.960
  701    H    ASP  95           H        ASP  95 -18.217  -3.000   3.104
  702    HA   ASP  95           HA       ASP  95 -19.260  -5.089   2.790
  703    HB2  ASP  95           HB3      ASP  95 -20.930  -3.430   1.462
  704    HB3  ASP  95           HB2      ASP  95 -20.327  -4.382   0.104
  705    H    GLY  96           H        GLY  96 -17.506  -6.415   2.439
  706    HA2  GLY  96           HA3      GLY  96 -16.967  -7.398  -0.189
  707    HA3  GLY  96           HA2      GLY  96 -15.694  -6.268   0.264
  708    H    GLY  97           H        GLY  97 -14.702  -6.717   2.519
  709    HA2  GLY  97           HA3      GLY  97 -14.969  -9.329   3.675
  710    HA3  GLY  97           HA2      GLY  97 -13.582  -9.305   2.592
  711    H    GLN  98           H        GLN  98 -11.767  -8.006   3.163
  712    HA   GLN  98           HA       GLN  98 -11.583  -6.123   5.232
  713    HB2  GLN  98           HB3      GLN  98 -12.138  -8.379   6.576
  714    HB3  GLN  98           HB2      GLN  98 -10.426  -8.673   6.317
  715    HG2  GLN  98           HG3      GLN  98 -10.121  -6.223   7.153
  716    HG3  GLN  98           HG2      GLN  98 -11.740  -6.432   7.825
  717   HE21  GLN  98          HE22      GLN  98  -9.036  -8.802   7.558
  718   HE22  GLN  98          HE21      GLN  98  -8.960  -9.126   9.222
  719    H    LEU  99           H        LEU  99  -9.965  -5.143   4.112
  720    HA   LEU  99           HA       LEU  99  -7.773  -6.711   2.963
  721    HB2  LEU  99           HB3      LEU  99  -7.893  -3.709   3.232
  722    HB3  LEU  99           HB2      LEU  99  -7.027  -4.656   2.038
  723    HG   LEU  99           HG       LEU  99 -10.028  -4.458   2.301
  724   HD11  LEU  99          HD11      LEU  99  -8.671  -2.498   1.306
  725   HD12  LEU  99          HD12      LEU  99  -9.989  -3.144   0.329
  726   HD13  LEU  99          HD13      LEU  99  -8.321  -3.592  -0.033
  727   HD21  LEU  99          HD21      LEU  99  -8.208  -6.218   0.713
  728   HD22  LEU  99          HD22      LEU  99  -9.688  -5.650  -0.058
  729   HD23  LEU  99          HD23      LEU  99  -9.773  -6.588   1.434
  730    H    VAL 100           H        VAL 100  -5.791  -7.008   3.898
  731    HA   VAL 100           HA       VAL 100  -5.126  -5.436   6.350
  732    HB   VAL 100           HB       VAL 100  -4.969  -8.453   6.099
  733   HG11  VAL 100          HG11      VAL 100  -3.650  -6.518   7.839
  734   HG12  VAL 100          HG12      VAL 100  -3.348  -8.246   7.657
  735   HG13  VAL 100          HG13      VAL 100  -4.607  -7.683   8.755
  736   HG21  VAL 100          HG21      VAL 100  -7.235  -7.922   6.513
  737   HG22  VAL 100          HG22      VAL 100  -6.815  -6.560   7.552
  738   HG23  VAL 100          HG23      VAL 100  -6.572  -8.212   8.122
  739    H    LEU 101           H        LEU 101  -3.252  -4.419   5.738
  740    HA   LEU 101           HA       LEU 101  -1.279  -5.869   4.049
  741    HB2  LEU 101           HB3      LEU 101  -1.915  -3.461   3.566
  742    HB3  LEU 101           HB2      LEU 101  -1.176  -3.041   5.089
  743    HG   LEU 101           HG       LEU 101   0.646  -4.664   3.579
  744   HD11  LEU 101          HD11      LEU 101   1.053  -2.939   1.785
  745   HD12  LEU 101          HD12      LEU 101  -0.469  -2.176   2.248
  746   HD13  LEU 101          HD13      LEU 101  -0.466  -3.813   1.589
  747   HD21  LEU 101          HD21      LEU 101   2.124  -2.774   4.023
  748   HD22  LEU 101          HD22      LEU 101   1.154  -3.093   5.462
  749   HD23  LEU 101          HD23      LEU 101   0.743  -1.746   4.401
  750    H    ARG 102           H        ARG 102   0.252  -7.101   5.202
  751    HA   ARG 102           HA       ARG 102   1.412  -5.855   7.627
  752    HB2  ARG 102           HB3      ARG 102  -0.407  -7.400   8.359
  753    HB3  ARG 102           HB2      ARG 102   0.389  -8.710   7.487
  754    HG2  ARG 102           HG3      ARG 102   2.363  -7.469   9.122
  755    HG3  ARG 102           HG2      ARG 102   0.942  -7.737  10.129
  756    HD2  ARG 102           HD3      ARG 102   0.871 -10.104   9.311
  757    HD3  ARG 102           HD2      ARG 102   2.384  -9.812   8.455
  758    HE   ARG 102           HE       ARG 102   2.076 -10.136  11.355
  759   HH11  ARG 102          HH22      ARG 102   3.953  -8.964   8.708
  760   HH12  ARG 102          HH21      ARG 102   5.448  -9.000   9.583
  761   HH21  ARG 102          HH11      ARG 102   4.017 -10.187  12.508
  762   HH22  ARG 102          HH12      ARG 102   5.483  -9.691  11.733
  763    H    ARG 103           H        ARG 103   3.584  -6.216   7.737
  764    HA   ARG 103           HA       ARG 103   5.185  -6.895   5.613
  765    HB2  ARG 103           HB3      ARG 103   6.394  -8.024   7.989
  766    HB3  ARG 103           HB2      ARG 103   6.841  -6.566   7.102
  767    HG2  ARG 103           HG3      ARG 103   5.042  -5.323   8.280
  768    HG3  ARG 103           HG2      ARG 103   4.666  -6.776   9.206
  769    HD2  ARG 103           HD3      ARG 103   7.233  -5.172   9.248
  770    HD3  ARG 103           HD2      ARG 103   6.115  -5.452  10.583
  771    HE   ARG 103           HE       ARG 103   6.893  -7.999   9.922
  772   HH11  ARG 103          HH22      ARG 103   8.546  -5.030  10.509
  773   HH12  ARG 103          HH21      ARG 103   9.964  -5.793  11.145
  774   HH21  ARG 103          HH11      ARG 103   8.737  -9.010  10.749
  775   HH22  ARG 103          HH12      ARG 103  10.074  -8.045  11.281
  776    H    ALA 104           H        ALA 104   5.387  -8.692   4.391
  777    HA   ALA 104           HA       ALA 104   4.095 -11.140   4.838
  778    HB1  ALA 104           HB1      ALA 104   5.065 -11.767   2.879
  779    HB2  ALA 104           HB2      ALA 104   6.688 -11.394   3.458
  780    HB3  ALA 104           HB3      ALA 104   5.658 -10.107   2.829
  781    H    THR 105           H        THR 105   4.639 -13.031   5.905
  782    HA   THR 105           HA       THR 105   7.275 -13.132   7.309
  783    HB   THR 105           HB       THR 105   5.929 -14.209   9.238
  784    HG1  THR 105           HG1      THR 105   3.992 -14.228   7.861
  785   HG21  THR 105          HG21      THR 105   5.335 -11.915  10.132
  786   HG22  THR 105          HG22      THR 105   5.780 -11.265   8.554
  787   HG23  THR 105          HG23      THR 105   6.991 -12.077   9.547
  788    HA   PRO 106           HA       PRO 106   5.900 -17.083   5.077
  789    HB2  PRO 106           HB2      PRO 106   8.009 -17.171   3.312
  790    HB3  PRO 106           HB3      PRO 106   6.446 -16.413   2.949
  791    HG2  PRO 106           HG3      PRO 106   9.016 -15.159   3.754
  792    HG3  PRO 106           HG2      PRO 106   7.790 -14.594   2.609
  793    HD2  PRO 106           HD3      PRO 106   8.032 -13.590   5.143
  794    HD3  PRO 106           HD2      PRO 106   6.489 -13.636   4.261
  Start of MODEL    6
    1    H1   SER   1           H        SER   1  14.694  24.725  -6.926
    2    H2   SER   1           H2       SER   1  15.751  23.559  -6.286
    3    H3   SER   1           1HT      SER   1  14.070  23.366  -6.123
    4    HA   SER   1           HA       SER   1  15.914  24.909  -4.534
    5    HB2  SER   1           HB3      SER   1  14.542  26.576  -6.007
    6    HB3  SER   1           HB2      SER   1  13.187  26.101  -4.988
    7    HG   SER   1           HG       SER   1  15.502  27.527  -4.373
    8    H    SER   2           H        SER   2  12.632  23.626  -5.068
    9    HA   SER   2           HA       SER   2  12.315  23.143  -2.174
   10    HB2  SER   2           HB3      SER   2  10.238  23.713  -2.992
   11    HB3  SER   2           HB2      SER   2  10.560  23.025  -4.582
   12    HG   SER   2           HG       SER   2   9.436  21.403  -3.860
   13    H    LEU   3           H        LEU   3  12.675  21.177  -1.220
   14    HA   LEU   3           HA       LEU   3  13.819  19.033  -2.870
   15    HB2  LEU   3           HB3      LEU   3  13.272  19.150   0.113
   16    HB3  LEU   3           HB2      LEU   3  14.222  17.912  -0.710
   17    HG   LEU   3           HG       LEU   3  15.370  20.265  -1.607
   18   HD11  LEU   3          HD11      LEU   3  14.050  21.529   0.072
   19   HD12  LEU   3          HD12      LEU   3  15.779  21.609   0.407
   20   HD13  LEU   3          HD13      LEU   3  14.746  20.533   1.350
   21   HD21  LEU   3          HD21      LEU   3  17.169  19.650   0.108
   22   HD22  LEU   3          HD22      LEU   3  16.681  18.360  -0.992
   23   HD23  LEU   3          HD23      LEU   3  16.069  18.388   0.662
   24    H    ILE   4           H        ILE   4  12.754  17.181  -3.472
   25    HA   ILE   4           HA       ILE   4   9.872  17.017  -2.822
   26    HB   ILE   4           HB       ILE   4  11.502  15.260  -4.679
   27   HG12  ILE   4          HG13      ILE   4   9.898  17.037  -6.157
   28   HG13  ILE   4          HG12      ILE   4  10.674  18.033  -4.925
   29   HG21  ILE   4          HG21      ILE   4   8.536  15.806  -4.362
   30   HG22  ILE   4          HG22      ILE   4   9.370  14.279  -4.069
   31   HG23  ILE   4          HG23      ILE   4   9.234  14.909  -5.711
   32   HD11  ILE   4          HD11      ILE   4  12.872  16.998  -5.565
   33   HD12  ILE   4          HD12      ILE   4  12.136  17.943  -6.858
   34   HD13  ILE   4          HD13      ILE   4  12.048  16.183  -6.894
   35    H    LEU   5           H        LEU   5  10.297  16.389  -0.550
   36    HA   LEU   5           HA       LEU   5  10.578  14.797   1.156
   37    HB2  LEU   5           HB3      LEU   5   9.613  13.147  -1.185
   38    HB3  LEU   5           HB2      LEU   5   9.905  12.427   0.399
   39    HG   LEU   5           HG       LEU   5   8.343  14.046   1.420
   40   HD11  LEU   5          HD11      LEU   5   6.860  15.268  -0.358
   41   HD12  LEU   5          HD12      LEU   5   8.253  15.048  -1.416
   42   HD13  LEU   5          HD13      LEU   5   8.419  15.968   0.080
   43   HD21  LEU   5          HD21      LEU   5   6.366  13.236  -0.361
   44   HD22  LEU   5          HD22      LEU   5   6.948  12.307   1.020
   45   HD23  LEU   5          HD23      LEU   5   7.633  12.030  -0.581
   46    H    LEU   6           H        LEU   6  11.550  12.184   1.118
   47    HA   LEU   6           HA       LEU   6  14.199  12.336  -0.234
   48    HB2  LEU   6           HB3      LEU   6  13.661  12.214   2.715
   49    HB3  LEU   6           HB2      LEU   6  15.066  11.366   2.070
   50    HG   LEU   6           HG       LEU   6  14.573  14.203   1.233
   51   HD11  LEU   6          HD11      LEU   6  14.396  14.452   3.598
   52   HD12  LEU   6          HD12      LEU   6  16.074  14.838   3.211
   53   HD13  LEU   6          HD13      LEU   6  15.666  13.263   3.892
   54   HD21  LEU   6          HD21      LEU   6  17.226  13.024   1.944
   55   HD22  LEU   6          HD22      LEU   6  16.809  14.144   0.647
   56   HD23  LEU   6          HD23      LEU   6  16.432  12.429   0.485
   57    H    SER   7           H        SER   7  15.343  10.049   0.680
   58    HA   SER   7           HA       SER   7  13.505   7.992  -0.389
   59    HB2  SER   7           HB3      SER   7  16.456   8.228   0.011
   60    HB3  SER   7           HB2      SER   7  15.755   6.611   0.018
   61    HG   SER   7           HG       SER   7  15.232   8.550  -1.986
   62    H    ALA   8           H        ALA   8  12.940   6.108   0.790
   63    HA   ALA   8           HA       ALA   8  13.023   6.462   3.726
   64    HB1  ALA   8           HB1      ALA   8  11.064   5.331   3.726
   65    HB2  ALA   8           HB2      ALA   8  11.726   4.036   2.730
   66    HB3  ALA   8           HB3      ALA   8  11.094   5.496   1.971
   67    H    SER   9           H        SER   9  13.422   4.358   5.018
   68    HA   SER   9           HA       SER   9  15.375   2.552   3.714
   69    HB2  SER   9           HB3      SER   9  16.045   4.631   5.675
   70    HB3  SER   9           HB2      SER   9  16.588   3.025   6.152
   71    HG   SER   9           HG       SER   9  18.077   3.192   4.693
   72    H    ASP  10           H        ASP  10  13.923   3.366   6.885
   73    HA   ASP  10           HA       ASP  10  13.990   0.674   7.872
   74    HB2  ASP  10           HB3      ASP  10  11.798   2.401   8.847
   75    HB3  ASP  10           HB2      ASP  10  13.060   1.565   9.752
   76    H    LEU  11           H        LEU  11  11.779   2.365   5.768
   77    HA   LEU  11           HA       LEU  11   9.754   0.212   6.021
   78    HB2  LEU  11           HB3      LEU  11   9.821   2.949   4.809
   79    HB3  LEU  11           HB2      LEU  11   8.684   1.772   4.152
   80    HG   LEU  11           HG       LEU  11   8.851   2.082   7.125
   81   HD11  LEU  11          HD11      LEU  11   8.614   4.365   6.659
   82   HD12  LEU  11          HD12      LEU  11   6.937   3.829   6.751
   83   HD13  LEU  11          HD13      LEU  11   7.702   4.068   5.179
   84   HD21  LEU  11          HD21      LEU  11   7.429   0.392   5.745
   85   HD22  LEU  11          HD22      LEU  11   6.408   1.783   5.384
   86   HD23  LEU  11          HD23      LEU  11   6.640   1.270   7.055
   87    H    ALA  12           H        ALA  12   8.774  -0.119   3.553
   88    HA   ALA  12           HA       ALA  12   9.175  -0.922   1.370
   89    HB1  ALA  12           HB1      ALA  12  11.115  -0.395   0.257
   90    HB2  ALA  12           HB2      ALA  12  12.140  -0.803   1.633
   91    HB3  ALA  12           HB3      ALA  12  11.279   0.736   1.602
   92    H    GLY  13           H        GLY  13  10.002  -2.967   0.455
   93    HA2  GLY  13           HA3      GLY  13  11.530  -4.960   1.168
   94    HA3  GLY  13           HA2      GLY  13  10.536  -4.947   2.622
   95    H    GLN  14           H        GLN  14   9.319  -6.802   2.409
   96    HA   GLN  14           HA       GLN  14   7.687  -7.067  -0.084
   97    HB2  GLN  14           HB3      GLN  14   9.536  -8.858   0.465
   98    HB3  GLN  14           HB2      GLN  14   8.376  -9.410   1.673
   99    HG2  GLN  14           HG3      GLN  14   6.641  -9.475  -0.178
  100    HG3  GLN  14           HG2      GLN  14   7.959  -9.204  -1.319
  101   HE21  GLN  14          HE22      GLN  14   7.936 -11.230   1.656
  102   HE22  GLN  14          HE21      GLN  14   8.315 -12.677   0.853
  103    H    TRP  15           H        TRP  15   5.481  -7.570   0.279
  104    HA   TRP  15           HA       TRP  15   4.587  -7.906   3.080
  105    HB2  TRP  15           HB3      TRP  15   3.650  -5.645   1.290
  106    HB3  TRP  15           HB2      TRP  15   2.901  -6.083   2.816
  107    HD1  TRP  15           HD1      TRP  15   6.372  -4.935   1.486
  108    HE1  TRP  15           HE1      TRP  15   7.512  -3.571   3.345
  109    HE3  TRP  15           HE3      TRP  15   2.891  -5.408   5.209
  110    HZ2  TRP  15           HZ2      TRP  15   7.024  -2.773   6.044
  111    HZ3  TRP  15           HZ3      TRP  15   3.261  -4.325   7.410
  112    HH2  TRP  15           HH2      TRP  15   5.318  -3.010   7.830
  113    H    THR  16           H        THR  16   2.057  -8.132   3.003
  114    HA   THR  16           HA       THR  16   1.142  -9.377   0.456
  115    HB   THR  16           HB       THR  16   0.186 -11.223   2.162
  116    HG1  THR  16           HG1      THR  16   1.992  -9.891   3.566
  117   HG21  THR  16          HG21      THR  16   2.371 -12.531   1.598
  118   HG22  THR  16          HG22      THR  16   2.797 -11.089   0.680
  119   HG23  THR  16          HG23      THR  16   1.339 -11.992   0.275
  120    H    LEU  17           H        LEU  17  -1.250  -9.830   0.586
  121    HA   LEU  17           HA       LEU  17  -2.605  -7.927   2.471
  122    HB2  LEU  17           HB3      LEU  17  -2.646  -8.050  -0.379
  123    HB3  LEU  17           HB2      LEU  17  -4.237  -8.551   0.194
  124    HG   LEU  17           HG       LEU  17  -4.321  -6.518   1.635
  125   HD11  LEU  17          HD11      LEU  17  -1.550  -6.418   0.903
  126   HD12  LEU  17          HD12      LEU  17  -2.422  -5.378   2.031
  127   HD13  LEU  17          HD13      LEU  17  -2.335  -4.949   0.323
  128   HD21  LEU  17          HD21      LEU  17  -4.292  -4.875  -0.427
  129   HD22  LEU  17          HD22      LEU  17  -5.474  -6.183  -0.368
  130   HD23  LEU  17          HD23      LEU  17  -4.020  -6.353  -1.351
  131    H    GLN  18           H        GLN  18  -4.720  -8.631   3.247
  132    HA   GLN  18           HA       GLN  18  -5.377 -11.495   2.791
  133    HB2  GLN  18           HB3      GLN  18  -3.974 -10.741   5.029
  134    HB3  GLN  18           HB2      GLN  18  -5.640 -10.616   5.596
  135    HG2  GLN  18           HG3      GLN  18  -6.048 -12.929   4.692
  136    HG3  GLN  18           HG2      GLN  18  -4.323 -13.041   4.343
  137   HE21  GLN  18          HE22      GLN  18  -3.091 -13.922   6.008
  138   HE22  GLN  18          HE21      GLN  18  -3.536 -13.943   7.646
  139    H    GLN  19           H        GLN  19  -7.473 -11.478   2.170
  140    HA   GLN  19           HA       GLN  19  -9.256  -9.297   3.156
  141    HB2  GLN  19           HB3      GLN  19  -9.180  -9.556   0.728
  142    HB3  GLN  19           HB2      GLN  19  -9.561 -11.270   0.871
  143    HG2  GLN  19           HG3      GLN  19 -11.774 -10.876   1.204
  144    HG3  GLN  19           HG2      GLN  19 -11.463  -9.491   2.250
  145   HE21  GLN  19          HE22      GLN  19 -11.242  -7.375   1.243
  146   HE22  GLN  19          HE21      GLN  19 -11.684  -7.111  -0.374
  147    H    ASP  20           H        ASP  20 -10.418  -9.885   4.956
  148    HA   ASP  20           HA       ASP  20 -11.497 -11.268   6.512
  149    HB2  ASP  20           HB3      ASP  20 -13.530 -11.827   5.664
  150    HB3  ASP  20           HB2      ASP  20 -12.935 -11.051   4.196
  151    H    GLU  21           H        GLU  21 -12.350 -13.845   6.517
  152    HA   GLU  21           HA       GLU  21  -9.787 -15.311   6.550
  153    HB2  GLU  21           HB3      GLU  21 -12.411 -16.518   7.369
  154    HB3  GLU  21           HB2      GLU  21 -10.801 -16.795   8.035
  155    HG2  GLU  21           HG3      GLU  21 -12.525 -14.328   8.380
  156    HG3  GLU  21           HG2      GLU  21 -12.020 -15.462   9.634
  157    H    ALA  22           H        ALA  22 -10.823 -14.751   3.926
  158    HA   ALA  22           HA       ALA  22 -11.372 -17.544   3.009
  159    HB1  ALA  22           HB1      ALA  22 -13.181 -15.458   2.818
  160    HB2  ALA  22           HB2      ALA  22 -13.197 -16.908   1.819
  161    HB3  ALA  22           HB3      ALA  22 -12.401 -15.444   1.238
  162    HA   PRO  23           HA       PRO  23  -8.192 -17.122  -0.041
  163    HB2  PRO  23           HB2      PRO  23 -10.028 -17.090  -2.374
  164    HB3  PRO  23           HB3      PRO  23  -8.759 -18.254  -1.954
  165    HG2  PRO  23           HG3      PRO  23 -11.352 -18.846  -1.745
  166    HG3  PRO  23           HG2      PRO  23 -10.146 -19.479  -0.610
  167    HD2  PRO  23           HD3      PRO  23 -12.124 -17.261  -0.216
  168    HD3  PRO  23           HD2      PRO  23 -11.561 -18.495   0.933
  169    H    ALA  24           H        ALA  24  -8.597 -15.901  -2.770
  170    HA   ALA  24           HA       ALA  24  -8.373 -13.801  -3.779
  171    HB1  ALA  24           HB1      ALA  24  -9.926 -12.153  -3.185
  172    HB2  ALA  24           HB2      ALA  24  -9.867 -12.576  -1.474
  173    HB3  ALA  24           HB3      ALA  24 -10.707 -13.628  -2.613
  174    H    ILE  25           H        ILE  25  -6.084 -14.374  -2.665
  175    HA   ILE  25           HA       ILE  25  -5.350 -12.127  -0.833
  176    HB   ILE  25           HB       ILE  25  -4.087 -14.823  -1.381
  177   HG12  ILE  25          HG13      ILE  25  -4.736 -13.579   1.288
  178   HG13  ILE  25          HG12      ILE  25  -5.998 -14.373   0.344
  179   HG21  ILE  25          HG21      ILE  25  -2.942 -12.357  -0.068
  180   HG22  ILE  25          HG22      ILE  25  -2.207 -13.380  -1.300
  181   HG23  ILE  25          HG23      ILE  25  -2.372 -13.972   0.354
  182   HD11  ILE  25          HD11      ILE  25  -3.363 -15.683   1.067
  183   HD12  ILE  25          HD12      ILE  25  -4.762 -16.453   0.321
  184   HD13  ILE  25          HD13      ILE  25  -4.849 -15.895   1.991
  185    H    CYS  26           H        CYS  26  -3.203 -11.099  -1.338
  186    HA   CYS  26           HA       CYS  26  -2.313 -11.417  -4.147
  187    HB2  CYS  26           HB3      CYS  26  -3.673  -8.998  -3.032
  188    HB3  CYS  26           HB2      CYS  26  -2.339  -8.758  -4.156
  189    H    HIS  27           H        HIS  27  -0.139 -11.584  -4.011
  190    HA   HIS  27           HA       HIS  27   1.372 -10.738  -1.703
  191    HB2  HIS  27           HB3      HIS  27   1.912 -12.050  -4.273
  192    HB3  HIS  27           HB2      HIS  27   3.197 -10.937  -3.795
  193    HD1  HIS  27           HD1      HIS  27   4.657 -11.591  -1.807
  194    HD2  HIS  27           HD2      HIS  27   1.439 -14.187  -2.363
  195    HE1  HIS  27           HE1      HIS  27   5.041 -13.556  -0.251
  196    HE2  HIS  27           HE2      HIS  27   3.088 -15.141  -0.582
  197    H    LEU  28           H        LEU  28   2.512  -8.792  -1.424
  198    HA   LEU  28           HA       LEU  28   2.219  -6.766  -3.610
  199    HB2  LEU  28           HB3      LEU  28   1.290  -6.716  -0.835
  200    HB3  LEU  28           HB2      LEU  28   2.311  -5.342  -1.224
  201    HG   LEU  28           HG       LEU  28  -0.109  -4.915  -1.661
  202   HD11  LEU  28          HD11      LEU  28   2.121  -4.447  -3.382
  203   HD12  LEU  28          HD12      LEU  28   0.673  -3.463  -3.178
  204   HD13  LEU  28          HD13      LEU  28   0.705  -4.740  -4.394
  205   HD21  LEU  28          HD21      LEU  28  -0.232  -7.449  -2.570
  206   HD22  LEU  28          HD22      LEU  28  -0.030  -6.606  -4.106
  207   HD23  LEU  28          HD23      LEU  28  -1.382  -6.207  -3.051
  208    H    GLU  29           H        GLU  29   3.941  -5.238  -3.745
  209    HA   GLU  29           HA       GLU  29   6.347  -5.814  -2.087
  210    HB2  GLU  29           HB3      GLU  29   6.028  -6.589  -4.799
  211    HB3  GLU  29           HB2      GLU  29   7.125  -5.209  -4.796
  212    HG2  GLU  29           HG3      GLU  29   8.429  -6.379  -2.966
  213    HG3  GLU  29           HG2      GLU  29   7.417  -7.796  -3.256
  214    H    LEU  30           H        LEU  30   6.931  -3.935  -1.190
  215    HA   LEU  30           HA       LEU  30   6.050  -1.391  -2.386
  216    HB2  LEU  30           HB3      LEU  30   7.123  -2.307   0.233
  217    HB3  LEU  30           HB2      LEU  30   7.494  -0.651  -0.234
  218    HG   LEU  30           HG       LEU  30   5.130  -0.157  -0.547
  219   HD11  LEU  30          HD11      LEU  30   4.924  -3.119  -0.273
  220   HD12  LEU  30          HD12      LEU  30   4.033  -2.023  -1.330
  221   HD13  LEU  30          HD13      LEU  30   3.599  -2.151   0.374
  222   HD21  LEU  30          HD21      LEU  30   5.155  -1.671   2.042
  223   HD22  LEU  30          HD22      LEU  30   4.561  -0.044   1.707
  224   HD23  LEU  30          HD23      LEU  30   6.296  -0.344   1.824
  225    H    ARG  31           H        ARG  31   7.331  -0.836  -4.127
  226    HA   ARG  31           HA       ARG  31  10.117  -1.487  -4.349
  227    HB2  ARG  31           HB3      ARG  31   8.155   0.111  -5.845
  228    HB3  ARG  31           HB2      ARG  31   9.800   0.735  -5.952
  229    HG2  ARG  31           HG3      ARG  31  10.627  -1.397  -6.740
  230    HG3  ARG  31           HG2      ARG  31   9.064  -2.163  -6.446
  231    HD2  ARG  31           HD3      ARG  31   9.184  -1.693  -8.804
  232    HD3  ARG  31           HD2      ARG  31   8.061  -0.530  -8.099
  233    HE   ARG  31           HE       ARG  31  10.486   0.791  -8.015
  234   HH11  ARG  31          HH22      ARG  31   8.652  -0.882 -10.405
  235   HH12  ARG  31          HH21      ARG  31   9.225   0.091 -11.720
  236   HH21  ARG  31          HH11      ARG  31  11.248   2.071  -9.715
  237   HH22  ARG  31          HH12      ARG  31  10.696   1.764 -11.328
  238    H    ASP  32           H        ASP  32  11.875   0.220  -4.478
  239    HA   ASP  32           HA       ASP  32  11.556   2.164  -2.225
  240    HB2  ASP  32           HB3      ASP  32  14.296   1.791  -2.946
  241    HB3  ASP  32           HB2      ASP  32  13.494   1.329  -1.447
  242    H    SER  33           H        SER  33  11.369   2.140  -5.455
  243    HA   SER  33           HA       SER  33  13.189   4.348  -6.083
  244    HB2  SER  33           HB3      SER  33  10.885   3.617  -7.850
  245    HB3  SER  33           HB2      SER  33  12.533   4.061  -8.288
  246    HG   SER  33           HG       SER  33  12.978   2.018  -8.299
  247    H    GLU  34           H        GLU  34  12.664   6.511  -6.005
  248    HA   GLU  34           HA       GLU  34  10.135   7.263  -4.753
  249    HB2  GLU  34           HB3      GLU  34  11.021   9.532  -4.808
  250    HB3  GLU  34           HB2      GLU  34  12.298   8.433  -4.281
  251    HG2  GLU  34           HG3      GLU  34  12.771   8.330  -6.911
  252    HG3  GLU  34           HG2      GLU  34  12.024   9.927  -6.850
  253    H    VAL  35           H        VAL  35   8.667   8.882  -5.747
  254    HA   VAL  35           HA       VAL  35   8.755   9.008  -8.712
  255    HB   VAL  35           HB       VAL  35   6.410   7.921  -7.127
  256   HG11  VAL  35          HG11      VAL  35   5.208   8.876  -8.800
  257   HG12  VAL  35          HG12      VAL  35   5.853   7.570  -9.797
  258   HG13  VAL  35          HG13      VAL  35   6.640   9.148  -9.794
  259   HG21  VAL  35          HG21      VAL  35   6.817   5.947  -8.696
  260   HG22  VAL  35          HG22      VAL  35   8.041   6.194  -7.450
  261   HG23  VAL  35          HG23      VAL  35   8.353   6.709  -9.109
  262    H    ALA  36           H        ALA  36   8.510  11.141  -9.166
  263    HA   ALA  36           HA       ALA  36   7.274  12.944  -7.217
  264    HB1  ALA  36           HB1      ALA  36   9.261  13.625  -8.544
  265    HB2  ALA  36           HB2      ALA  36   7.895  14.713  -8.799
  266    HB3  ALA  36           HB3      ALA  36   8.300  13.502 -10.017
  267    H    GLU  37           H        GLU  37   6.403  11.451 -10.291
  268    HA   GLU  37           HA       GLU  37   4.205  13.056 -11.025
  269    HB2  GLU  37           HB3      GLU  37   4.739  11.389 -12.584
  270    HB3  GLU  37           HB2      GLU  37   4.823  10.129 -11.352
  271    HG2  GLU  37           HG3      GLU  37   2.489   9.943 -11.198
  272    HG3  GLU  37           HG2      GLU  37   2.219  11.539 -11.899
  273    H    ALA  38           H        ALA  38   4.503  10.625  -8.509
  274    HA   ALA  38           HA       ALA  38   1.677  11.176  -7.689
  275    HB1  ALA  38           HB1      ALA  38   2.852   8.722  -8.266
  276    HB2  ALA  38           HB2      ALA  38   1.364   8.962  -7.350
  277    HB3  ALA  38           HB3      ALA  38   2.906   8.807  -6.505
  278    H    SER  39           H        SER  39   4.884  11.721  -6.915
  279    HA   SER  39           HA       SER  39   5.865  12.648  -5.009
  280    HB2  SER  39           HB3      SER  39   3.416  13.756  -5.071
  281    HB3  SER  39           HB2      SER  39   3.263  12.841  -3.574
  282    HG   SER  39           HG       SER  39   5.306  13.842  -2.968
  283    H    GLY  40           H        GLY  40   5.648   9.816  -5.216
  284    HA2  GLY  40           HA3      GLY  40   5.924   9.118  -2.376
  285    HA3  GLY  40           HA2      GLY  40   4.614   8.284  -3.213
  286    H    TYR  41           H        TYR  41   5.659   6.230  -3.036
  287    HA   TYR  41           HA       TYR  41   8.137   5.927  -4.683
  288    HB2  TYR  41           HB3      TYR  41   7.124   4.204  -2.404
  289    HB3  TYR  41           HB2      TYR  41   8.615   3.943  -3.312
  290    HD1  TYR  41           HD1      TYR  41   6.836   6.516  -1.247
  291    HD2  TYR  41           HD2      TYR  41  10.598   4.991  -2.643
  292    HE1  TYR  41           HE1      TYR  41   8.030   8.108   0.228
  293    HE2  TYR  41           HE2      TYR  41  11.795   6.578  -1.160
  294    HH   TYR  41           HH       TYR  41  10.283   9.204   0.310
  295    H    ASP  42           H        ASP  42   8.195   4.133  -6.122
  296    HA   ASP  42           HA       ASP  42   5.736   3.532  -7.426
  297    HB2  ASP  42           HB3      ASP  42   8.128   3.434  -8.362
  298    HB3  ASP  42           HB2      ASP  42   8.219   1.830  -7.636
  299    H    LEU  43           H        LEU  43   4.917   1.326  -7.807
  300    HA   LEU  43           HA       LEU  43   5.061  -0.422  -5.375
  301    HB2  LEU  43           HB3      LEU  43   2.887   0.842  -5.453
  302    HB3  LEU  43           HB2      LEU  43   2.577   0.131  -7.031
  303    HG   LEU  43           HG       LEU  43   2.857  -2.165  -5.872
  304   HD11  LEU  43          HD11      LEU  43   1.891  -1.172  -3.339
  305   HD12  LEU  43          HD12      LEU  43   3.491  -0.515  -3.670
  306   HD13  LEU  43          HD13      LEU  43   3.238  -2.262  -3.661
  307   HD21  LEU  43          HD21      LEU  43   0.713  -1.326  -6.630
  308   HD22  LEU  43          HD22      LEU  43   0.558  -0.325  -5.187
  309   HD23  LEU  43          HD23      LEU  43   0.512  -2.082  -5.052
  310    H    GLY  44           H        GLY  44   5.521  -2.503  -5.829
  311    HA2  GLY  44           HA3      GLY  44   5.122  -3.494  -8.624
  312    HA3  GLY  44           HA2      GLY  44   6.601  -3.842  -7.722
  313    H    GLY  45           H        GLY  45   4.552  -5.746  -8.735
  314    HA2  GLY  45           HA3      GLY  45   4.474  -7.825  -7.120
  315    HA3  GLY  45           HA2      GLY  45   3.402  -6.785  -6.194
  316    H    ASP  46           H        ASP  46   1.481  -7.913  -6.490
  317    HA   ASP  46           HA       ASP  46   0.626  -8.522  -9.275
  318    HB2  ASP  46           HB3      ASP  46   0.450 -10.112  -7.156
  319    HB3  ASP  46           HB2      ASP  46  -1.033  -9.197  -6.877
  320    H    THR  47           H        THR  47   0.729  -5.784  -8.089
  321    HA   THR  47           HA       THR  47  -1.613  -4.638  -7.236
  322    HB   THR  47           HB       THR  47  -0.763  -2.648  -7.986
  323    HG1  THR  47           HG1      THR  47   0.262  -2.650 -10.186
  324   HG21  THR  47          HG21      THR  47   1.625  -2.736  -8.249
  325   HG22  THR  47          HG22      THR  47   1.554  -4.391  -8.853
  326   HG23  THR  47          HG23      THR  47   1.175  -4.050  -7.163
  327    H    ALA  48           H        ALA  48  -1.081  -6.108 -10.369
  328    HA   ALA  48           HA       ALA  48  -3.401  -4.982 -11.665
  329    HB1  ALA  48           HB1      ALA  48  -1.284  -6.728 -12.367
  330    HB2  ALA  48           HB2      ALA  48  -2.516  -6.055 -13.435
  331    HB3  ALA  48           HB3      ALA  48  -2.779  -7.616 -12.656
  332    H    CYS  49           H        CYS  49  -3.423  -6.632  -8.932
  333    HA   CYS  49           HA       CYS  49  -5.824  -8.283  -9.636
  334    HB2  CYS  49           HB3      CYS  49  -5.274  -9.758  -7.846
  335    HB3  CYS  49           HB2      CYS  49  -3.751  -9.458  -8.683
  336    H    LEU  50           H        LEU  50  -4.561  -5.693  -7.691
  337    HA   LEU  50           HA       LEU  50  -6.598  -5.649  -5.674
  338    HB2  LEU  50           HB3      LEU  50  -5.059  -3.301  -6.818
  339    HB3  LEU  50           HB2      LEU  50  -5.894  -3.345  -5.269
  340    HG   LEU  50           HG       LEU  50  -3.701  -5.306  -5.959
  341   HD11  LEU  50          HD11      LEU  50  -3.403  -2.671  -4.492
  342   HD12  LEU  50          HD12      LEU  50  -2.842  -2.974  -6.136
  343   HD13  LEU  50          HD13      LEU  50  -2.129  -3.855  -4.786
  344   HD21  LEU  50          HD21      LEU  50  -4.970  -6.023  -4.064
  345   HD22  LEU  50          HD22      LEU  50  -5.042  -4.389  -3.401
  346   HD23  LEU  50          HD23      LEU  50  -3.519  -5.275  -3.404
  347    H    THR  51           H        THR  51  -6.977  -5.362  -8.940
  348    HA   THR  51           HA       THR  51  -8.762  -3.129  -9.176
  349    HB   THR  51           HB       THR  51  -9.608  -4.418 -11.215
  350    HG1  THR  51           HG1      THR  51  -7.471  -6.138 -10.521
  351   HG21  THR  51          HG21      THR  51  -6.745  -3.671 -10.703
  352   HG22  THR  51          HG22      THR  51  -7.944  -2.862 -11.712
  353   HG23  THR  51          HG23      THR  51  -7.199  -4.363 -12.260
  354    H    ARG  52           H        ARG  52  -9.112  -5.581  -7.136
  355    HA   ARG  52           HA       ARG  52 -12.053  -5.903  -7.557
  356    HB2  ARG  52           HB3      ARG  52 -11.867  -7.858  -6.066
  357    HB3  ARG  52           HB2      ARG  52 -10.774  -8.014  -7.440
  358    HG2  ARG  52           HG3      ARG  52  -8.968  -6.994  -5.959
  359    HG3  ARG  52           HG2      ARG  52 -10.081  -7.215  -4.608
  360    HD2  ARG  52           HD3      ARG  52  -8.829  -9.331  -6.359
  361    HD3  ARG  52           HD2      ARG  52  -8.748  -9.177  -4.603
  362    HE   ARG  52           HE       ARG  52 -11.448  -9.495  -5.089
  363   HH11  ARG  52          HH22      ARG  52  -8.559 -11.146  -5.988
  364   HH12  ARG  52          HH21      ARG  52  -9.315 -12.701  -6.072
  365   HH21  ARG  52          HH11      ARG  52 -12.453 -11.516  -5.192
  366   HH22  ARG  52          HH12      ARG  52 -11.521 -12.911  -5.620
  367    H    TRP  53           H        TRP  53  -9.618  -4.525  -5.532
  368    HA   TRP  53           HA       TRP  53 -11.694  -3.820  -3.482
  369    HB2  TRP  53           HB3      TRP  53  -8.682  -3.947  -3.145
  370    HB3  TRP  53           HB2      TRP  53  -9.850  -3.563  -1.885
  371    HD1  TRP  53           HD1      TRP  53 -11.991  -5.739  -2.210
  372    HE1  TRP  53           HE1      TRP  53 -11.456  -8.226  -1.805
  373    HE3  TRP  53           HE3      TRP  53  -6.921  -5.664  -2.817
  374    HZ2  TRP  53           HZ2      TRP  53  -9.180  -9.958  -1.743
  375    HZ3  TRP  53           HZ3      TRP  53  -5.596  -7.743  -2.579
  376    HH2  TRP  53           HH2      TRP  53  -6.718  -9.889  -2.042
  377    H    LEU  54           H        LEU  54  -8.999  -2.691  -5.454
  378    HA   LEU  54           HA       LEU  54  -9.560   0.114  -4.661
  379    HB2  LEU  54           HB3      LEU  54  -7.339  -1.190  -6.254
  380    HB3  LEU  54           HB2      LEU  54  -7.453   0.549  -6.024
  381    HG   LEU  54           HG       LEU  54  -7.351  -1.457  -3.749
  382   HD11  LEU  54          HD11      LEU  54  -5.248  -1.116  -5.305
  383   HD12  LEU  54          HD12      LEU  54  -5.061  -1.128  -3.554
  384   HD13  LEU  54          HD13      LEU  54  -5.103   0.405  -4.426
  385   HD21  LEU  54          HD21      LEU  54  -7.806   1.434  -3.927
  386   HD22  LEU  54          HD22      LEU  54  -6.471   1.012  -2.858
  387   HD23  LEU  54          HD23      LEU  54  -8.075   0.336  -2.577
  388    HA   PRO  55           HA       PRO  55 -11.736   0.747  -8.494
  389    HB2  PRO  55           HB2      PRO  55 -11.379   3.410  -8.923
  390    HB3  PRO  55           HB3      PRO  55 -12.424   2.781  -7.635
  391    HG2  PRO  55           HG3      PRO  55  -9.673   3.884  -7.471
  392    HG3  PRO  55           HG2      PRO  55 -11.028   4.055  -6.345
  393    HD2  PRO  55           HD3      PRO  55  -8.921   2.306  -5.979
  394    HD3  PRO  55           HD2      PRO  55 -10.521   2.107  -5.245
  395    H    SER  56           H        SER  56  -8.356   1.406  -8.280
  396    HA   SER  56           HA       SER  56  -8.050   0.861 -11.160
  397    HB2  SER  56           HB3      SER  56  -7.482   2.949 -11.804
  398    HB3  SER  56           HB2      SER  56  -8.064   3.516 -10.241
  399    HG   SER  56           HG       SER  56  -6.004   3.293  -9.422
  400    H    GLU  57           H        GLU  57  -5.788   0.340 -11.688
  401    HA   GLU  57           HA       GLU  57  -4.510  -1.160  -9.610
  402    HB2  GLU  57           HB3      GLU  57  -4.334  -1.666 -12.049
  403    HB3  GLU  57           HB2      GLU  57  -3.318  -0.237 -12.235
  404    HG2  GLU  57           HG3      GLU  57  -1.638  -1.156 -10.760
  405    HG3  GLU  57           HG2      GLU  57  -2.687  -2.510 -10.335
  406    HA   PRO  58           HA       PRO  58  -2.314   2.484  -7.989
  407    HB2  PRO  58           HB2      PRO  58  -1.005   1.248  -5.940
  408    HB3  PRO  58           HB3      PRO  58  -2.699   1.743  -5.856
  409    HG2  PRO  58           HG3      PRO  58  -1.540  -0.940  -6.251
  410    HG3  PRO  58           HG2      PRO  58  -3.027  -0.454  -5.447
  411    HD2  PRO  58           HD3      PRO  58  -2.888  -1.553  -7.997
  412    HD3  PRO  58           HD2      PRO  58  -4.262  -0.621  -7.362
  413    H    ARG  59           H        ARG  59  -0.612   3.133  -9.212
  414    HA   ARG  59           HA       ARG  59   1.640   1.265  -9.699
  415    HB2  ARG  59           HB3      ARG  59   0.422   3.411 -11.171
  416    HB3  ARG  59           HB2      ARG  59   2.124   3.791 -10.902
  417    HG2  ARG  59           HG3      ARG  59   2.760   1.577 -11.787
  418    HG3  ARG  59           HG2      ARG  59   1.059   1.201 -12.066
  419    HD2  ARG  59           HD3      ARG  59   0.854   2.951 -13.699
  420    HD3  ARG  59           HD2      ARG  59   2.439   3.604 -13.285
  421    HE   ARG  59           HE       ARG  59   1.935   1.357 -15.059
  422   HH11  ARG  59          HH22      ARG  59   4.084   2.795 -12.779
  423   HH12  ARG  59          HH21      ARG  59   5.497   2.035 -13.431
  424   HH21  ARG  59          HH11      ARG  59   3.766   0.354 -15.924
  425   HH22  ARG  59          HH12      ARG  59   5.316   0.651 -15.213
  426    H    ALA  60           H        ALA  60   0.773   3.585  -7.447
  427    HA   ALA  60           HA       ALA  60   3.553   3.751  -6.504
  428    HB1  ALA  60           HB1      ALA  60   2.001   6.294  -7.057
  429    HB2  ALA  60           HB2      ALA  60   3.272   5.671  -8.107
  430    HB3  ALA  60           HB3      ALA  60   3.655   6.168  -6.458
  431    H    TRP  61           H        TRP  61   3.635   4.853  -4.355
  432    HA   TRP  61           HA       TRP  61   1.064   5.068  -2.911
  433    HB2  TRP  61           HB3      TRP  61   1.889   3.524  -1.102
  434    HB3  TRP  61           HB2      TRP  61   1.539   2.703  -2.621
  435    HD1  TRP  61           HD1      TRP  61   3.883   2.625  -4.305
  436    HE1  TRP  61           HE1      TRP  61   6.229   1.844  -3.588
  437    HE3  TRP  61           HE3      TRP  61   3.471   3.128   0.759
  438    HZ2  TRP  61           HZ2      TRP  61   7.731   1.468  -1.187
  439    HZ3  TRP  61           HZ3      TRP  61   5.369   2.532   2.237
  440    HH2  TRP  61           HH2      TRP  61   7.498   1.706   1.272
  441    H    ARG  62           H        ARG  62   1.414   6.117  -0.775
  442    HA   ARG  62           HA       ARG  62   4.081   7.442  -0.522
  443    HB2  ARG  62           HB3      ARG  62   2.830   9.129  -1.566
  444    HB3  ARG  62           HB2      ARG  62   1.366   8.719  -0.668
  445    HG2  ARG  62           HG3      ARG  62   2.131   9.730   1.298
  446    HG3  ARG  62           HG2      ARG  62   3.822   9.631   0.806
  447    HD2  ARG  62           HD3      ARG  62   3.708  11.532  -0.469
  448    HD3  ARG  62           HD2      ARG  62   2.030  11.245  -0.932
  449    HE   ARG  62           HE       ARG  62   1.367  12.535   0.925
  450   HH11  ARG  62          HH22      ARG  62   4.617  11.419   1.219
  451   HH12  ARG  62          HH21      ARG  62   4.937  12.323   2.660
  452   HH21  ARG  62          HH11      ARG  62   1.768  13.720   2.807
  453   HH22  ARG  62          HH12      ARG  62   3.324  13.626   3.560
  454    HA   PRO  63           HA       PRO  63   3.095   5.783   3.651
  455    HB2  PRO  63           HB2      PRO  63   5.688   6.915   4.415
  456    HB3  PRO  63           HB3      PRO  63   5.138   5.234   4.483
  457    HG2  PRO  63           HG3      PRO  63   6.972   6.212   2.704
  458    HG3  PRO  63           HG2      PRO  63   6.013   4.747   2.474
  459    HD2  PRO  63           HD3      PRO  63   5.756   7.366   1.143
  460    HD3  PRO  63           HD2      PRO  63   5.172   5.770   0.626
  461    H    THR  64           H        THR  64   1.837   7.011   5.037
  462    HA   THR  64           HA       THR  64   2.429   9.923   5.253
  463    HB   THR  64           HB       THR  64   0.045   9.562   6.536
  464    HG1  THR  64           HG1      THR  64   0.553   7.291   5.290
  465   HG21  THR  64          HG21      THR  64   0.510  11.170   4.727
  466   HG22  THR  64          HG22      THR  64  -0.995  10.302   4.421
  467   HG23  THR  64          HG23      THR  64   0.471   9.858   3.548
  468    HA   PRO  65           HA       PRO  65   3.849   9.448   9.412
  469    HB2  PRO  65           HB2      PRO  65   2.746  11.645  10.657
  470    HB3  PRO  65           HB3      PRO  65   4.159  11.713   9.588
  471    HG2  PRO  65           HG3      PRO  65   1.321  12.381   9.020
  472    HG3  PRO  65           HG2      PRO  65   2.805  13.165   8.452
  473    HD2  PRO  65           HD3      PRO  65   1.338  11.468   6.892
  474    HD3  PRO  65           HD2      PRO  65   3.094  11.666   6.714
  475    H    ALA  66           H        ALA  66   1.147   8.223   8.710
  476    HA   ALA  66           HA       ALA  66   0.424   7.432  11.393
  477    HB1  ALA  66           HB1      ALA  66  -2.013   8.326  11.067
  478    HB2  ALA  66           HB2      ALA  66  -1.258   9.484   9.972
  479    HB3  ALA  66           HB3      ALA  66  -0.774   9.429  11.668
  480    H    GLY  67           H        GLY  67   0.940   6.517   8.497
  481    HA2  GLY  67           HA3      GLY  67  -0.216   4.088   8.359
  482    HA3  GLY  67           HA2      GLY  67  -1.572   5.104   7.871
  483    H    ILE  68           H        ILE  68  -0.929   3.467   5.912
  484    HA   ILE  68           HA       ILE  68   0.986   4.917   4.130
  485    HB   ILE  68           HB       ILE  68  -0.040   2.138   3.617
  486   HG12  ILE  68          HG13      ILE  68   2.207   2.948   5.489
  487   HG13  ILE  68          HG12      ILE  68   0.758   2.035   5.910
  488   HG21  ILE  68          HG21      ILE  68   1.701   2.023   2.131
  489   HG22  ILE  68          HG22      ILE  68   2.765   3.001   3.141
  490   HG23  ILE  68          HG23      ILE  68   1.530   3.777   2.150
  491   HD11  ILE  68          HD11      ILE  68   3.068   1.152   4.170
  492   HD12  ILE  68          HD12      ILE  68   1.520   0.305   4.186
  493   HD13  ILE  68          HD13      ILE  68   2.485   0.409   5.661
  494    H    ALA  69           H        ALA  69   0.321   5.361   1.975
  495    HA   ALA  69           HA       ALA  69  -2.610   5.047   1.441
  496    HB1  ALA  69           HB1      ALA  69  -2.838   7.263   0.851
  497    HB2  ALA  69           HB2      ALA  69  -1.155   7.410   0.348
  498    HB3  ALA  69           HB3      ALA  69  -1.567   7.432   2.063
  499    H    LEU  70           H        LEU  70  -3.170   4.660  -0.724
  500    HA   LEU  70           HA       LEU  70  -0.883   3.916  -2.509
  501    HB2  LEU  70           HB3      LEU  70  -3.721   2.920  -2.341
  502    HB3  LEU  70           HB2      LEU  70  -2.636   2.497  -3.654
  503    HG   LEU  70           HG       LEU  70  -1.546   2.128  -0.924
  504   HD11  LEU  70          HD11      LEU  70  -3.855   0.508  -2.019
  505   HD12  LEU  70          HD12      LEU  70  -3.732   1.288  -0.442
  506   HD13  LEU  70          HD13      LEU  70  -2.745  -0.127  -0.806
  507   HD21  LEU  70          HD21      LEU  70  -1.661   0.155  -3.205
  508   HD22  LEU  70          HD22      LEU  70  -0.433   0.312  -1.949
  509   HD23  LEU  70          HD23      LEU  70  -0.535   1.511  -3.237
  510    H    LEU  71           H        LEU  71  -0.698   5.023  -4.447
  511    HA   LEU  71           HA       LEU  71  -2.867   6.980  -5.093
  512    HB2  LEU  71           HB3      LEU  71   0.045   6.927  -5.935
  513    HB3  LEU  71           HB2      LEU  71  -1.116   8.184  -6.350
  514    HG   LEU  71           HG       LEU  71  -0.762   7.485  -3.458
  515   HD11  LEU  71          HD11      LEU  71   1.136   9.243  -5.037
  516   HD12  LEU  71          HD12      LEU  71   1.546   7.688  -4.313
  517   HD13  LEU  71          HD13      LEU  71   1.127   9.059  -3.284
  518   HD21  LEU  71          HD21      LEU  71  -2.463   9.123  -4.152
  519   HD22  LEU  71          HD22      LEU  71  -1.230  10.070  -4.983
  520   HD23  LEU  71          HD23      LEU  71  -1.191   9.917  -3.226
  521    H    GLU  72           H        GLU  72  -2.989   7.431  -7.550
  522    HA   GLU  72           HA       GLU  72  -3.003   4.807  -8.990
  523    HB2  GLU  72           HB3      GLU  72  -4.598   6.333 -10.514
  524    HB3  GLU  72           HB2      GLU  72  -5.204   5.457  -9.110
  525    HG2  GLU  72           HG3      GLU  72  -5.891   7.880  -9.173
  526    HG3  GLU  72           HG2      GLU  72  -5.007   7.425  -7.716
  527    H    ARG  73           H        ARG  73  -0.886   7.161  -8.743
  528    HA   ARG  73           HA       ARG  73   0.876   7.741 -10.195
  529    HB2  ARG  73           HB3      ARG  73  -0.126   5.646 -11.566
  530    HB3  ARG  73           HB2      ARG  73  -0.582   6.945 -12.665
  531    HG2  ARG  73           HG3      ARG  73   1.895   7.745 -12.301
  532    HG3  ARG  73           HG2      ARG  73   2.161   6.074 -11.801
  533    HD2  ARG  73           HD3      ARG  73   2.580   5.982 -14.107
  534    HD3  ARG  73           HD2      ARG  73   0.894   5.476 -14.008
  535    HE   ARG  73           HE       ARG  73   0.715   8.211 -14.336
  536   HH11  ARG  73          HH22      ARG  73   2.353   5.630 -15.931
  537   HH12  ARG  73          HH21      ARG  73   2.303   6.384 -17.489
  538   HH21  ARG  73          HH11      ARG  73   0.640   9.210 -16.362
  539   HH22  ARG  73          HH12      ARG  73   1.332   8.410 -17.734
  540    H    GLY  74           H        GLY  74  -1.395   9.385  -9.427
  541    HA2  GLY  74           HA3      GLY  74  -1.073  11.476 -11.474
  542    HA3  GLY  74           HA2      GLY  74  -2.728  10.918 -11.220
  543    H    GLY  75           H        GLY  75  -1.363  10.464  -8.313
  544    HA2  GLY  75           HA3      GLY  75  -0.899  11.974  -6.472
  545    HA3  GLY  75           HA2      GLY  75  -1.663  13.275  -7.382
  546    H    LEU  76           H        LEU  76  -3.680  10.782  -7.904
  547    HA   LEU  76           HA       LEU  76  -5.578  11.731  -5.878
  548    HB2  LEU  76           HB3      LEU  76  -5.725  10.377  -8.410
  549    HB3  LEU  76           HB2      LEU  76  -6.573   9.415  -7.199
  550    HG   LEU  76           HG       LEU  76  -7.007  12.385  -7.620
  551   HD11  LEU  76          HD11      LEU  76  -8.131   9.999  -8.947
  552   HD12  LEU  76          HD12      LEU  76  -8.107  11.679  -9.484
  553   HD13  LEU  76          HD13      LEU  76  -9.336  11.137  -8.340
  554   HD21  LEU  76          HD21      LEU  76  -9.160  10.933  -6.367
  555   HD22  LEU  76          HD22      LEU  76  -8.215  12.276  -5.720
  556   HD23  LEU  76          HD23      LEU  76  -7.658  10.617  -5.497
  557    H    THR  77           H        THR  77  -6.236  10.563  -4.059
  558    HA   THR  77           HA       THR  77  -4.500   8.281  -3.322
  559    HB   THR  77           HB       THR  77  -6.529   9.021  -1.369
  560    HG1  THR  77           HG1      THR  77  -4.833  11.068  -1.371
  561   HG21  THR  77          HG21      THR  77  -3.526   9.332  -1.255
  562   HG22  THR  77          HG22      THR  77  -4.337   7.781  -1.038
  563   HG23  THR  77          HG23      THR  77  -4.638   9.100   0.094
  564    H    LEU  78           H        LEU  78  -5.215   6.215  -3.387
  565    HA   LEU  78           HA       LEU  78  -8.046   5.750  -4.148
  566    HB2  LEU  78           HB3      LEU  78  -5.823   3.705  -3.979
  567    HB3  LEU  78           HB2      LEU  78  -7.361   3.541  -4.802
  568    HG   LEU  78           HG       LEU  78  -5.504   5.762  -5.609
  569   HD11  LEU  78          HD11      LEU  78  -5.369   2.898  -6.594
  570   HD12  LEU  78          HD12      LEU  78  -4.144   3.689  -5.603
  571   HD13  LEU  78          HD13      LEU  78  -4.455   4.258  -7.242
  572   HD21  LEU  78          HD21      LEU  78  -8.012   5.128  -6.390
  573   HD22  LEU  78          HD22      LEU  78  -7.098   4.114  -7.504
  574   HD23  LEU  78          HD23      LEU  78  -6.835   5.856  -7.480
  575    H    MET  79           H        MET  79  -5.692   4.691  -1.676
  576    HA   MET  79           HA       MET  79  -7.954   4.251   0.170
  577    HB2  MET  79           HB3      MET  79  -7.550   2.102  -1.121
  578    HB3  MET  79           HB2      MET  79  -5.973   2.022  -0.342
  579    HG2  MET  79           HG3      MET  79  -7.385   0.725   1.054
  580    HG3  MET  79           HG2      MET  79  -7.256   2.277   1.880
  581    HE1  MET  79           HE1      MET  79 -10.872   0.207   0.186
  582    HE2  MET  79           HE2      MET  79  -9.550  -0.402   1.190
  583    HE3  MET  79           HE3      MET  79  -9.255   0.036  -0.490
  584    H    LEU  80           H        LEU  80  -7.375   4.594   2.280
  585    HA   LEU  80           HA       LEU  80  -4.509   5.262   2.798
  586    HB2  LEU  80           HB3      LEU  80  -5.931   7.150   3.225
  587    HB3  LEU  80           HB2      LEU  80  -7.094   6.156   4.100
  588    HG   LEU  80           HG       LEU  80  -5.558   5.832   5.930
  589   HD11  LEU  80          HD11      LEU  80  -3.564   7.034   4.011
  590   HD12  LEU  80          HD12      LEU  80  -3.450   5.523   4.912
  591   HD13  LEU  80          HD13      LEU  80  -3.279   7.062   5.752
  592   HD21  LEU  80          HD21      LEU  80  -5.179   8.157   6.649
  593   HD22  LEU  80          HD22      LEU  80  -6.758   7.996   5.880
  594   HD23  LEU  80          HD23      LEU  80  -5.413   8.714   4.992
  595    H    LEU  81           H        LEU  81  -3.630   3.326   3.479
  596    HA   LEU  81           HA       LEU  81  -5.085   1.525   5.266
  597    HB2  LEU  81           HB3      LEU  81  -2.495   1.540   3.845
  598    HB3  LEU  81           HB2      LEU  81  -2.450   0.750   5.420
  599    HG   LEU  81           HG       LEU  81  -4.385  -0.649   4.769
  600   HD11  LEU  81          HD11      LEU  81  -5.709   0.160   3.130
  601   HD12  LEU  81          HD12      LEU  81  -4.472  -0.372   1.989
  602   HD13  LEU  81          HD13      LEU  81  -4.464   1.286   2.590
  603   HD21  LEU  81          HD21      LEU  81  -2.161  -0.702   2.702
  604   HD22  LEU  81          HD22      LEU  81  -3.205  -2.052   3.147
  605   HD23  LEU  81          HD23      LEU  81  -2.050  -1.407   4.314
  606    H    GLY  82           H        GLY  82  -5.257   1.913   7.446
  607    HA2  GLY  82           HA3      GLY  82  -3.381   3.871   8.657
  608    HA3  GLY  82           HA2      GLY  82  -4.911   3.346   9.350
  609    H    ARG  83           H        ARG  83  -1.966   3.313  10.281
  610    HA   ARG  83           HA       ARG  83  -1.291   0.519  10.621
  611    HB2  ARG  83           HB3      ARG  83   0.348   2.417  10.801
  612    HB3  ARG  83           HB2      ARG  83  -0.437   2.900  12.301
  613    HG2  ARG  83           HG3      ARG  83   0.190   0.063  12.347
  614    HG3  ARG  83           HG2      ARG  83   1.636   1.016  12.011
  615    HD2  ARG  83           HD3      ARG  83   1.380   0.771  14.427
  616    HD3  ARG  83           HD2      ARG  83   1.110   2.453  13.980
  617    HE   ARG  83           HE       ARG  83  -1.321   0.807  14.126
  618   HH11  ARG  83          HH22      ARG  83   0.913   2.916  15.699
  619   HH12  ARG  83          HH21      ARG  83  -0.225   3.441  16.894
  620   HH21  ARG  83          HH11      ARG  83  -2.813   1.482  15.680
  621   HH22  ARG  83          HH12      ARG  83  -2.332   2.630  16.884
  622    H    GLN  84           H        GLN  84  -2.243  -0.890  12.051
  623    HA   GLN  84           HA       GLN  84  -3.987   0.270  14.178
  624    HB2  GLN  84           HB3      GLN  84  -5.359  -0.992  12.766
  625    HB3  GLN  84           HB2      GLN  84  -4.104  -2.187  12.458
  626    HG2  GLN  84           HG3      GLN  84  -6.027  -2.917  13.973
  627    HG3  GLN  84           HG2      GLN  84  -4.401  -3.202  14.586
  628   HE21  GLN  84          HE22      GLN  84  -4.667  -2.892  16.835
  629   HE22  GLN  84          HE21      GLN  84  -5.316  -1.488  17.532
  630    H    GLY  85           H        GLY  85  -1.454  -2.133  13.513
  631    HA2  GLY  85           HA3      GLY  85  -0.849  -2.159  16.415
  632    HA3  GLY  85           HA2      GLY  85  -1.210  -3.711  15.664
  633    H    GLU  86           H        GLU  86   0.703  -0.899  14.548
  634    HA   GLU  86           HA       GLU  86   2.856  -0.845  13.599
  635    HB2  GLU  86           HB3      GLU  86   3.154  -1.402  16.142
  636    HB3  GLU  86           HB2      GLU  86   3.614  -2.999  15.553
  637    HG2  GLU  86           HG3      GLU  86   5.099  -1.500  13.886
  638    HG3  GLU  86           HG2      GLU  86   5.024  -0.393  15.259
  639    H    GLY  87           H        GLY  87   2.761  -1.726  11.547
  640    HA2  GLY  87           HA3      GLY  87   3.617  -3.351  10.002
  641    HA3  GLY  87           HA2      GLY  87   3.641  -4.540  11.304
  642    H    ASP  88           H        ASP  88   0.833  -3.649  12.054
  643    HA   ASP  88           HA       ASP  88  -0.583  -5.232   9.944
  644    HB2  ASP  88           HB3      ASP  88  -0.595  -5.333  12.840
  645    HB3  ASP  88           HB2      ASP  88  -2.222  -5.036  12.221
  646    H    TYR  89           H        TYR  89  -1.333  -3.649   8.564
  647    HA   TYR  89           HA       TYR  89  -2.762  -1.310   9.735
  648    HB2  TYR  89           HB3      TYR  89  -1.981  -1.833   6.861
  649    HB3  TYR  89           HB2      TYR  89  -2.645  -0.347   7.477
  650    HD1  TYR  89           HD1      TYR  89   0.246  -2.676   8.047
  651    HD2  TYR  89           HD2      TYR  89  -1.187   1.374   8.099
  652    HE1  TYR  89           HE1      TYR  89   2.531  -1.874   8.555
  653    HE2  TYR  89           HE2      TYR  89   1.104   2.172   8.608
  654    HH   TYR  89           HH       TYR  89   3.821   0.341   8.200
  655    H    ARG  90           H        ARG  90  -4.978  -1.024   9.292
  656    HA   ARG  90           HA       ARG  90  -6.275  -3.100   7.594
  657    HB2  ARG  90           HB3      ARG  90  -7.549  -2.128  10.149
  658    HB3  ARG  90           HB2      ARG  90  -7.930  -3.572   9.212
  659    HG2  ARG  90           HG3      ARG  90  -5.796  -4.588   9.861
  660    HG3  ARG  90           HG2      ARG  90  -5.345  -3.130  10.731
  661    HD2  ARG  90           HD3      ARG  90  -6.187  -4.631  12.383
  662    HD3  ARG  90           HD2      ARG  90  -7.470  -3.452  12.106
  663    HE   ARG  90           HE       ARG  90  -8.120  -5.451  10.346
  664   HH11  ARG  90          HH22      ARG  90  -7.255  -5.341  13.681
  665   HH12  ARG  90          HH21      ARG  90  -8.198  -6.730  14.109
  666   HH21  ARG  90          HH11      ARG  90  -9.353  -7.268  10.883
  667   HH22  ARG  90          HH12      ARG  90  -9.385  -7.821  12.524
  668    H    VAL  91           H        VAL  91  -8.144  -2.375   6.526
  669    HA   VAL  91           HA       VAL  91  -8.812   0.524   6.830
  670    HB   VAL  91           HB       VAL  91  -7.295   0.184   4.874
  671   HG11  VAL  91          HG11      VAL  91  -7.716  -1.345   3.216
  672   HG12  VAL  91          HG12      VAL  91  -9.466  -1.219   3.398
  673   HG13  VAL  91          HG13      VAL  91  -8.528  -2.184   4.538
  674   HG21  VAL  91          HG21      VAL  91  -8.440   1.920   4.006
  675   HG22  VAL  91          HG22      VAL  91  -9.860   1.452   4.941
  676   HG23  VAL  91          HG23      VAL  91  -9.616   0.799   3.322
  677    H    GLN  92           H        GLN  92 -10.893   0.468   7.537
  678    HA   GLN  92           HA       GLN  92 -12.726  -1.655   7.221
  679    HB2  GLN  92           HB3      GLN  92 -13.344   1.308   7.450
  680    HB3  GLN  92           HB2      GLN  92 -14.473  -0.005   7.778
  681    HG2  GLN  92           HG3      GLN  92 -13.716   0.352   9.924
  682    HG3  GLN  92           HG2      GLN  92 -12.488  -0.795   9.390
  683   HE21  GLN  92          HE22      GLN  92 -13.066   2.564  10.248
  684   HE22  GLN  92          HE21      GLN  92 -11.449   3.068  10.133
  685    H    LYS  93           H        LYS  93 -13.432  -2.479   5.313
  686    HA   LYS  93           HA       LYS  93 -13.475  -0.812   2.895
  687    HB2  LYS  93           HB3      LYS  93 -12.857  -3.345   3.099
  688    HB3  LYS  93           HB2      LYS  93 -14.601  -3.597   3.068
  689    HG2  LYS  93           HG3      LYS  93 -14.763  -2.386   0.940
  690    HG3  LYS  93           HG2      LYS  93 -13.026  -2.071   0.973
  691    HD2  LYS  93           HD3      LYS  93 -12.493  -4.205   0.357
  692    HD3  LYS  93           HD2      LYS  93 -13.822  -4.911   1.278
  693    HE2  LYS  93           HE3      LYS  93 -14.047  -5.093  -1.246
  694    HE3  LYS  93           HE2      LYS  93 -15.416  -4.343  -0.424
  695    HZ1  LYS  93           HZ1      LYS  93 -14.740  -2.224  -1.084
  696    HZ2  LYS  93           HZ2      LYS  93 -14.524  -3.178  -2.471
  697    HZ3  LYS  93           HZ3      LYS  93 -13.183  -2.745  -1.522
  698    H    GLY  94           H        GLY  94 -15.643  -1.578   5.412
  699    HA2  GLY  94           HA3      GLY  94 -17.798  -0.539   5.643
  700    HA3  GLY  94           HA2      GLY  94 -17.843  -0.298   3.897
  701    H    ASP  95           H        ASP  95 -17.831  -2.488   2.634
  702    HA   ASP  95           HA       ASP  95 -20.202  -3.891   3.149
  703    HB2  ASP  95           HB3      ASP  95 -18.956  -5.793   1.816
  704    HB3  ASP  95           HB2      ASP  95 -19.342  -4.271   1.012
  705    H    GLY  96           H        GLY  96 -17.472  -6.046   3.164
  706    HA2  GLY  96           HA3      GLY  96 -17.586  -6.534   6.053
  707    HA3  GLY  96           HA2      GLY  96 -18.303  -7.817   5.076
  708    H    GLY  97           H        GLY  97 -15.901  -6.339   3.295
  709    HA2  GLY  97           HA3      GLY  97 -14.057  -8.601   3.835
  710    HA3  GLY  97           HA2      GLY  97 -13.987  -7.532   2.431
  711    H    GLN  98           H        GLN  98 -12.391  -8.294   5.183
  712    HA   GLN  98           HA       GLN  98 -11.448  -5.510   5.697
  713    HB2  GLN  98           HB3      GLN  98 -12.270  -7.205   7.551
  714    HB3  GLN  98           HB2      GLN  98 -10.642  -7.861   7.372
  715    HG2  GLN  98           HG3      GLN  98  -9.700  -5.607   7.761
  716    HG3  GLN  98           HG2      GLN  98 -11.333  -4.974   7.976
  717   HE21  GLN  98          HE22      GLN  98 -10.464  -4.407  10.233
  718   HE22  GLN  98          HE21      GLN  98 -10.525  -5.608  11.429
  719    H    LEU  99           H        LEU  99  -9.582  -4.940   4.796
  720    HA   LEU  99           HA       LEU  99  -7.804  -7.023   3.691
  721    HB2  LEU  99           HB3      LEU  99  -7.486  -4.022   3.534
  722    HB3  LEU  99           HB2      LEU  99  -6.762  -5.235   2.490
  723    HG   LEU  99           HG       LEU  99  -9.718  -4.642   2.715
  724   HD11  LEU  99          HD11      LEU  99  -8.648  -4.356   0.078
  725   HD12  LEU  99          HD12      LEU  99  -7.636  -3.426   1.185
  726   HD13  LEU  99          HD13      LEU  99  -9.370  -3.114   1.100
  727   HD21  LEU  99          HD21      LEU  99  -9.546  -6.162   0.537
  728   HD22  LEU  99          HD22      LEU  99  -9.708  -6.885   2.137
  729   HD23  LEU  99          HD23      LEU  99  -8.123  -6.787   1.371
  730    H    VAL 100           H        VAL 100  -5.612  -7.221   4.343
  731    HA   VAL 100           HA       VAL 100  -4.757  -5.621   6.708
  732    HB   VAL 100           HB       VAL 100  -4.734  -8.649   6.559
  733   HG11  VAL 100          HG11      VAL 100  -3.427  -6.652   8.375
  734   HG12  VAL 100          HG12      VAL 100  -2.797  -8.178   7.755
  735   HG13  VAL 100          HG13      VAL 100  -3.992  -8.179   9.054
  736   HG21  VAL 100          HG21      VAL 100  -6.197  -8.406   8.592
  737   HG22  VAL 100          HG22      VAL 100  -6.941  -7.797   7.114
  738   HG23  VAL 100          HG23      VAL 100  -6.255  -6.672   8.285
  739    H    LEU 101           H        LEU 101  -2.878  -4.707   6.025
  740    HA   LEU 101           HA       LEU 101  -1.103  -6.223   4.175
  741    HB2  LEU 101           HB3      LEU 101  -1.703  -3.799   3.736
  742    HB3  LEU 101           HB2      LEU 101  -0.824  -3.397   5.193
  743    HG   LEU 101           HG       LEU 101   0.815  -5.083   3.544
  744   HD11  LEU 101          HD11      LEU 101  -0.337  -2.575   2.287
  745   HD12  LEU 101          HD12      LEU 101  -0.407  -4.214   1.639
  746   HD13  LEU 101          HD13      LEU 101   1.135  -3.364   1.720
  747   HD21  LEU 101          HD21      LEU 101   1.081  -2.166   4.325
  748   HD22  LEU 101          HD22      LEU 101   2.388  -3.253   3.860
  749   HD23  LEU 101          HD23      LEU 101   1.518  -3.517   5.372
  750    H    ARG 102           H        ARG 102   0.506  -7.469   5.188
  751    HA   ARG 102           HA       ARG 102   1.917  -6.231   7.473
  752    HB2  ARG 102           HB3      ARG 102   0.079  -7.754   8.337
  753    HB3  ARG 102           HB2      ARG 102   0.926  -9.089   7.556
  754    HG2  ARG 102           HG3      ARG 102   2.989  -8.431   8.856
  755    HG3  ARG 102           HG2      ARG 102   1.986  -7.284   9.746
  756    HD2  ARG 102           HD3      ARG 102   0.608  -9.046  10.626
  757    HD3  ARG 102           HD2      ARG 102   1.345 -10.238   9.555
  758    HE   ARG 102           HE       ARG 102   3.278  -8.950  11.314
  759   HH11  ARG 102          HH22      ARG 102   0.904 -11.420  10.940
  760   HH12  ARG 102          HH21      ARG 102   1.594 -12.453  12.147
  761   HH21  ARG 102          HH11      ARG 102   4.195 -10.285  12.892
  762   HH22  ARG 102          HH12      ARG 102   3.456 -11.810  13.253
  763    H    ARG 103           H        ARG 103   4.076  -6.706   7.450
  764    HA   ARG 103           HA       ARG 103   5.465  -7.460   5.200
  765    HB2  ARG 103           HB3      ARG 103   6.827  -8.614   7.475
  766    HB3  ARG 103           HB2      ARG 103   7.244  -7.173   6.548
  767    HG2  ARG 103           HG3      ARG 103   5.611  -5.862   7.874
  768    HG3  ARG 103           HG2      ARG 103   5.242  -7.302   8.822
  769    HD2  ARG 103           HD3      ARG 103   8.032  -6.154   8.571
  770    HD3  ARG 103           HD2      ARG 103   6.930  -5.736   9.885
  771    HE   ARG 103           HE       ARG 103   6.960  -8.491   9.954
  772   HH11  ARG 103          HH22      ARG 103   9.351  -6.008   9.869
  773   HH12  ARG 103          HH21      ARG 103  10.516  -6.914  10.774
  774   HH21  ARG 103          HH11      ARG 103   8.469  -9.687  11.139
  775   HH22  ARG 103          HH12      ARG 103  10.016  -8.996  11.494
  776    H    ALA 104           H        ALA 104   5.483  -9.287   3.995
  777    HA   ALA 104           HA       ALA 104   4.103 -11.644   4.525
  778    HB1  ALA 104           HB1      ALA 104   5.284 -12.626   2.732
  779    HB2  ALA 104           HB2      ALA 104   6.750 -11.709   3.079
  780    HB3  ALA 104           HB3      ALA 104   5.351 -10.900   2.374
  781    H    THR 105           H        THR 105   4.301 -12.843   6.351
  782    HA   THR 105           HA       THR 105   7.040 -13.716   7.167
  783    HB   THR 105           HB       THR 105   6.341 -11.970   8.735
  784    HG1  THR 105           HG1      THR 105   6.110 -14.621   9.703
  785   HG21  THR 105          HG21      THR 105   4.185 -11.689   9.302
  786   HG22  THR 105          HG22      THR 105   4.107 -13.323   9.961
  787   HG23  THR 105          HG23      THR 105   3.773 -13.043   8.251
  788    HA   PRO 106           HA       PRO 106   3.797 -17.131   6.733
  789    HB2  PRO 106           HB2      PRO 106   5.059 -18.511   4.727
  790    HB3  PRO 106           HB3      PRO 106   3.842 -17.255   4.439
  791    HG2  PRO 106           HG3      PRO 106   6.804 -17.097   4.261
  792    HG3  PRO 106           HG2      PRO 106   5.567 -16.334   3.249
  793    HD2  PRO 106           HD3      PRO 106   6.937 -14.993   5.211
  794    HD3  PRO 106           HD2      PRO 106   5.296 -14.551   4.689
  Start of MODEL    7
    1    H1   SER   1           H        SER   1   6.969  25.431  -4.322
    2    H2   SER   1           H2       SER   1   5.788  25.580  -3.111
    3    H3   SER   1           1HT      SER   1   7.216  24.710  -2.807
    4    HA   SER   1           HA       SER   1   4.907  23.569  -3.497
    5    HB2  SER   1           HB3      SER   1   6.533  23.945  -6.031
    6    HB3  SER   1           HB2      SER   1   5.120  22.905  -5.865
    7    HG   SER   1           HG       SER   1   4.225  25.089  -4.989
    8    H    SER   2           H        SER   2   7.601  23.411  -2.180
    9    HA   SER   2           HA       SER   2   9.164  21.754  -1.609
   10    HB2  SER   2           HB3      SER   2   7.210  19.789  -2.810
   11    HB3  SER   2           HB2      SER   2   8.311  19.544  -1.457
   12    HG   SER   2           HG       SER   2   6.457  21.613  -1.256
   13    H    LEU   3           H        LEU   3  10.240  19.623  -2.692
   14    HA   LEU   3           HA       LEU   3  10.309  19.486  -5.557
   15    HB2  LEU   3           HB3      LEU   3  11.797  21.642  -4.399
   16    HB3  LEU   3           HB2      LEU   3  12.940  20.459  -5.038
   17    HG   LEU   3           HG       LEU   3  10.587  21.581  -6.588
   18   HD11  LEU   3          HD11      LEU   3  13.514  22.326  -6.492
   19   HD12  LEU   3          HD12      LEU   3  12.110  23.384  -6.348
   20   HD13  LEU   3          HD13      LEU   3  12.518  22.668  -7.907
   21   HD21  LEU   3          HD21      LEU   3  12.704  20.486  -8.183
   22   HD22  LEU   3          HD22      LEU   3  11.034  19.933  -8.059
   23   HD23  LEU   3          HD23      LEU   3  12.258  19.297  -6.961
   24    H    ILE   4           H        ILE   4  12.476  19.246  -2.715
   25    HA   ILE   4           HA       ILE   4  13.714  16.815  -3.777
   26    HB   ILE   4           HB       ILE   4  14.646  16.822  -1.307
   27   HG12  ILE   4          HG13      ILE   4  13.868  19.729  -1.588
   28   HG13  ILE   4          HG12      ILE   4  12.852  18.584  -0.710
   29   HG21  ILE   4          HG21      ILE   4  16.193  17.297  -2.994
   30   HG22  ILE   4          HG22      ILE   4  16.181  18.809  -2.087
   31   HG23  ILE   4          HG23      ILE   4  15.267  18.675  -3.590
   32   HD11  ILE   4          HD11      ILE   4  14.331  18.392   1.023
   33   HD12  ILE   4          HD12      ILE   4  14.859  19.979   0.462
   34   HD13  ILE   4          HD13      ILE   4  15.739  18.530  -0.029
   35    H    LEU   5           H        LEU   5  13.255  14.710  -3.145
   36    HA   LEU   5           HA       LEU   5  10.736  14.340  -1.631
   37    HB2  LEU   5           HB3      LEU   5  12.241  12.830  -3.664
   38    HB3  LEU   5           HB2      LEU   5  11.584  11.822  -2.376
   39    HG   LEU   5           HG       LEU   5  10.017  12.138  -4.321
   40   HD11  LEU   5          HD11      LEU   5   9.486  12.363  -1.523
   41   HD12  LEU   5          HD12      LEU   5   8.429  11.731  -2.786
   42   HD13  LEU   5          HD13      LEU   5   8.380  13.443  -2.372
   43   HD21  LEU   5          HD21      LEU   5   9.392  14.203  -5.048
   44   HD22  LEU   5          HD22      LEU   5  10.854  14.746  -4.227
   45   HD23  LEU   5          HD23      LEU   5   9.294  14.853  -3.411
   46    H    LEU   6           H        LEU   6  10.753  12.372  -0.090
   47    HA   LEU   6           HA       LEU   6  13.079  12.697   1.724
   48    HB2  LEU   6           HB3      LEU   6  10.292  11.591   2.036
   49    HB3  LEU   6           HB2      LEU   6  11.540  11.236   3.232
   50    HG   LEU   6           HG       LEU   6  11.903  13.618   3.618
   51   HD11  LEU   6          HD11      LEU   6  11.552  14.641   1.525
   52   HD12  LEU   6          HD12      LEU   6  10.171  15.185   2.478
   53   HD13  LEU   6          HD13      LEU   6   9.978  13.876   1.313
   54   HD21  LEU   6          HD21      LEU   6   9.588  14.218   4.451
   55   HD22  LEU   6          HD22      LEU   6  10.161  12.634   4.971
   56   HD23  LEU   6          HD23      LEU   6   8.994  12.761   3.655
   57    H    SER   7           H        SER   7  14.365  10.934   2.371
   58    HA   SER   7           HA       SER   7  14.289   8.617   0.520
   59    HB2  SER   7           HB3      SER   7  16.427   9.899   0.988
   60    HB3  SER   7           HB2      SER   7  16.365   9.263   2.629
   61    HG   SER   7           HG       SER   7  16.823   7.957   0.195
   62    H    ALA   8           H        ALA   8  12.469   7.511   1.462
   63    HA   ALA   8           HA       ALA   8  12.738   6.637   4.283
   64    HB1  ALA   8           HB1      ALA   8  10.472   5.902   4.117
   65    HB2  ALA   8           HB2      ALA   8  10.522   5.921   2.354
   66    HB3  ALA   8           HB3      ALA   8  10.534   7.438   3.252
   67    H    SER   9           H        SER   9  14.709   5.342   3.628
   68    HA   SER   9           HA       SER   9  14.217   2.970   1.972
   69    HB2  SER   9           HB3      SER   9  16.642   3.265   3.704
   70    HB3  SER   9           HB2      SER   9  16.505   2.596   2.080
   71    HG   SER   9           HG       SER   9  16.062   4.766   1.375
   72    H    ASP  10           H        ASP  10  13.900   3.836   5.277
   73    HA   ASP  10           HA       ASP  10  14.344   1.214   6.423
   74    HB2  ASP  10           HB3      ASP  10  12.561   3.362   7.583
   75    HB3  ASP  10           HB2      ASP  10  13.494   2.138   8.444
   76    H    LEU  11           H        LEU  11  11.679   2.746   4.791
   77    HA   LEU  11           HA       LEU  11   9.801   0.618   5.682
   78    HB2  LEU  11           HB3      LEU  11   9.474   3.246   4.243
   79    HB3  LEU  11           HB2      LEU  11   8.193   2.033   4.210
   80    HG   LEU  11           HG       LEU  11   9.363   2.603   6.876
   81   HD11  LEU  11          HD11      LEU  11   7.963   4.643   7.134
   82   HD12  LEU  11          HD12      LEU  11   7.597   4.587   5.410
   83   HD13  LEU  11          HD13      LEU  11   9.251   4.870   5.950
   84   HD21  LEU  11          HD21      LEU  11   6.507   2.410   5.866
   85   HD22  LEU  11          HD22      LEU  11   7.034   2.333   7.547
   86   HD23  LEU  11          HD23      LEU  11   7.457   1.036   6.430
   87    H    ALA  12           H        ALA  12  10.400  -1.209   4.514
   88    HA   ALA  12           HA       ALA  12   9.533  -1.444   1.804
   89    HB1  ALA  12           HB1      ALA  12  12.317  -1.969   1.444
   90    HB2  ALA  12           HB2      ALA  12  12.161  -0.342   2.109
   91    HB3  ALA  12           HB3      ALA  12  11.323  -0.769   0.617
   92    H    GLY  13           H        GLY  13  10.211  -3.639   0.897
   93    HA2  GLY  13           HA3      GLY  13  11.532  -5.730   1.813
   94    HA3  GLY  13           HA2      GLY  13  10.409  -5.567   3.159
   95    H    GLN  14           H        GLN  14   9.245  -7.465   2.818
   96    HA   GLN  14           HA       GLN  14   7.743  -7.648   0.236
   97    HB2  GLN  14           HB3      GLN  14   8.263  -9.958   2.111
   98    HB3  GLN  14           HB2      GLN  14   7.785 -10.011   0.414
   99    HG2  GLN  14           HG3      GLN  14  10.093  -8.654   0.155
  100    HG3  GLN  14           HG2      GLN  14  10.474  -9.573   1.611
  101   HE21  GLN  14          HE22      GLN  14  10.954  -9.772  -1.603
  102   HE22  GLN  14          HE21      GLN  14  10.849 -11.452  -1.836
  103    H    TRP  15           H        TRP  15   5.491  -8.058   0.435
  104    HA   TRP  15           HA       TRP  15   4.369  -8.291   3.158
  105    HB2  TRP  15           HB3      TRP  15   3.655  -6.017   1.287
  106    HB3  TRP  15           HB2      TRP  15   2.824  -6.386   2.787
  107    HD1  TRP  15           HD1      TRP  15   6.392  -5.416   1.585
  108    HE1  TRP  15           HE1      TRP  15   7.515  -4.070   3.471
  109    HE3  TRP  15           HE3      TRP  15   2.755  -5.693   5.164
  110    HZ2  TRP  15           HZ2      TRP  15   6.951  -3.215   6.140
  111    HZ3  TRP  15           HZ3      TRP  15   3.075  -4.600   7.367
  112    HH2  TRP  15           HH2      TRP  15   5.167  -3.361   7.858
  113    H    THR  16           H        THR  16   1.844  -8.363   2.897
  114    HA   THR  16           HA       THR  16   1.026  -9.523   0.292
  115    HB   THR  16           HB       THR  16  -0.063 -11.371   1.988
  116    HG1  THR  16           HG1      THR  16   2.026 -10.243   3.241
  117   HG21  THR  16          HG21      THR  16   0.909 -12.068  -0.048
  118   HG22  THR  16          HG22      THR  16   1.909 -12.830   1.188
  119   HG23  THR  16          HG23      THR  16   2.476 -11.378   0.366
  120    H    LEU  17           H        LEU  17  -1.405 -10.015   0.370
  121    HA   LEU  17           HA       LEU  17  -2.776  -8.054   2.185
  122    HB2  LEU  17           HB3      LEU  17  -2.719  -8.139  -0.630
  123    HB3  LEU  17           HB2      LEU  17  -4.304  -8.766  -0.175
  124    HG   LEU  17           HG       LEU  17  -4.592  -6.774   1.327
  125   HD11  LEU  17          HD11      LEU  17  -2.847  -5.417   1.742
  126   HD12  LEU  17          HD12      LEU  17  -2.670  -5.081   0.020
  127   HD13  LEU  17          HD13      LEU  17  -1.831  -6.454   0.742
  128   HD21  LEU  17          HD21      LEU  17  -4.254  -6.569  -1.650
  129   HD22  LEU  17          HD22      LEU  17  -4.645  -5.115  -0.729
  130   HD23  LEU  17          HD23      LEU  17  -5.731  -6.504  -0.689
  131    H    GLN  18           H        GLN  18  -4.983  -8.707   2.845
  132    HA   GLN  18           HA       GLN  18  -5.694 -11.540   2.404
  133    HB2  GLN  18           HB3      GLN  18  -4.135 -11.337   4.444
  134    HB3  GLN  18           HB2      GLN  18  -5.469 -10.491   5.229
  135    HG2  GLN  18           HG3      GLN  18  -6.124 -12.582   5.848
  136    HG3  GLN  18           HG2      GLN  18  -6.766 -12.665   4.207
  137   HE21  GLN  18          HE22      GLN  18  -6.274 -14.776   3.530
  138   HE22  GLN  18          HE21      GLN  18  -4.725 -15.467   3.600
  139    H    GLN  19           H        GLN  19  -7.848 -11.542   2.009
  140    HA   GLN  19           HA       GLN  19  -9.498  -9.281   3.047
  141    HB2  GLN  19           HB3      GLN  19  -9.804  -9.431   0.720
  142    HB3  GLN  19           HB2      GLN  19  -9.781 -11.194   0.736
  143    HG2  GLN  19           HG3      GLN  19 -11.962 -11.342   1.606
  144    HG3  GLN  19           HG2      GLN  19 -11.936  -9.680   2.197
  145   HE21  GLN  19          HE22      GLN  19 -13.492  -8.577   0.980
  146   HE22  GLN  19          HE21      GLN  19 -13.612  -8.636  -0.713
  147    H    ASP  20           H        ASP  20 -10.819  -9.715   4.770
  148    HA   ASP  20           HA       ASP  20 -10.998 -12.249   6.016
  149    HB2  ASP  20           HB3      ASP  20 -11.694  -9.814   6.811
  150    HB3  ASP  20           HB2      ASP  20 -13.291 -10.362   6.297
  151    H    GLU  21           H        GLU  21 -13.157 -10.783   3.583
  152    HA   GLU  21           HA       GLU  21 -15.285 -12.627   3.744
  153    HB2  GLU  21           HB3      GLU  21 -14.284 -10.696   1.784
  154    HB3  GLU  21           HB2      GLU  21 -15.083 -12.078   1.036
  155    HG2  GLU  21           HG3      GLU  21 -16.287 -10.485   3.315
  156    HG3  GLU  21           HG2      GLU  21 -16.636 -10.170   1.614
  157    H    ALA  22           H        ALA  22 -12.064 -13.248   2.875
  158    HA   ALA  22           HA       ALA  22 -12.300 -15.993   2.592
  159    HB1  ALA  22           HB1      ALA  22 -13.140 -14.557   0.141
  160    HB2  ALA  22           HB2      ALA  22 -13.567 -16.174   0.697
  161    HB3  ALA  22           HB3      ALA  22 -12.025 -15.899  -0.112
  162    HA   PRO  23           HA       PRO  23  -7.891 -15.961   2.410
  163    HB2  PRO  23           HB2      PRO  23  -8.148 -17.511  -0.150
  164    HB3  PRO  23           HB3      PRO  23  -7.100 -17.810   1.244
  165    HG2  PRO  23           HG3      PRO  23  -9.374 -19.168   0.831
  166    HG3  PRO  23           HG2      PRO  23  -8.761 -18.798   2.449
  167    HD2  PRO  23           HD3      PRO  23 -11.129 -17.707   1.075
  168    HD3  PRO  23           HD2      PRO  23 -10.714 -17.679   2.803
  169    H    ALA  24           H        ALA  24  -8.246 -16.112  -1.094
  170    HA   ALA  24           HA       ALA  24  -7.276 -14.674  -2.674
  171    HB1  ALA  24           HB1      ALA  24  -8.402 -12.409  -2.608
  172    HB2  ALA  24           HB2      ALA  24  -9.134 -12.899  -1.079
  173    HB3  ALA  24           HB3      ALA  24  -9.509 -13.782  -2.560
  174    H    ILE  25           H        ILE  25  -5.059 -14.755  -1.827
  175    HA   ILE  25           HA       ILE  25  -4.283 -12.333  -0.252
  176    HB   ILE  25           HB       ILE  25  -2.846 -14.971  -0.665
  177   HG12  ILE  25          HG13      ILE  25  -3.404 -14.221   2.067
  178   HG13  ILE  25          HG12      ILE  25  -4.898 -14.203   1.129
  179   HG21  ILE  25          HG21      ILE  25  -1.010 -13.712  -0.231
  180   HG22  ILE  25          HG22      ILE  25  -1.627 -13.646   1.421
  181   HG23  ILE  25          HG23      ILE  25  -1.973 -12.332   0.296
  182   HD11  ILE  25          HD11      ILE  25  -4.434 -16.445   2.099
  183   HD12  ILE  25          HD12      ILE  25  -2.922 -16.503   1.194
  184   HD13  ILE  25          HD13      ILE  25  -4.462 -16.479   0.336
  185    H    CYS  26           H        CYS  26  -3.540 -10.745  -1.571
  186    HA   CYS  26           HA       CYS  26  -2.265 -11.481  -4.152
  187    HB2  CYS  26           HB3      CYS  26  -3.607  -9.071  -3.055
  188    HB3  CYS  26           HB2      CYS  26  -2.265  -8.775  -4.149
  189    H    HIS  27           H        HIS  27  -0.059 -11.711  -4.106
  190    HA   HIS  27           HA       HIS  27   1.583 -10.846  -1.936
  191    HB2  HIS  27           HB3      HIS  27   1.966 -12.092  -4.553
  192    HB3  HIS  27           HB2      HIS  27   3.263 -10.961  -4.164
  193    HD1  HIS  27           HD1      HIS  27   5.135 -12.253  -3.147
  194    HD2  HIS  27           HD2      HIS  27   1.429 -13.612  -1.797
  195    HE1  HIS  27           HE1      HIS  27   5.612 -14.057  -1.432
  196    HE2  HIS  27           HE2      HIS  27   3.365 -14.892  -0.605
  197    H    LEU  28           H        LEU  28   2.541  -8.873  -1.551
  198    HA   LEU  28           HA       LEU  28   2.326  -6.791  -3.696
  199    HB2  LEU  28           HB3      LEU  28   1.250  -6.843  -0.992
  200    HB3  LEU  28           HB2      LEU  28   2.327  -5.474  -1.220
  201    HG   LEU  28           HG       LEU  28  -0.037  -4.939  -1.811
  202   HD11  LEU  28          HD11      LEU  28   2.282  -4.342  -3.257
  203   HD12  LEU  28          HD12      LEU  28   0.739  -3.494  -3.360
  204   HD13  LEU  28          HD13      LEU  28   1.105  -4.799  -4.488
  205   HD21  LEU  28          HD21      LEU  28   0.099  -6.482  -4.327
  206   HD22  LEU  28          HD22      LEU  28  -1.269  -6.190  -3.254
  207   HD23  LEU  28          HD23      LEU  28  -0.103  -7.453  -2.869
  208    H    GLU  29           H        GLU  29   4.100  -5.333  -3.816
  209    HA   GLU  29           HA       GLU  29   6.453  -6.003  -2.088
  210    HB2  GLU  29           HB3      GLU  29   6.157  -6.413  -4.919
  211    HB3  GLU  29           HB2      GLU  29   7.387  -5.181  -4.640
  212    HG2  GLU  29           HG3      GLU  29   8.540  -6.682  -3.058
  213    HG3  GLU  29           HG2      GLU  29   7.305  -7.914  -3.328
  214    H    LEU  30           H        LEU  30   6.918  -4.220  -0.963
  215    HA   LEU  30           HA       LEU  30   6.200  -1.555  -1.972
  216    HB2  LEU  30           HB3      LEU  30   7.138  -2.738   0.593
  217    HB3  LEU  30           HB2      LEU  30   7.587  -1.061   0.293
  218    HG   LEU  30           HG       LEU  30   5.255  -0.450  -0.058
  219   HD11  LEU  30          HD11      LEU  30   4.131  -2.196  -1.057
  220   HD12  LEU  30          HD12      LEU  30   3.617  -2.459   0.609
  221   HD13  LEU  30          HD13      LEU  30   4.933  -3.415  -0.069
  222   HD21  LEU  30          HD21      LEU  30   4.628  -0.493   2.171
  223   HD22  LEU  30          HD22      LEU  30   6.325  -0.945   2.333
  224   HD23  LEU  30          HD23      LEU  30   5.074  -2.189   2.372
  225    H    ARG  31           H        ARG  31   7.581  -1.052  -3.686
  226    HA   ARG  31           HA       ARG  31  10.381  -1.704  -3.725
  227    HB2  ARG  31           HB3      ARG  31   8.500  -0.191  -5.383
  228    HB3  ARG  31           HB2      ARG  31  10.127   0.492  -5.387
  229    HG2  ARG  31           HG3      ARG  31  11.083  -1.632  -6.060
  230    HG3  ARG  31           HG2      ARG  31   9.525  -2.439  -5.876
  231    HD2  ARG  31           HD3      ARG  31   9.812  -2.012  -8.222
  232    HD3  ARG  31           HD2      ARG  31   8.619  -0.853  -7.637
  233    HE   ARG  31           HE       ARG  31  10.176   0.888  -8.039
  234   HH11  ARG  31          HH22      ARG  31  11.611  -2.245  -8.165
  235   HH12  ARG  31          HH21      ARG  31  13.116  -1.675  -8.802
  236   HH21  ARG  31          HH11      ARG  31  12.134   1.650  -8.871
  237   HH22  ARG  31          HH12      ARG  31  13.413   0.530  -9.202
  238    H    ASP  32           H        ASP  32  12.149  -0.031  -3.736
  239    HA   ASP  32           HA       ASP  32  11.667   1.992  -1.586
  240    HB2  ASP  32           HB3      ASP  32  13.455  -0.019  -1.516
  241    HB3  ASP  32           HB2      ASP  32  14.430   1.191  -2.352
  242    H    SER  33           H        SER  33  11.695   1.906  -4.804
  243    HA   SER  33           HA       SER  33  13.654   3.973  -5.425
  244    HB2  SER  33           HB3      SER  33  11.430   2.617  -6.928
  245    HB3  SER  33           HB2      SER  33  12.165   4.076  -7.585
  246    HG   SER  33           HG       SER  33  14.093   2.465  -6.707
  247    H    GLU  34           H        GLU  34  13.067   6.160  -6.128
  248    HA   GLU  34           HA       GLU  34  10.834   7.237  -4.507
  249    HB2  GLU  34           HB3      GLU  34  11.829   9.444  -5.060
  250    HB3  GLU  34           HB2      GLU  34  13.016   8.355  -4.340
  251    HG2  GLU  34           HG3      GLU  34  13.076   7.866  -7.128
  252    HG3  GLU  34           HG2      GLU  34  13.073   9.619  -6.929
  253    H    VAL  35           H        VAL  35   9.175   8.551  -5.447
  254    HA   VAL  35           HA       VAL  35   8.996   8.539  -8.422
  255    HB   VAL  35           HB       VAL  35   6.819   7.565  -6.546
  256   HG11  VAL  35          HG11      VAL  35   5.435   8.271  -8.188
  257   HG12  VAL  35          HG12      VAL  35   6.130   6.994  -9.185
  258   HG13  VAL  35          HG13      VAL  35   6.784   8.629  -9.267
  259   HG21  VAL  35          HG21      VAL  35   8.582   5.896  -6.926
  260   HG22  VAL  35          HG22      VAL  35   8.468   6.150  -8.667
  261   HG23  VAL  35          HG23      VAL  35   7.118   5.431  -7.791
  262    H    ALA  36           H        ALA  36   8.865  10.693  -8.859
  263    HA   ALA  36           HA       ALA  36   7.624  12.540  -6.951
  264    HB1  ALA  36           HB1      ALA  36   9.633  12.817  -8.783
  265    HB2  ALA  36           HB2      ALA  36   8.740  14.168  -8.088
  266    HB3  ALA  36           HB3      ALA  36   8.276  13.522  -9.661
  267    H    GLU  37           H        GLU  37   6.776  11.011 -10.018
  268    HA   GLU  37           HA       GLU  37   4.630  12.637 -10.829
  269    HB2  GLU  37           HB3      GLU  37   5.521  10.618 -12.058
  270    HB3  GLU  37           HB2      GLU  37   4.634   9.606 -10.915
  271    HG2  GLU  37           HG3      GLU  37   3.243   9.887 -12.870
  272    HG3  GLU  37           HG2      GLU  37   2.534  10.851 -11.573
  273    H    ALA  38           H        ALA  38   4.825  10.302  -8.218
  274    HA   ALA  38           HA       ALA  38   2.022  11.007  -7.435
  275    HB1  ALA  38           HB1      ALA  38   2.738   8.530  -8.109
  276    HB2  ALA  38           HB2      ALA  38   1.621   8.826  -6.778
  277    HB3  ALA  38           HB3      ALA  38   3.323   8.506  -6.445
  278    H    SER  39           H        SER  39   5.221  11.436  -6.685
  279    HA   SER  39           HA       SER  39   6.270  12.307  -4.787
  280    HB2  SER  39           HB3      SER  39   5.008  13.709  -3.449
  281    HB3  SER  39           HB2      SER  39   3.908  13.541  -4.813
  282    HG   SER  39           HG       SER  39   3.908  11.941  -2.462
  283    H    GLY  40           H        GLY  40   5.985   9.490  -4.998
  284    HA2  GLY  40           HA3      GLY  40   6.227   8.779  -2.153
  285    HA3  GLY  40           HA2      GLY  40   4.928   7.959  -3.019
  286    H    TYR  41           H        TYR  41   6.000   5.915  -2.758
  287    HA   TYR  41           HA       TYR  41   8.484   5.583  -4.392
  288    HB2  TYR  41           HB3      TYR  41   7.419   3.874  -2.123
  289    HB3  TYR  41           HB2      TYR  41   8.923   3.598  -3.005
  290    HD1  TYR  41           HD1      TYR  41   7.131   6.200  -0.984
  291    HD2  TYR  41           HD2      TYR  41  10.905   4.625  -2.293
  292    HE1  TYR  41           HE1      TYR  41   8.313   7.788   0.507
  293    HE2  TYR  41           HE2      TYR  41  12.088   6.207  -0.795
  294    HH   TYR  41           HH       TYR  41  10.327   8.238   1.486
  295    H    ASP  42           H        ASP  42   8.552   3.719  -5.792
  296    HA   ASP  42           HA       ASP  42   6.143   3.197  -7.189
  297    HB2  ASP  42           HB3      ASP  42   8.419   2.922  -8.144
  298    HB3  ASP  42           HB2      ASP  42   8.636   1.482  -7.155
  299    H    LEU  43           H        LEU  43   5.092   1.118  -7.492
  300    HA   LEU  43           HA       LEU  43   5.061  -0.615  -5.050
  301    HB2  LEU  43           HB3      LEU  43   3.091   0.929  -5.026
  302    HB3  LEU  43           HB2      LEU  43   2.614   0.301  -6.599
  303    HG   LEU  43           HG       LEU  43   2.377  -1.960  -5.637
  304   HD11  LEU  43          HD11      LEU  43   3.543  -0.573  -3.263
  305   HD12  LEU  43          HD12      LEU  43   3.807  -2.218  -3.845
  306   HD13  LEU  43          HD13      LEU  43   2.331  -1.819  -2.965
  307   HD21  LEU  43          HD21      LEU  43   0.262  -1.262  -5.316
  308   HD22  LEU  43          HD22      LEU  43   0.809   0.369  -4.925
  309   HD23  LEU  43          HD23      LEU  43   0.707  -0.856  -3.659
  310    H    GLY  44           H        GLY  44   6.285  -2.221  -6.197
  311    HA2  GLY  44           HA3      GLY  44   5.123  -3.293  -8.698
  312    HA3  GLY  44           HA2      GLY  44   6.659  -3.780  -7.982
  313    H    GLY  45           H        GLY  45   4.692  -5.641  -8.866
  314    HA2  GLY  45           HA3      GLY  45   4.586  -7.724  -7.275
  315    HA3  GLY  45           HA2      GLY  45   3.502  -6.692  -6.348
  316    H    ASP  46           H        ASP  46   1.594  -7.829  -6.670
  317    HA   ASP  46           HA       ASP  46   0.771  -8.463  -9.450
  318    HB2  ASP  46           HB3      ASP  46   0.472  -9.914  -7.192
  319    HB3  ASP  46           HB2      ASP  46  -1.044  -9.011  -7.155
  320    H    THR  47           H        THR  47   0.950  -5.705  -8.354
  321    HA   THR  47           HA       THR  47  -1.284  -4.377  -7.565
  322    HB   THR  47           HB       THR  47  -0.661  -2.503  -9.011
  323    HG1  THR  47           HG1      THR  47   0.990  -2.916 -10.590
  324   HG21  THR  47          HG21      THR  47   0.906  -3.612  -7.110
  325   HG22  THR  47          HG22      THR  47   1.353  -2.146  -7.985
  326   HG23  THR  47          HG23      THR  47   2.004  -3.707  -8.488
  327    H    ALA  48           H        ALA  48  -0.963  -6.068 -10.622
  328    HA   ALA  48           HA       ALA  48  -3.370  -4.967 -11.810
  329    HB1  ALA  48           HB1      ALA  48  -2.817  -6.239 -13.621
  330    HB2  ALA  48           HB2      ALA  48  -2.526  -7.677 -12.641
  331    HB3  ALA  48           HB3      ALA  48  -1.281  -6.436 -12.775
  332    H    CYS  49           H        CYS  49  -3.394  -6.297  -9.026
  333    HA   CYS  49           HA       CYS  49  -5.716  -8.123  -9.548
  334    HB2  CYS  49           HB3      CYS  49  -4.936  -9.648  -8.007
  335    HB3  CYS  49           HB2      CYS  49  -3.381  -8.977  -8.495
  336    H    LEU  50           H        LEU  50  -4.329  -5.538  -7.637
  337    HA   LEU  50           HA       LEU  50  -6.330  -5.404  -5.602
  338    HB2  LEU  50           HB3      LEU  50  -4.669  -3.170  -6.801
  339    HB3  LEU  50           HB2      LEU  50  -5.527  -3.096  -5.265
  340    HG   LEU  50           HG       LEU  50  -3.439  -5.193  -5.891
  341   HD11  LEU  50          HD11      LEU  50  -3.124  -2.533  -4.478
  342   HD12  LEU  50          HD12      LEU  50  -2.353  -3.021  -5.986
  343   HD13  LEU  50          HD13      LEU  50  -1.913  -3.813  -4.475
  344   HD21  LEU  50          HD21      LEU  50  -4.949  -4.341  -3.426
  345   HD22  LEU  50          HD22      LEU  50  -3.367  -5.099  -3.277
  346   HD23  LEU  50          HD23      LEU  50  -4.684  -5.965  -4.058
  347    H    THR  51           H        THR  51  -6.751  -5.071  -8.872
  348    HA   THR  51           HA       THR  51  -8.476  -2.782  -9.029
  349    HB   THR  51           HB       THR  51  -9.180  -4.975 -10.840
  350    HG1  THR  51           HG1      THR  51  -6.983  -4.616 -11.848
  351   HG21  THR  51          HG21      THR  51  -9.624  -2.520 -11.148
  352   HG22  THR  51          HG22      THR  51  -8.779  -3.266 -12.505
  353   HG23  THR  51          HG23      THR  51  -7.887  -2.284 -11.344
  354    H    ARG  52           H        ARG  52  -8.864  -5.308  -7.074
  355    HA   ARG  52           HA       ARG  52 -11.813  -5.556  -7.487
  356    HB2  ARG  52           HB3      ARG  52 -11.701  -7.587  -6.191
  357    HB3  ARG  52           HB2      ARG  52 -10.414  -7.659  -7.395
  358    HG2  ARG  52           HG3      ARG  52  -8.997  -6.508  -5.473
  359    HG3  ARG  52           HG2      ARG  52 -10.218  -7.249  -4.436
  360    HD2  ARG  52           HD3      ARG  52  -8.165  -8.551  -6.177
  361    HD3  ARG  52           HD2      ARG  52  -8.702  -8.993  -4.558
  362    HE   ARG  52           HE       ARG  52 -10.921  -9.432  -6.194
  363   HH11  ARG  52          HH22      ARG  52  -7.624 -10.429  -6.025
  364   HH12  ARG  52          HH21      ARG  52  -7.919 -11.979  -6.741
  365   HH21  ARG  52          HH11      ARG  52 -11.323 -11.449  -7.130
  366   HH22  ARG  52          HH12      ARG  52 -10.013 -12.556  -7.366
  367    H    TRP  53           H        TRP  53  -9.344  -4.336  -5.374
  368    HA   TRP  53           HA       TRP  53 -11.412  -3.675  -3.304
  369    HB2  TRP  53           HB3      TRP  53  -8.394  -3.859  -3.074
  370    HB3  TRP  53           HB2      TRP  53  -9.478  -3.375  -1.772
  371    HD1  TRP  53           HD1      TRP  53 -11.701  -5.381  -1.727
  372    HE1  TRP  53           HE1      TRP  53 -11.319  -7.907  -1.369
  373    HE3  TRP  53           HE3      TRP  53  -6.802  -5.727  -3.090
  374    HZ2  TRP  53           HZ2      TRP  53  -9.203  -9.822  -1.628
  375    HZ3  TRP  53           HZ3      TRP  53  -5.624  -7.902  -3.028
  376    HH2  TRP  53           HH2      TRP  53  -6.814  -9.951  -2.301
  377    H    LEU  54           H        LEU  54  -8.869  -2.456  -5.373
  378    HA   LEU  54           HA       LEU  54  -9.390   0.327  -4.466
  379    HB2  LEU  54           HB3      LEU  54  -7.270  -0.820  -6.309
  380    HB3  LEU  54           HB2      LEU  54  -7.370   0.867  -5.828
  381    HG   LEU  54           HG       LEU  54  -7.070  -1.455  -3.896
  382   HD11  LEU  54          HD11      LEU  54  -4.964   0.614  -4.458
  383   HD12  LEU  54          HD12      LEU  54  -5.091  -0.816  -5.478
  384   HD13  LEU  54          HD13      LEU  54  -4.783  -0.991  -3.753
  385   HD21  LEU  54          HD21      LEU  54  -7.528   1.456  -3.599
  386   HD22  LEU  54          HD22      LEU  54  -6.262   0.777  -2.578
  387   HD23  LEU  54          HD23      LEU  54  -7.902   0.135  -2.494
  388    HA   PRO  55           HA       PRO  55 -11.834   0.959  -8.132
  389    HB2  PRO  55           HB2      PRO  55 -11.615   3.641  -8.520
  390    HB3  PRO  55           HB3      PRO  55 -12.545   2.940  -7.183
  391    HG2  PRO  55           HG3      PRO  55  -9.853   4.178  -7.172
  392    HG3  PRO  55           HG2      PRO  55 -11.127   4.231  -5.945
  393    HD2  PRO  55           HD3      PRO  55  -8.893   2.590  -5.822
  394    HD3  PRO  55           HD2      PRO  55 -10.401   2.307  -4.937
  395    H    SER  56           H        SER  56  -8.481   1.671  -8.129
  396    HA   SER  56           HA       SER  56  -8.381   1.296 -11.058
  397    HB2  SER  56           HB3      SER  56  -7.801   3.417 -11.564
  398    HB3  SER  56           HB2      SER  56  -8.191   3.871  -9.907
  399    HG   SER  56           HG       SER  56  -6.015   3.178  -9.382
  400    H    GLU  57           H        GLU  57  -6.197   0.683 -11.758
  401    HA   GLU  57           HA       GLU  57  -4.857  -0.972  -9.828
  402    HB2  GLU  57           HB3      GLU  57  -4.905  -1.340 -12.329
  403    HB3  GLU  57           HB2      GLU  57  -3.753  -0.013 -12.478
  404    HG2  GLU  57           HG3      GLU  57  -2.294  -1.289 -10.801
  405    HG3  GLU  57           HG2      GLU  57  -3.362  -2.664 -11.083
  406    HA   PRO  58           HA       PRO  58  -2.399   2.467  -8.188
  407    HB2  PRO  58           HB2      PRO  58  -0.757   1.004  -6.547
  408    HB3  PRO  58           HB3      PRO  58  -2.397   1.503  -6.114
  409    HG2  PRO  58           HG3      PRO  58  -1.386  -1.131  -6.970
  410    HG3  PRO  58           HG2      PRO  58  -2.736  -0.724  -5.900
  411    HD2  PRO  58           HD3      PRO  58  -2.999  -1.554  -8.541
  412    HD3  PRO  58           HD2      PRO  58  -4.237  -0.677  -7.621
  413    H    ARG  59           H        ARG  59   0.091   2.711  -7.696
  414    HA   ARG  59           HA       ARG  59   1.912   1.230  -9.406
  415    HB2  ARG  59           HB3      ARG  59   0.559   3.553 -10.466
  416    HB3  ARG  59           HB2      ARG  59   2.296   3.851 -10.366
  417    HG2  ARG  59           HG3      ARG  59   1.070   1.376 -11.613
  418    HG3  ARG  59           HG2      ARG  59   1.578   2.793 -12.531
  419    HD2  ARG  59           HD3      ARG  59   3.724   2.113 -12.490
  420    HD3  ARG  59           HD2      ARG  59   3.688   1.983 -10.732
  421    HE   ARG  59           HE       ARG  59   2.341  -0.266 -11.914
  422   HH11  ARG  59          HH22      ARG  59   5.432   1.162 -11.363
  423   HH12  ARG  59          HH21      ARG  59   6.277  -0.351 -11.358
  424   HH21  ARG  59          HH11      ARG  59   3.428  -2.246 -11.913
  425   HH22  ARG  59          HH12      ARG  59   5.143  -2.279 -11.671
  426    H    ALA  60           H        ALA  60   1.167   3.467  -6.943
  427    HA   ALA  60           HA       ALA  60   3.943   3.417  -6.036
  428    HB1  ALA  60           HB1      ALA  60   2.633   6.123  -6.244
  429    HB2  ALA  60           HB2      ALA  60   3.558   5.474  -7.598
  430    HB3  ALA  60           HB3      ALA  60   4.342   5.738  -6.040
  431    H    TRP  61           H        TRP  61   4.061   4.446  -3.812
  432    HA   TRP  61           HA       TRP  61   1.449   4.639  -2.417
  433    HB2  TRP  61           HB3      TRP  61   2.240   3.075  -0.632
  434    HB3  TRP  61           HB2      TRP  61   1.997   2.274  -2.179
  435    HD1  TRP  61           HD1      TRP  61   4.439   2.342  -3.739
  436    HE1  TRP  61           HE1      TRP  61   6.763   1.601  -2.913
  437    HE3  TRP  61           HE3      TRP  61   3.710   2.641   1.302
  438    HZ2  TRP  61           HZ2      TRP  61   8.126   1.174  -0.436
  439    HZ3  TRP  61           HZ3      TRP  61   5.533   2.042   2.871
  440    HH2  TRP  61           HH2      TRP  61   7.740   1.315   2.010
  441    H    ARG  62           H        ARG  62   1.689   5.758  -0.341
  442    HA   ARG  62           HA       ARG  62   4.350   7.064   0.058
  443    HB2  ARG  62           HB3      ARG  62   3.123   8.703  -1.132
  444    HB3  ARG  62           HB2      ARG  62   1.654   8.376  -0.214
  445    HG2  ARG  62           HG3      ARG  62   2.395   9.527   1.656
  446    HG3  ARG  62           HG2      ARG  62   4.095   9.244   1.283
  447    HD2  ARG  62           HD3      ARG  62   4.210  11.014  -0.201
  448    HD3  ARG  62           HD2      ARG  62   2.501  10.907  -0.624
  449    HE   ARG  62           HE       ARG  62   2.424  11.707   2.005
  450   HH11  ARG  62          HH22      ARG  62   4.110  12.747  -0.817
  451   HH12  ARG  62          HH21      ARG  62   4.177  14.408  -0.326
  452   HH21  ARG  62          HH11      ARG  62   2.502  13.867   2.661
  453   HH22  ARG  62          HH12      ARG  62   3.265  15.042   1.642
  454    HA   PRO  63           HA       PRO  63   3.052   5.475   4.179
  455    HB2  PRO  63           HB2      PRO  63   5.654   6.467   5.083
  456    HB3  PRO  63           HB3      PRO  63   5.016   4.815   5.105
  457    HG2  PRO  63           HG3      PRO  63   6.994   5.721   3.437
  458    HG3  PRO  63           HG2      PRO  63   5.996   4.293   3.156
  459    HD2  PRO  63           HD3      PRO  63   5.916   6.909   1.804
  460    HD3  PRO  63           HD2      PRO  63   5.291   5.337   1.265
  461    H    THR  64           H        THR  64   1.786   6.776   5.470
  462    HA   THR  64           HA       THR  64   2.519   9.654   5.719
  463    HB   THR  64           HB       THR  64   0.060   9.428   6.889
  464    HG1  THR  64           HG1      THR  64  -0.017   7.208   6.362
  465   HG21  THR  64          HG21      THR  64  -0.836  10.214   4.724
  466   HG22  THR  64          HG22      THR  64   0.646   9.690   3.926
  467   HG23  THR  64          HG23      THR  64   0.694  11.002   5.103
  468    HA   PRO  65           HA       PRO  65   3.725   9.129   9.936
  469    HB2  PRO  65           HB2      PRO  65   2.679  11.386  11.127
  470    HB3  PRO  65           HB3      PRO  65   4.142  11.374  10.125
  471    HG2  PRO  65           HG3      PRO  65   1.373  12.188   9.424
  472    HG3  PRO  65           HG2      PRO  65   2.920  12.888   8.922
  473    HD2  PRO  65           HD3      PRO  65   1.434  11.262   7.305
  474    HD3  PRO  65           HD2      PRO  65   3.205  11.366   7.203
  475    H    ALA  66           H        ALA  66   1.036   7.991   9.134
  476    HA   ALA  66           HA       ALA  66   0.147   7.257  11.775
  477    HB1  ALA  66           HB1      ALA  66  -0.923   9.687  10.773
  478    HB2  ALA  66           HB2      ALA  66  -1.435   8.798  12.208
  479    HB3  ALA  66           HB3      ALA  66  -2.203   8.479  10.652
  480    H    GLY  67           H        GLY  67   0.725   6.341   8.877
  481    HA2  GLY  67           HA3      GLY  67  -0.539   3.961   8.703
  482    HA3  GLY  67           HA2      GLY  67  -1.821   5.039   8.163
  483    H    ILE  68           H        ILE  68  -1.144   3.332   6.254
  484    HA   ILE  68           HA       ILE  68   0.884   4.698   4.535
  485    HB   ILE  68           HB       ILE  68  -0.172   1.860   4.547
  486   HG12  ILE  68          HG13      ILE  68   2.673   2.866   4.789
  487   HG13  ILE  68          HG12      ILE  68   1.637   2.628   6.197
  488   HG21  ILE  68          HG21      ILE  68   1.683   1.672   2.711
  489   HG22  ILE  68          HG22      ILE  68   1.421   3.406   2.519
  490   HG23  ILE  68          HG23      ILE  68   0.090   2.279   2.257
  491   HD11  ILE  68          HD11      ILE  68   2.093   0.450   4.151
  492   HD12  ILE  68          HD12      ILE  68   1.432   0.292   5.778
  493   HD13  ILE  68          HD13      ILE  68   3.142   0.656   5.554
  494    H    ALA  69           H        ALA  69   0.322   5.170   2.364
  495    HA   ALA  69           HA       ALA  69  -2.590   4.932   1.694
  496    HB1  ALA  69           HB1      ALA  69  -1.263   7.302   2.278
  497    HB2  ALA  69           HB2      ALA  69  -2.774   7.164   1.381
  498    HB3  ALA  69           HB3      ALA  69  -1.241   7.243   0.514
  499    H    LEU  70           H        LEU  70  -3.051   4.584  -0.514
  500    HA   LEU  70           HA       LEU  70  -0.690   3.808  -2.187
  501    HB2  LEU  70           HB3      LEU  70  -3.532   2.822  -2.119
  502    HB3  LEU  70           HB2      LEU  70  -2.430   2.422  -3.426
  503    HG   LEU  70           HG       LEU  70  -1.363   2.000  -0.698
  504   HD11  LEU  70          HD11      LEU  70  -2.598  -0.264  -0.652
  505   HD12  LEU  70          HD12      LEU  70  -3.726   0.469  -1.794
  506   HD13  LEU  70          HD13      LEU  70  -3.522   1.163  -0.185
  507   HD21  LEU  70          HD21      LEU  70  -1.507   0.057  -3.005
  508   HD22  LEU  70          HD22      LEU  70  -0.283   0.170  -1.741
  509   HD23  LEU  70          HD23      LEU  70  -0.354   1.392  -3.011
  510    H    LEU  71           H        LEU  71  -0.418   4.892  -4.123
  511    HA   LEU  71           HA       LEU  71  -2.489   6.928  -4.820
  512    HB2  LEU  71           HB3      LEU  71   0.393   6.763  -5.744
  513    HB3  LEU  71           HB2      LEU  71  -0.702   8.131  -5.924
  514    HG   LEU  71           HG       LEU  71   0.311   6.991  -3.301
  515   HD11  LEU  71          HD11      LEU  71   0.854   9.621  -4.712
  516   HD12  LEU  71          HD12      LEU  71   2.002   8.293  -4.523
  517   HD13  LEU  71          HD13      LEU  71   1.444   9.185  -3.108
  518   HD21  LEU  71          HD21      LEU  71  -1.751   9.064  -4.002
  519   HD22  LEU  71          HD22      LEU  71  -0.805   9.243  -2.524
  520   HD23  LEU  71          HD23      LEU  71  -1.809   7.813  -2.760
  521    H    GLU  72           H        GLU  72  -2.734   7.350  -7.204
  522    HA   GLU  72           HA       GLU  72  -2.751   4.758  -8.691
  523    HB2  GLU  72           HB3      GLU  72  -4.346   6.346 -10.172
  524    HB3  GLU  72           HB2      GLU  72  -4.942   5.417  -8.796
  525    HG2  GLU  72           HG3      GLU  72  -5.618   7.848  -8.766
  526    HG3  GLU  72           HG2      GLU  72  -4.736   7.327  -7.329
  527    H    ARG  73           H        ARG  73  -0.627   7.117  -8.450
  528    HA   ARG  73           HA       ARG  73   1.135   7.668  -9.917
  529    HB2  ARG  73           HB3      ARG  73   0.091   5.640 -11.336
  530    HB3  ARG  73           HB2      ARG  73  -0.387   6.974 -12.382
  531    HG2  ARG  73           HG3      ARG  73   2.086   7.763 -12.088
  532    HG3  ARG  73           HG2      ARG  73   2.379   6.098 -11.587
  533    HD2  ARG  73           HD3      ARG  73   2.734   5.942 -13.882
  534    HD3  ARG  73           HD2      ARG  73   1.027   5.515 -13.773
  535    HE   ARG  73           HE       ARG  73   1.456   8.374 -14.143
  536   HH11  ARG  73          HH22      ARG  73   1.208   5.270 -15.623
  537   HH12  ARG  73          HH21      ARG  73   0.694   5.896 -17.155
  538   HH21  ARG  73          HH11      ARG  73   0.788   9.208 -16.133
  539   HH22  ARG  73          HH12      ARG  73   0.455   8.125 -17.445
  540    H    GLY  74           H        GLY  74  -1.124   9.332  -9.082
  541    HA2  GLY  74           HA3      GLY  74  -0.782  11.450 -11.116
  542    HA3  GLY  74           HA2      GLY  74  -2.439  10.958 -10.765
  543    H    GLY  75           H        GLY  75  -1.005  10.418  -7.931
  544    HA2  GLY  75           HA3      GLY  75  -0.355  11.897  -6.112
  545    HA3  GLY  75           HA2      GLY  75  -1.096  13.240  -6.979
  546    H    LEU  76           H        LEU  76  -3.234  10.833  -7.421
  547    HA   LEU  76           HA       LEU  76  -4.978  11.830  -5.267
  548    HB2  LEU  76           HB3      LEU  76  -5.348  10.681  -7.868
  549    HB3  LEU  76           HB2      LEU  76  -6.187   9.673  -6.689
  550    HG   LEU  76           HG       LEU  76  -6.471  12.687  -6.879
  551   HD11  LEU  76          HD11      LEU  76  -7.789  12.209  -8.660
  552   HD12  LEU  76          HD12      LEU  76  -8.912  11.527  -7.485
  553   HD13  LEU  76          HD13      LEU  76  -7.764  10.480  -8.316
  554   HD21  LEU  76          HD21      LEU  76  -7.118  10.785  -4.846
  555   HD22  LEU  76          HD22      LEU  76  -8.631  11.337  -5.567
  556   HD23  LEU  76          HD23      LEU  76  -7.501  12.506  -4.883
  557    H    THR  77           H        THR  77  -5.803  10.501  -3.587
  558    HA   THR  77           HA       THR  77  -4.119   8.131  -2.993
  559    HB   THR  77           HB       THR  77  -6.104   8.806  -0.983
  560    HG1  THR  77           HG1      THR  77  -4.216  10.813  -1.613
  561   HG21  THR  77          HG21      THR  77  -4.188   8.787   0.461
  562   HG22  THR  77          HG22      THR  77  -3.091   9.038  -0.898
  563   HG23  THR  77          HG23      THR  77  -3.949   7.505  -0.728
  564    H    LEU  78           H        LEU  78  -4.912   6.108  -3.284
  565    HA   LEU  78           HA       LEU  78  -7.747   5.803  -4.049
  566    HB2  LEU  78           HB3      LEU  78  -5.545   3.731  -3.900
  567    HB3  LEU  78           HB2      LEU  78  -7.116   3.506  -4.650
  568    HG   LEU  78           HG       LEU  78  -5.162   5.656  -5.519
  569   HD11  LEU  78          HD11      LEU  78  -4.954   2.840  -5.931
  570   HD12  LEU  78          HD12      LEU  78  -3.985   4.117  -6.658
  571   HD13  LEU  78          HD13      LEU  78  -5.452   3.563  -7.457
  572   HD21  LEU  78          HD21      LEU  78  -6.869   4.816  -7.611
  573   HD22  LEU  78          HD22      LEU  78  -6.923   6.351  -6.745
  574   HD23  LEU  78          HD23      LEU  78  -7.901   4.993  -6.198
  575    H    MET  79           H        MET  79  -5.517   4.611  -1.528
  576    HA   MET  79           HA       MET  79  -7.866   4.188   0.218
  577    HB2  MET  79           HB3      MET  79  -7.459   2.060  -1.059
  578    HB3  MET  79           HB2      MET  79  -5.880   1.956  -0.290
  579    HG2  MET  79           HG3      MET  79  -7.402   0.619   1.017
  580    HG3  MET  79           HG2      MET  79  -7.062   2.080   1.943
  581    HE1  MET  79           HE1      MET  79  -9.208   0.267  -0.477
  582    HE2  MET  79           HE2      MET  79 -10.876   0.714  -0.093
  583    HE3  MET  79           HE3      MET  79  -9.927  -0.231   1.053
  584    H    LEU  80           H        LEU  80  -7.390   4.556   2.341
  585    HA   LEU  80           HA       LEU  80  -4.551   5.197   2.999
  586    HB2  LEU  80           HB3      LEU  80  -6.014   7.064   3.402
  587    HB3  LEU  80           HB2      LEU  80  -7.187   6.045   4.229
  588    HG   LEU  80           HG       LEU  80  -5.707   5.715   6.099
  589   HD11  LEU  80          HD11      LEU  80  -3.570   5.431   5.130
  590   HD12  LEU  80          HD12      LEU  80  -3.431   6.953   6.010
  591   HD13  LEU  80          HD13      LEU  80  -3.664   6.963   4.261
  592   HD21  LEU  80          HD21      LEU  80  -6.786   8.134   5.458
  593   HD22  LEU  80          HD22      LEU  80  -5.090   8.578   5.652
  594   HD23  LEU  80          HD23      LEU  80  -5.959   7.807   6.981
  595    H    LEU  81           H        LEU  81  -3.753   3.178   3.570
  596    HA   LEU  81           HA       LEU  81  -5.237   1.381   5.325
  597    HB2  LEU  81           HB3      LEU  81  -2.727   1.347   3.804
  598    HB3  LEU  81           HB2      LEU  81  -2.576   0.576   5.378
  599    HG   LEU  81           HG       LEU  81  -4.618  -0.788   4.846
  600   HD11  LEU  81          HD11      LEU  81  -4.287   0.654   2.205
  601   HD12  LEU  81          HD12      LEU  81  -5.736   0.542   3.204
  602   HD13  LEU  81          HD13      LEU  81  -5.151  -0.878   2.337
  603   HD21  LEU  81          HD21      LEU  81  -1.994  -0.931   3.524
  604   HD22  LEU  81          HD22      LEU  81  -3.255  -1.846   2.699
  605   HD23  LEU  81          HD23      LEU  81  -2.887  -2.180   4.389
  606    H    GLY  82           H        GLY  82  -5.297   1.561   7.528
  607    HA2  GLY  82           HA3      GLY  82  -3.418   3.470   8.814
  608    HA3  GLY  82           HA2      GLY  82  -4.927   2.895   9.508
  609    H    ARG  83           H        ARG  83  -1.889   2.816  10.253
  610    HA   ARG  83           HA       ARG  83  -1.265  -0.013  10.528
  611    HB2  ARG  83           HB3      ARG  83   0.407   1.898  10.537
  612    HB3  ARG  83           HB2      ARG  83  -0.165   2.303  12.148
  613    HG2  ARG  83           HG3      ARG  83   0.313  -0.478  12.187
  614    HG3  ARG  83           HG2      ARG  83   1.689   0.230  11.342
  615    HD2  ARG  83           HD3      ARG  83   0.637   1.155  14.031
  616    HD3  ARG  83           HD2      ARG  83   2.064   0.149  13.790
  617    HE   ARG  83           HE       ARG  83   2.125   2.683  12.321
  618   HH11  ARG  83          HH22      ARG  83   2.817   0.954  15.223
  619   HH12  ARG  83          HH21      ARG  83   4.068   2.040  15.728
  620   HH21  ARG  83          HH11      ARG  83   3.754   4.109  12.964
  621   HH22  ARG  83          HH12      ARG  83   4.599   3.826  14.451
  622    H    GLN  84           H        GLN  84  -2.036  -1.373  12.151
  623    HA   GLN  84           HA       GLN  84  -3.722  -0.154  14.262
  624    HB2  GLN  84           HB3      GLN  84  -3.693  -2.655  12.815
  625    HB3  GLN  84           HB2      GLN  84  -3.649  -2.964  14.551
  626    HG2  GLN  84           HG3      GLN  84  -5.617  -1.086  13.215
  627    HG3  GLN  84           HG2      GLN  84  -5.978  -2.763  13.632
  628   HE21  GLN  84          HE22      GLN  84  -3.904  -1.888  16.016
  629   HE22  GLN  84          HE21      GLN  84  -4.998  -1.285  17.166
  630    H    GLY  85           H        GLY  85  -0.628  -1.683  13.820
  631    HA2  GLY  85           HA3      GLY  85   0.485  -0.866  16.248
  632    HA3  GLY  85           HA2      GLY  85  -0.211  -2.455  16.575
  633    H    GLU  86           H        GLU  86   2.553  -0.895  15.504
  634    HA   GLU  86           HA       GLU  86   4.567  -1.724  14.622
  635    HB2  GLU  86           HB3      GLU  86   3.762  -3.678  16.234
  636    HB3  GLU  86           HB2      GLU  86   3.512  -4.526  14.707
  637    HG2  GLU  86           HG3      GLU  86   5.942  -3.579  14.183
  638    HG3  GLU  86           HG2      GLU  86   6.058  -3.558  15.943
  639    H    GLY  87           H        GLY  87   4.605  -4.270  13.001
  640    HA2  GLY  87           HA3      GLY  87   3.853  -3.034  10.466
  641    HA3  GLY  87           HA2      GLY  87   4.572  -4.630  10.659
  642    H    ASP  88           H        ASP  88   1.512  -2.897  11.209
  643    HA   ASP  88           HA       ASP  88   0.052  -5.182  10.061
  644    HB2  ASP  88           HB3      ASP  88  -0.157  -6.063  12.183
  645    HB3  ASP  88           HB2      ASP  88   0.020  -4.494  12.967
  646    H    TYR  89           H        TYR  89  -1.014  -4.008   8.538
  647    HA   TYR  89           HA       TYR  89  -2.572  -1.620   9.449
  648    HB2  TYR  89           HB3      TYR  89  -1.582  -2.020   6.639
  649    HB3  TYR  89           HB2      TYR  89  -2.199  -0.562   7.349
  650    HD1  TYR  89           HD1      TYR  89   0.597  -3.041   7.861
  651    HD2  TYR  89           HD2      TYR  89  -0.673   1.070   8.019
  652    HE1  TYR  89           HE1      TYR  89   2.884  -2.345   8.458
  653    HE2  TYR  89           HE2      TYR  89   1.639   1.752   8.599
  654    HH   TYR  89           HH       TYR  89   4.123  -0.616   9.326
  655    H    ARG  90           H        ARG  90  -4.624  -1.348   8.362
  656    HA   ARG  90           HA       ARG  90  -5.603  -3.391   6.538
  657    HB2  ARG  90           HB3      ARG  90  -7.541  -3.900   8.252
  658    HB3  ARG  90           HB2      ARG  90  -6.031  -4.802   8.335
  659    HG2  ARG  90           HG3      ARG  90  -5.447  -3.880  10.329
  660    HG3  ARG  90           HG2      ARG  90  -6.020  -2.281   9.863
  661    HD2  ARG  90           HD3      ARG  90  -7.917  -4.539  10.510
  662    HD3  ARG  90           HD2      ARG  90  -7.318  -3.429  11.743
  663    HE   ARG  90           HE       ARG  90  -9.326  -2.816   9.740
  664   HH11  ARG  90          HH22      ARG  90  -6.724  -1.600  11.647
  665   HH12  ARG  90          HH21      ARG  90  -7.309   0.030  11.646
  666   HH21  ARG  90          HH11      ARG  90 -10.104  -0.694   9.726
  667   HH22  ARG  90          HH12      ARG  90  -9.224   0.542  10.559
  668    H    VAL  91           H        VAL  91  -7.984  -2.958   6.063
  669    HA   VAL  91           HA       VAL  91  -8.907  -0.277   6.860
  670    HB   VAL  91           HB       VAL  91  -7.317  -0.211   4.763
  671   HG11  VAL  91          HG11      VAL  91  -8.286  -0.762   2.690
  672   HG12  VAL  91          HG12      VAL  91  -9.914  -0.826   3.362
  673   HG13  VAL  91          HG13      VAL  91  -8.758  -2.108   3.727
  674   HG21  VAL  91          HG21      VAL  91 -10.066   1.079   4.805
  675   HG22  VAL  91          HG22      VAL  91  -8.705   1.632   3.830
  676   HG23  VAL  91          HG23      VAL  91  -8.615   1.704   5.589
  677    H    GLN  92           H        GLN  92 -11.139   0.090   6.244
  678    HA   GLN  92           HA       GLN  92 -12.614  -2.456   5.686
  679    HB2  GLN  92           HB3      GLN  92 -13.498   0.055   7.141
  680    HB3  GLN  92           HB2      GLN  92 -14.525  -1.346   6.832
  681    HG2  GLN  92           HG3      GLN  92 -13.129  -2.767   8.185
  682    HG3  GLN  92           HG2      GLN  92 -11.896  -1.513   8.326
  683   HE21  GLN  92          HE22      GLN  92 -13.317  -2.772  10.586
  684   HE22  GLN  92          HE21      GLN  92 -14.166  -1.532  11.375
  685    H    LYS  93           H        LYS  93 -14.146  -2.463   4.036
  686    HA   LYS  93           HA       LYS  93 -14.452   0.070   2.464
  687    HB2  LYS  93           HB3      LYS  93 -14.666  -1.648   0.482
  688    HB3  LYS  93           HB2      LYS  93 -13.068  -1.154   1.041
  689    HG2  LYS  93           HG3      LYS  93 -12.803  -3.153   2.333
  690    HG3  LYS  93           HG2      LYS  93 -14.497  -3.595   2.117
  691    HD2  LYS  93           HD3      LYS  93 -12.812  -3.208  -0.326
  692    HD3  LYS  93           HD2      LYS  93 -12.602  -4.690   0.608
  693    HE2  LYS  93           HE3      LYS  93 -14.744  -5.444   0.158
  694    HE3  LYS  93           HE2      LYS  93 -15.388  -3.815  -0.042
  695    HZ1  LYS  93           HZ1      LYS  93 -14.402  -5.575  -2.010
  696    HZ2  LYS  93           HZ2      LYS  93 -13.455  -4.169  -1.999
  697    HZ3  LYS  93           HZ3      LYS  93 -15.136  -4.057  -2.212
  698    H    GLY  94           H        GLY  94 -16.552   0.653   2.656
  699    HA2  GLY  94           HA3      GLY  94 -18.888   0.477   2.829
  700    HA3  GLY  94           HA2      GLY  94 -18.715  -0.835   1.664
  701    H    ASP  95           H        ASP  95 -17.143  -1.041   4.774
  702    HA   ASP  95           HA       ASP  95 -17.408  -2.639   6.477
  703    HB2  ASP  95           HB3      ASP  95 -19.884  -1.207   6.126
  704    HB3  ASP  95           HB2      ASP  95 -20.231  -2.872   6.595
  705    H    GLY  96           H        GLY  96 -16.677  -4.556   5.518
  706    HA2  GLY  96           HA3      GLY  96 -18.363  -6.749   5.260
  707    HA3  GLY  96           HA2      GLY  96 -18.292  -6.062   3.636
  708    H    GLY  97           H        GLY  97 -15.959  -5.582   2.877
  709    HA2  GLY  97           HA3      GLY  97 -14.344  -8.007   3.443
  710    HA3  GLY  97           HA2      GLY  97 -14.131  -6.932   2.062
  711    H    GLN  98           H        GLN  98 -12.659  -7.888   4.790
  712    HA   GLN  98           HA       GLN  98 -11.511  -5.206   5.427
  713    HB2  GLN  98           HB3      GLN  98 -12.481  -6.947   7.204
  714    HB3  GLN  98           HB2      GLN  98 -10.876  -7.648   7.032
  715    HG2  GLN  98           HG3      GLN  98  -9.831  -5.512   7.583
  716    HG3  GLN  98           HG2      GLN  98 -11.414  -4.741   7.693
  717   HE21  GLN  98          HE22      GLN  98 -10.960  -4.253  10.006
  718   HE22  GLN  98          HE21      GLN  98 -11.093  -5.478  11.173
  719    H    LEU  99           H        LEU  99  -9.630  -4.781   4.467
  720    HA   LEU  99           HA       LEU  99  -7.969  -7.011   3.460
  721    HB2  LEU  99           HB3      LEU  99  -7.188  -4.146   3.158
  722    HB3  LEU  99           HB2      LEU  99  -7.008  -5.476   2.025
  723    HG   LEU  99           HG       LEU  99  -9.581  -4.061   2.737
  724   HD11  LEU  99          HD11      LEU  99  -9.519  -3.158   0.560
  725   HD12  LEU  99          HD12      LEU  99  -8.306  -4.320   0.020
  726   HD13  LEU  99          HD13      LEU  99  -7.851  -3.016   1.118
  727   HD21  LEU  99          HD21      LEU  99  -8.987  -6.644   1.378
  728   HD22  LEU  99          HD22      LEU  99 -10.229  -5.627   0.647
  729   HD23  LEU  99          HD23      LEU  99 -10.402  -6.170   2.316
  730    H    VAL 100           H        VAL 100  -5.774  -7.254   4.125
  731    HA   VAL 100           HA       VAL 100  -4.898  -5.626   6.456
  732    HB   VAL 100           HB       VAL 100  -4.688  -8.637   6.498
  733   HG11  VAL 100          HG11      VAL 100  -3.797  -8.338   8.571
  734   HG12  VAL 100          HG12      VAL 100  -4.920  -7.037   8.968
  735   HG13  VAL 100          HG13      VAL 100  -3.479  -6.697   8.009
  736   HG21  VAL 100          HG21      VAL 100  -6.887  -6.880   7.633
  737   HG22  VAL 100          HG22      VAL 100  -6.668  -8.585   8.022
  738   HG23  VAL 100          HG23      VAL 100  -7.073  -8.101   6.376
  739    H    LEU 101           H        LEU 101  -2.974  -4.819   5.794
  740    HA   LEU 101           HA       LEU 101  -1.235  -6.466   4.022
  741    HB2  LEU 101           HB3      LEU 101  -1.741  -4.026   3.512
  742    HB3  LEU 101           HB2      LEU 101  -0.831  -3.628   4.943
  743    HG   LEU 101           HG       LEU 101   0.726  -5.432   3.357
  744   HD11  LEU 101          HD11      LEU 101   1.055  -3.876   1.416
  745   HD12  LEU 101          HD12      LEU 101  -0.338  -2.950   1.978
  746   HD13  LEU 101          HD13      LEU 101  -0.544  -4.618   1.442
  747   HD21  LEU 101          HD21      LEU 101   1.485  -3.748   5.083
  748   HD22  LEU 101          HD22      LEU 101   1.112  -2.477   3.919
  749   HD23  LEU 101          HD23      LEU 101   2.367  -3.662   3.560
  750    H    ARG 102           H        ARG 102   0.341  -7.728   5.075
  751    HA   ARG 102           HA       ARG 102   1.703  -6.501   7.400
  752    HB2  ARG 102           HB3      ARG 102  -0.277  -8.227   7.922
  753    HB3  ARG 102           HB2      ARG 102   0.992  -9.399   7.565
  754    HG2  ARG 102           HG3      ARG 102   2.417  -7.838   9.178
  755    HG3  ARG 102           HG2      ARG 102   0.820  -7.412   9.796
  756    HD2  ARG 102           HD3      ARG 102   1.275  -9.251  11.124
  757    HD3  ARG 102           HD2      ARG 102   0.488 -10.051   9.763
  758    HE   ARG 102           HE       ARG 102   3.112 -10.087   8.995
  759   HH11  ARG 102          HH22      ARG 102   1.453 -10.868  11.916
  760   HH12  ARG 102          HH21      ARG 102   2.592 -12.082  12.394
  761   HH21  ARG 102          HH11      ARG 102   4.607 -11.666   9.604
  762   HH22  ARG 102          HH12      ARG 102   4.377 -12.533  11.085
  763    H    ARG 103           H        ARG 103   3.854  -6.962   7.390
  764    HA   ARG 103           HA       ARG 103   5.314  -7.711   5.202
  765    HB2  ARG 103           HB3      ARG 103   6.641  -8.919   7.438
  766    HB3  ARG 103           HB2      ARG 103   7.013  -7.395   6.635
  767    HG2  ARG 103           HG3      ARG 103   5.360  -6.231   8.030
  768    HG3  ARG 103           HG2      ARG 103   4.936  -7.754   8.818
  769    HD2  ARG 103           HD3      ARG 103   7.703  -6.515   8.844
  770    HD3  ARG 103           HD2      ARG 103   6.539  -6.400  10.165
  771    HE   ARG 103           HE       ARG 103   6.722  -9.108   9.783
  772   HH11  ARG 103          HH22      ARG 103   9.010  -6.550  10.105
  773   HH12  ARG 103          HH21      ARG 103  10.218  -7.546  10.843
  774   HH21  ARG 103          HH11      ARG 103   8.286 -10.424  10.744
  775   HH22  ARG 103          HH12      ARG 103   9.809  -9.740  11.207
  776    H    ALA 104           H        ALA 104   5.430  -9.524   3.977
  777    HA   ALA 104           HA       ALA 104   4.026 -11.921   4.569
  778    HB1  ALA 104           HB1      ALA 104   6.397 -11.520   2.719
  779    HB2  ALA 104           HB2      ALA 104   4.702 -11.303   2.282
  780    HB3  ALA 104           HB3      ALA 104   5.309 -12.907   2.695
  781    H    THR 105           H        THR 105   4.555 -12.836   6.563
  782    HA   THR 105           HA       THR 105   7.259 -13.145   7.499
  783    HB   THR 105           HB       THR 105   5.552 -15.145   8.641
  784    HG1  THR 105           HG1      THR 105   4.412 -12.605   8.165
  785   HG21  THR 105          HG21      THR 105   7.403 -13.880   9.736
  786   HG22  THR 105          HG22      THR 105   5.900 -13.821  10.657
  787   HG23  THR 105          HG23      THR 105   6.397 -12.432   9.691
  788    HA   PRO 106           HA       PRO 106   6.568 -17.728   5.886
  789    HB2  PRO 106           HB2      PRO 106   4.910 -17.159   3.496
  790    HB3  PRO 106           HB3      PRO 106   4.760 -18.464   4.686
  791    HG2  PRO 106           HG3      PRO 106   3.038 -16.422   4.597
  792    HG3  PRO 106           HG2      PRO 106   3.508 -17.195   6.121
  793    HD2  PRO 106           HD3      PRO 106   4.393 -14.566   4.989
  794    HD3  PRO 106           HD2      PRO 106   4.099 -15.025   6.682
  Start of MODEL    8
    1    H1   SER   1           H        SER   1  18.576  23.683  -4.468
    2    H2   SER   1           H2       SER   1  17.916  24.879  -5.478
    3    H3   SER   1           1HT      SER   1  16.954  24.142  -4.288
    4    HA   SER   1           HA       SER   1  16.355  23.195  -6.372
    5    HB2  SER   1           HB3      SER   1  18.552  23.843  -7.456
    6    HB3  SER   1           HB2      SER   1  19.274  22.440  -6.672
    7    HG   SER   1           HG       SER   1  17.393  21.293  -7.712
    8    H    SER   2           H        SER   2  15.412  22.002  -4.533
    9    HA   SER   2           HA       SER   2  16.463  19.257  -4.425
   10    HB2  SER   2           HB3      SER   2  17.625  20.535  -2.569
   11    HB3  SER   2           HB2      SER   2  16.039  20.791  -1.847
   12    HG   SER   2           HG       SER   2  17.553  18.461  -2.116
   13    H    LEU   3           H        LEU   3  14.358  19.076  -5.576
   14    HA   LEU   3           HA       LEU   3  11.954  19.513  -3.906
   15    HB2  LEU   3           HB3      LEU   3  12.525  19.156  -6.772
   16    HB3  LEU   3           HB2      LEU   3  11.100  18.276  -6.226
   17    HG   LEU   3           HG       LEU   3  10.614  20.621  -7.002
   18   HD11  LEU   3          HD11      LEU   3   8.844  20.431  -5.630
   19   HD12  LEU   3          HD12      LEU   3   9.822  21.015  -4.283
   20   HD13  LEU   3          HD13      LEU   3   9.739  19.289  -4.628
   21   HD21  LEU   3          HD21      LEU   3  12.892  21.265  -5.614
   22   HD22  LEU   3          HD22      LEU   3  11.637  21.767  -4.482
   23   HD23  LEU   3          HD23      LEU   3  11.669  22.433  -6.114
   24    H    ILE   4           H        ILE   4  14.213  17.242  -3.853
   25    HA   ILE   4           HA       ILE   4  12.596  14.822  -4.115
   26    HB   ILE   4           HB       ILE   4  15.240  15.044  -2.668
   27   HG12  ILE   4          HG13      ILE   4  15.622  16.190  -4.747
   28   HG13  ILE   4          HG12      ILE   4  16.241  14.553  -4.957
   29   HG21  ILE   4          HG21      ILE   4  14.046  12.889  -2.572
   30   HG22  ILE   4          HG22      ILE   4  15.509  12.748  -3.544
   31   HG23  ILE   4          HG23      ILE   4  13.936  12.866  -4.331
   32   HD11  ILE   4          HD11      ILE   4  14.968  14.965  -6.917
   33   HD12  ILE   4          HD12      ILE   4  13.662  15.721  -6.007
   34   HD13  ILE   4          HD13      ILE   4  13.915  13.979  -5.904
   35    H    LEU   5           H        LEU   5  11.709  13.610  -2.418
   36    HA   LEU   5           HA       LEU   5  11.305  15.105   0.102
   37    HB2  LEU   5           HB3      LEU   5  10.121  12.434  -0.695
   38    HB3  LEU   5           HB2      LEU   5   9.535  13.538   0.549
   39    HG   LEU   5           HG       LEU   5   9.625  14.121  -2.425
   40   HD11  LEU   5          HD11      LEU   5   7.860  12.485  -1.326
   41   HD12  LEU   5          HD12      LEU   5   7.340  13.698  -2.494
   42   HD13  LEU   5          HD13      LEU   5   7.130  13.990  -0.768
   43   HD21  LEU   5          HD21      LEU   5   8.109  16.068  -1.506
   44   HD22  LEU   5          HD22      LEU   5   9.863  16.219  -1.423
   45   HD23  LEU   5          HD23      LEU   5   8.950  15.748   0.011
   46    H    LEU   6           H        LEU   6  10.917  12.895   1.833
   47    HA   LEU   6           HA       LEU   6  13.732  12.234   2.397
   48    HB2  LEU   6           HB3      LEU   6  11.132  11.954   3.886
   49    HB3  LEU   6           HB2      LEU   6  12.552  11.051   4.415
   50    HG   LEU   6           HG       LEU   6  13.837  13.139   4.585
   51   HD11  LEU   6          HD11      LEU   6  12.315  15.277   4.454
   52   HD12  LEU   6          HD12      LEU   6  11.309  14.268   3.414
   53   HD13  LEU   6          HD13      LEU   6  12.985  14.597   2.971
   54   HD21  LEU   6          HD21      LEU   6  11.771  14.219   6.168
   55   HD22  LEU   6          HD22      LEU   6  13.037  13.109   6.696
   56   HD23  LEU   6          HD23      LEU   6  11.484  12.479   6.146
   57    H    SER   7           H        SER   7  14.203   9.902   3.075
   58    HA   SER   7           HA       SER   7  13.015   8.071   1.044
   59    HB2  SER   7           HB3      SER   7  15.596   8.541   1.419
   60    HB3  SER   7           HB2      SER   7  15.402   7.353   2.706
   61    HG   SER   7           HG       SER   7  15.157   7.079  -0.066
   62    H    ALA   8           H        ALA   8  13.079   5.661   1.926
   63    HA   ALA   8           HA       ALA   8  11.402   5.670   4.357
   64    HB1  ALA   8           HB1      ALA   8  11.723   3.025   3.516
   65    HB2  ALA   8           HB2      ALA   8  11.730   3.959   2.019
   66    HB3  ALA   8           HB3      ALA   8  10.365   4.082   3.129
   67    H    SER   9           H        SER   9  12.138   4.999   6.334
   68    HA   SER   9           HA       SER   9  14.980   4.313   6.585
   69    HB2  SER   9           HB3      SER   9  14.550   5.537   8.448
   70    HB3  SER   9           HB2      SER   9  12.819   5.225   8.362
   71    HG   SER   9           HG       SER   9  13.912   4.269  10.197
   72    H    ASP  10           H        ASP  10  12.390   2.767   8.463
   73    HA   ASP  10           HA       ASP  10  13.608   0.135   7.799
   74    HB2  ASP  10           HB3      ASP  10  12.539   1.298  10.180
   75    HB3  ASP  10           HB2      ASP  10  11.530  -0.083   9.749
   76    H    LEU  11           H        LEU  11  11.603   1.808   6.151
   77    HA   LEU  11           HA       LEU  11   9.297  -0.061   6.099
   78    HB2  LEU  11           HB3      LEU  11   9.860   2.660   4.965
   79    HB3  LEU  11           HB2      LEU  11   8.621   1.656   4.210
   80    HG   LEU  11           HG       LEU  11   8.587   1.911   7.187
   81   HD11  LEU  11          HD11      LEU  11   7.877   4.084   5.217
   82   HD12  LEU  11          HD12      LEU  11   8.801   4.217   6.714
   83   HD13  LEU  11          HD13      LEU  11   7.057   3.963   6.773
   84   HD21  LEU  11          HD21      LEU  11   7.011   0.443   5.940
   85   HD22  LEU  11          HD22      LEU  11   6.424   1.853   5.059
   86   HD23  LEU  11          HD23      LEU  11   6.170   1.734   6.800
   87    H    ALA  12           H        ALA  12   8.559  -0.275   3.568
   88    HA   ALA  12           HA       ALA  12   9.075  -1.118   1.427
   89    HB1  ALA  12           HB1      ALA  12  12.012  -1.168   1.908
   90    HB2  ALA  12           HB2      ALA  12  11.248   0.421   1.859
   91    HB3  ALA  12           HB3      ALA  12  11.115  -0.664   0.476
   92    H    GLY  13           H        GLY  13   9.851  -3.201   0.561
   93    HA2  GLY  13           HA3      GLY  13  11.226  -5.271   1.369
   94    HA3  GLY  13           HA2      GLY  13  10.124  -5.219   2.741
   95    H    GLN  14           H        GLN  14   8.887  -7.048   2.393
   96    HA   GLN  14           HA       GLN  14   7.393  -7.177  -0.195
   97    HB2  GLN  14           HB3      GLN  14   8.837  -9.269   1.356
   98    HB3  GLN  14           HB2      GLN  14   7.266  -9.727   0.697
   99    HG2  GLN  14           HG3      GLN  14   7.954  -9.127  -1.541
  100    HG3  GLN  14           HG2      GLN  14   9.463  -8.435  -0.943
  101   HE21  GLN  14          HE22      GLN  14   9.803 -10.390  -2.827
  102   HE22  GLN  14          HE21      GLN  14  10.308 -11.847  -2.117
  103    H    TRP  15           H        TRP  15   5.147  -7.633   0.050
  104    HA   TRP  15           HA       TRP  15   4.128  -7.988   2.810
  105    HB2  TRP  15           HB3      TRP  15   3.259  -5.713   1.002
  106    HB3  TRP  15           HB2      TRP  15   2.530  -6.121   2.545
  107    HD1  TRP  15           HD1      TRP  15   6.041  -5.089   1.189
  108    HE1  TRP  15           HE1      TRP  15   7.189  -3.683   3.014
  109    HE3  TRP  15           HE3      TRP  15   2.501  -5.333   4.866
  110    HZ2  TRP  15           HZ2      TRP  15   6.679  -2.770   5.674
  111    HZ3  TRP  15           HZ3      TRP  15   2.855  -4.180   7.030
  112    HH2  TRP  15           HH2      TRP  15   4.937  -2.898   7.438
  113    H    THR  16           H        THR  16   1.608  -8.123   2.639
  114    HA   THR  16           HA       THR  16   0.717  -9.302   0.049
  115    HB   THR  16           HB       THR  16  -0.316 -11.105   1.837
  116    HG1  THR  16           HG1      THR  16   1.462 -11.740   3.117
  117   HG21  THR  16          HG21      THR  16   1.479 -12.644   0.960
  118   HG22  THR  16          HG22      THR  16   2.233 -11.236   0.215
  119   HG23  THR  16          HG23      THR  16   0.619 -11.743  -0.285
  120    H    LEU  17           H        LEU  17  -1.697  -9.696   0.137
  121    HA   LEU  17           HA       LEU  17  -3.023  -7.785   2.033
  122    HB2  LEU  17           HB3      LEU  17  -3.045  -7.805  -0.782
  123    HB3  LEU  17           HB2      LEU  17  -4.614  -8.445  -0.299
  124    HG   LEU  17           HG       LEU  17  -4.828  -6.487   1.282
  125   HD11  LEU  17          HD11      LEU  17  -3.109  -5.060   1.570
  126   HD12  LEU  17          HD12      LEU  17  -2.961  -4.812  -0.170
  127   HD13  LEU  17          HD13      LEU  17  -2.121  -6.156   0.604
  128   HD21  LEU  17          HD21      LEU  17  -4.898  -6.455  -1.657
  129   HD22  LEU  17          HD22      LEU  17  -4.793  -4.849  -0.937
  130   HD23  LEU  17          HD23      LEU  17  -6.119  -5.927  -0.501
  131    H    GLN  18           H        GLN  18  -4.856  -8.533   3.108
  132    HA   GLN  18           HA       GLN  18  -5.784 -11.289   2.475
  133    HB2  GLN  18           HB3      GLN  18  -5.456 -10.567   5.350
  134    HB3  GLN  18           HB2      GLN  18  -5.346 -12.143   4.568
  135    HG2  GLN  18           HG3      GLN  18  -3.195 -11.392   3.503
  136    HG3  GLN  18           HG2      GLN  18  -3.282  -9.927   4.482
  137   HE21  GLN  18          HE22      GLN  18  -2.600 -10.069   6.661
  138   HE22  GLN  18          HE21      GLN  18  -2.119 -11.516   7.408
  139    H    GLN  19           H        GLN  19  -7.945 -11.300   2.332
  140    HA   GLN  19           HA       GLN  19  -9.485  -9.108   3.652
  141    HB2  GLN  19           HB3      GLN  19 -10.902 -10.990   1.866
  142    HB3  GLN  19           HB2      GLN  19 -10.953  -9.227   1.911
  143    HG2  GLN  19           HG3      GLN  19  -8.818 -10.964   0.648
  144    HG3  GLN  19           HG2      GLN  19  -9.931  -9.872  -0.172
  145   HE21  GLN  19          HE22      GLN  19  -7.189  -9.472  -0.579
  146   HE22  GLN  19          HE21      GLN  19  -6.690  -8.064   0.225
  147    H    ASP  20           H        ASP  20 -10.191  -9.749   5.674
  148    HA   ASP  20           HA       ASP  20 -10.896 -11.181   7.403
  149    HB2  ASP  20           HB3      ASP  20 -13.026 -10.923   6.334
  150    HB3  ASP  20           HB2      ASP  20 -12.585 -12.033   5.041
  151    H    GLU  21           H        GLU  21 -11.723 -13.896   5.462
  152    HA   GLU  21           HA       GLU  21  -9.554 -15.440   6.654
  153    HB2  GLU  21           HB3      GLU  21 -12.000 -16.013   5.136
  154    HB3  GLU  21           HB2      GLU  21 -10.642 -17.022   4.629
  155    HG2  GLU  21           HG3      GLU  21 -11.375 -16.626   7.535
  156    HG3  GLU  21           HG2      GLU  21 -12.042 -17.932   6.556
  157    H    ALA  22           H        ALA  22 -10.336 -14.104   3.487
  158    HA   ALA  22           HA       ALA  22  -8.822 -13.346   1.836
  159    HB1  ALA  22           HB1      ALA  22  -6.580 -15.017   2.918
  160    HB2  ALA  22           HB2      ALA  22  -7.058 -13.560   3.788
  161    HB3  ALA  22           HB3      ALA  22  -6.528 -13.455   2.111
  162    HA   PRO  23           HA       PRO  23  -9.873 -17.662   0.237
  163    HB2  PRO  23           HB2      PRO  23 -11.192 -15.933  -1.791
  164    HB3  PRO  23           HB3      PRO  23 -11.809 -17.380  -0.972
  165    HG2  PRO  23           HG3      PRO  23 -12.668 -14.911  -0.371
  166    HG3  PRO  23           HG2      PRO  23 -12.560 -16.206   0.833
  167    HD2  PRO  23           HD3      PRO  23 -10.811 -13.820   0.476
  168    HD3  PRO  23           HD2      PRO  23 -11.200 -14.728   1.952
  169    H    ALA  24           H        ALA  24  -8.293 -14.806  -0.750
  170    HA   ALA  24           HA       ALA  24  -6.655 -16.320  -2.694
  171    HB1  ALA  24           HB1      ALA  24  -6.827 -14.324  -4.285
  172    HB2  ALA  24           HB2      ALA  24  -8.220 -13.805  -3.334
  173    HB3  ALA  24           HB3      ALA  24  -8.260 -15.349  -4.188
  174    H    ILE  25           H        ILE  25  -4.518 -15.693  -2.531
  175    HA   ILE  25           HA       ILE  25  -3.928 -13.386  -0.722
  176    HB   ILE  25           HB       ILE  25  -2.392 -15.886  -1.436
  177   HG12  ILE  25          HG13      ILE  25  -2.852 -14.806   1.323
  178   HG13  ILE  25          HG12      ILE  25  -4.198 -15.581   0.487
  179   HG21  ILE  25          HG21      ILE  25  -0.667 -14.822   0.195
  180   HG22  ILE  25          HG22      ILE  25  -1.440 -13.294  -0.226
  181   HG23  ILE  25          HG23      ILE  25  -0.676 -14.272  -1.480
  182   HD11  ILE  25          HD11      ILE  25  -1.503 -16.921   0.598
  183   HD12  ILE  25          HD12      ILE  25  -3.090 -17.648   0.351
  184   HD13  ILE  25          HD13      ILE  25  -2.628 -17.062   1.950
  185    H    CYS  26           H        CYS  26  -3.399 -11.562  -1.826
  186    HA   CYS  26           HA       CYS  26  -2.110 -11.812  -4.494
  187    HB2  CYS  26           HB3      CYS  26  -3.653  -9.681  -3.087
  188    HB3  CYS  26           HB2      CYS  26  -2.410  -9.162  -4.217
  189    H    HIS  27           H        HIS  27   0.082 -11.772  -4.508
  190    HA   HIS  27           HA       HIS  27   1.640 -10.919  -2.225
  191    HB2  HIS  27           HB3      HIS  27   2.121 -12.210  -4.797
  192    HB3  HIS  27           HB2      HIS  27   3.356 -11.004  -4.432
  193    HD1  HIS  27           HD1      HIS  27   5.250 -12.507  -3.667
  194    HD2  HIS  27           HD2      HIS  27   1.669 -13.329  -1.693
  195    HE1  HIS  27           HE1      HIS  27   5.810 -14.146  -1.817
  196    HE2  HIS  27           HE2      HIS  27   3.639 -14.651  -0.609
  197    H    LEU  28           H        LEU  28   2.446  -8.904  -1.832
  198    HA   LEU  28           HA       LEU  28   2.187  -6.841  -3.988
  199    HB2  LEU  28           HB3      LEU  28   1.379  -6.872  -1.140
  200    HB3  LEU  28           HB2      LEU  28   2.190  -5.408  -1.665
  201    HG   LEU  28           HG       LEU  28  -0.316  -5.345  -1.915
  202   HD11  LEU  28          HD11      LEU  28   1.704  -4.562  -3.772
  203   HD12  LEU  28          HD12      LEU  28   0.131  -3.820  -3.486
  204   HD13  LEU  28          HD13      LEU  28   0.297  -5.095  -4.693
  205   HD21  LEU  28          HD21      LEU  28  -1.458  -6.786  -3.294
  206   HD22  LEU  28          HD22      LEU  28  -0.178  -7.865  -2.756
  207   HD23  LEU  28          HD23      LEU  28  -0.068  -7.083  -4.332
  208    H    GLU  29           H        GLU  29   3.845  -5.172  -3.940
  209    HA   GLU  29           HA       GLU  29   6.282  -5.840  -2.367
  210    HB2  GLU  29           HB3      GLU  29   6.001  -6.535  -5.046
  211    HB3  GLU  29           HB2      GLU  29   6.879  -5.009  -5.110
  212    HG2  GLU  29           HG3      GLU  29   7.669  -7.391  -3.404
  213    HG3  GLU  29           HG2      GLU  29   8.400  -6.969  -4.953
  214    H    LEU  30           H        LEU  30   6.597  -4.012  -1.231
  215    HA   LEU  30           HA       LEU  30   5.797  -1.400  -2.295
  216    HB2  LEU  30           HB3      LEU  30   6.705  -2.509   0.296
  217    HB3  LEU  30           HB2      LEU  30   7.189  -0.846  -0.021
  218    HG   LEU  30           HG       LEU  30   4.859  -0.225  -0.464
  219   HD11  LEU  30          HD11      LEU  30   3.285  -2.283   0.408
  220   HD12  LEU  30          HD12      LEU  30   4.555  -3.158  -0.446
  221   HD13  LEU  30          HD13      LEU  30   3.608  -1.934  -1.291
  222   HD21  LEU  30          HD21      LEU  30   4.199  -0.153   1.765
  223   HD22  LEU  30          HD22      LEU  30   5.909  -0.539   1.948
  224   HD23  LEU  30          HD23      LEU  30   4.699  -1.817   2.072
  225    H    ARG  31           H        ARG  31   7.137  -0.533  -3.834
  226    HA   ARG  31           HA       ARG  31   9.965  -1.178  -3.958
  227    HB2  ARG  31           HB3      ARG  31   8.040   0.394  -5.527
  228    HB3  ARG  31           HB2      ARG  31   9.659   1.093  -5.490
  229    HG2  ARG  31           HG3      ARG  31  10.637  -0.985  -6.272
  230    HG3  ARG  31           HG2      ARG  31   9.080  -1.805  -6.163
  231    HD2  ARG  31           HD3      ARG  31   9.359  -1.237  -8.468
  232    HD3  ARG  31           HD2      ARG  31   8.201  -0.075  -7.819
  233    HE   ARG  31           HE       ARG  31   9.786   1.625  -8.218
  234   HH11  ARG  31          HH22      ARG  31  11.228  -1.506  -8.165
  235   HH12  ARG  31          HH21      ARG  31  12.788  -0.943  -8.664
  236   HH21  ARG  31          HH11      ARG  31  11.813   2.378  -8.872
  237   HH22  ARG  31          HH12      ARG  31  13.120   1.257  -9.065
  238    H    ASP  32           H        ASP  32  11.727   0.278  -3.556
  239    HA   ASP  32           HA       ASP  32  11.111   2.309  -1.462
  240    HB2  ASP  32           HB3      ASP  32  13.875   2.031  -1.604
  241    HB3  ASP  32           HB2      ASP  32  12.819   1.232  -0.439
  242    H    SER  33           H        SER  33  11.135   2.427  -4.604
  243    HA   SER  33           HA       SER  33  13.190   4.452  -5.112
  244    HB2  SER  33           HB3      SER  33  12.367   2.792  -6.839
  245    HB3  SER  33           HB2      SER  33  10.848   3.682  -6.874
  246    HG   SER  33           HG       SER  33  12.317   4.403  -8.479
  247    H    GLU  34           H        GLU  34  12.415   6.565  -6.175
  248    HA   GLU  34           HA       GLU  34  10.266   7.724  -4.458
  249    HB2  GLU  34           HB3      GLU  34  11.299   9.920  -5.330
  250    HB3  GLU  34           HB2      GLU  34  12.268   8.969  -4.204
  251    HG2  GLU  34           HG3      GLU  34  13.539   8.002  -6.039
  252    HG3  GLU  34           HG2      GLU  34  12.508   8.812  -7.222
  253    H    VAL  35           H        VAL  35   8.581   8.952  -5.419
  254    HA   VAL  35           HA       VAL  35   8.406   8.877  -8.400
  255    HB   VAL  35           HB       VAL  35   6.219   8.009  -6.484
  256   HG11  VAL  35          HG11      VAL  35   6.217   8.923  -9.278
  257   HG12  VAL  35          HG12      VAL  35   4.871   8.749  -8.152
  258   HG13  VAL  35          HG13      VAL  35   5.452   7.349  -9.054
  259   HG21  VAL  35          HG21      VAL  35   7.776   6.214  -6.722
  260   HG22  VAL  35          HG22      VAL  35   7.999   6.541  -8.440
  261   HG23  VAL  35          HG23      VAL  35   6.478   5.859  -7.864
  262    H    ALA  36           H        ALA  36   8.313  11.005  -8.919
  263    HA   ALA  36           HA       ALA  36   7.111  12.949  -7.076
  264    HB1  ALA  36           HB1      ALA  36   8.000  14.612  -8.497
  265    HB2  ALA  36           HB2      ALA  36   8.018  13.533  -9.892
  266    HB3  ALA  36           HB3      ALA  36   9.184  13.309  -8.589
  267    H    GLU  37           H        GLU  37   6.220  11.265 -10.027
  268    HA   GLU  37           HA       GLU  37   4.100  12.942 -10.895
  269    HB2  GLU  37           HB3      GLU  37   5.011  10.930 -12.125
  270    HB3  GLU  37           HB2      GLU  37   4.119   9.912 -10.997
  271    HG2  GLU  37           HG3      GLU  37   2.745  10.197 -12.962
  272    HG3  GLU  37           HG2      GLU  37   2.021  11.151 -11.666
  273    H    ALA  38           H        ALA  38   4.231  10.451  -8.394
  274    HA   ALA  38           HA       ALA  38   1.428  11.138  -7.611
  275    HB1  ALA  38           HB1      ALA  38   1.081   8.949  -7.121
  276    HB2  ALA  38           HB2      ALA  38   2.656   8.792  -6.341
  277    HB3  ALA  38           HB3      ALA  38   2.522   8.652  -8.094
  278    H    SER  39           H        SER  39   4.617  11.682  -6.833
  279    HA   SER  39           HA       SER  39   5.608  12.688  -4.973
  280    HB2  SER  39           HB3      SER  39   4.291  14.114  -3.714
  281    HB3  SER  39           HB2      SER  39   3.222  13.858  -5.090
  282    HG   SER  39           HG       SER  39   1.894  13.221  -3.577
  283    H    GLY  40           H        GLY  40   5.536   9.898  -5.015
  284    HA2  GLY  40           HA3      GLY  40   5.780   9.324  -2.163
  285    HA3  GLY  40           HA2      GLY  40   4.449   8.459  -2.928
  286    H    TYR  41           H        TYR  41   5.499   6.426  -2.616
  287    HA   TYR  41           HA       TYR  41   8.012   5.998  -4.165
  288    HB2  TYR  41           HB3      TYR  41   6.705   4.376  -1.964
  289    HB3  TYR  41           HB2      TYR  41   8.176   3.903  -2.813
  290    HD1  TYR  41           HD1      TYR  41   6.706   6.786  -0.909
  291    HD2  TYR  41           HD2      TYR  41  10.246   4.621  -2.004
  292    HE1  TYR  41           HE1      TYR  41   8.047   8.226   0.589
  293    HE2  TYR  41           HE2      TYR  41  11.592   6.056  -0.493
  294    HH   TYR  41           HH       TYR  41  10.835   7.536   1.789
  295    H    ASP  42           H        ASP  42   8.102   4.229  -5.638
  296    HA   ASP  42           HA       ASP  42   5.684   3.751  -7.104
  297    HB2  ASP  42           HB3      ASP  42   7.976   3.714  -8.092
  298    HB3  ASP  42           HB2      ASP  42   8.281   2.200  -7.242
  299    H    LEU  43           H        LEU  43   5.068   1.422  -7.682
  300    HA   LEU  43           HA       LEU  43   5.136  -0.392  -5.316
  301    HB2  LEU  43           HB3      LEU  43   2.979   0.926  -5.260
  302    HB3  LEU  43           HB2      LEU  43   2.596   0.267  -6.845
  303    HG   LEU  43           HG       LEU  43   2.894  -2.065  -5.785
  304   HD11  LEU  43          HD11      LEU  43   3.438  -2.234  -3.612
  305   HD12  LEU  43          HD12      LEU  43   2.081  -1.204  -3.164
  306   HD13  LEU  43          HD13      LEU  43   3.642  -0.483  -3.547
  307   HD21  LEU  43          HD21      LEU  43   0.716  -1.185  -6.374
  308   HD22  LEU  43          HD22      LEU  43   0.668  -0.218  -4.904
  309   HD23  LEU  43          HD23      LEU  43   0.603  -1.974  -4.806
  310    H    GLY  44           H        GLY  44   5.475  -2.472  -5.900
  311    HA2  GLY  44           HA3      GLY  44   4.931  -3.288  -8.718
  312    HA3  GLY  44           HA2      GLY  44   6.479  -3.665  -7.959
  313    H    GLY  45           H        GLY  45   4.579  -5.622  -8.903
  314    HA2  GLY  45           HA3      GLY  45   4.595  -7.740  -7.369
  315    HA3  GLY  45           HA2      GLY  45   3.528  -6.781  -6.362
  316    H    ASP  46           H        ASP  46   1.786  -8.262  -6.646
  317    HA   ASP  46           HA       ASP  46   0.781  -8.774  -9.366
  318    HB2  ASP  46           HB3      ASP  46   0.631 -10.168  -6.989
  319    HB3  ASP  46           HB2      ASP  46  -0.978  -9.454  -7.110
  320    H    THR  47           H        THR  47   0.844  -6.048  -7.940
  321    HA   THR  47           HA       THR  47  -1.526  -4.958  -7.166
  322    HB   THR  47           HB       THR  47  -0.768  -2.893  -7.910
  323    HG1  THR  47           HG1      THR  47  -0.163  -2.549  -9.911
  324   HG21  THR  47          HG21      THR  47   1.618  -2.878  -7.717
  325   HG22  THR  47          HG22      THR  47   1.741  -4.532  -8.316
  326   HG23  THR  47          HG23      THR  47   1.048  -4.220  -6.725
  327    H    ALA  48           H        ALA  48  -0.991  -6.413 -10.281
  328    HA   ALA  48           HA       ALA  48  -3.238  -5.137 -11.608
  329    HB1  ALA  48           HB1      ALA  48  -1.166  -6.513 -12.572
  330    HB2  ALA  48           HB2      ALA  48  -2.710  -6.473 -13.424
  331    HB3  ALA  48           HB3      ALA  48  -2.294  -7.859 -12.414
  332    H    CYS  49           H        CYS  49  -3.346  -6.816  -8.918
  333    HA   CYS  49           HA       CYS  49  -5.743  -8.450  -9.676
  334    HB2  CYS  49           HB3      CYS  49  -5.167 -10.011  -8.055
  335    HB3  CYS  49           HB2      CYS  49  -3.561  -9.455  -8.520
  336    H    LEU  50           H        LEU  50  -4.451  -5.951  -7.599
  337    HA   LEU  50           HA       LEU  50  -6.585  -5.789  -5.710
  338    HB2  LEU  50           HB3      LEU  50  -4.937  -3.486  -6.782
  339    HB3  LEU  50           HB2      LEU  50  -5.778  -3.553  -5.241
  340    HG   LEU  50           HG       LEU  50  -3.598  -5.509  -5.997
  341   HD11  LEU  50          HD11      LEU  50  -3.341  -2.978  -4.350
  342   HD12  LEU  50          HD12      LEU  50  -2.737  -3.172  -5.996
  343   HD13  LEU  50          HD13      LEU  50  -2.059  -4.141  -4.687
  344   HD21  LEU  50          HD21      LEU  50  -3.490  -5.635  -3.435
  345   HD22  LEU  50          HD22      LEU  50  -4.908  -6.357  -4.193
  346   HD23  LEU  50          HD23      LEU  50  -5.023  -4.770  -3.431
  347    H    THR  51           H        THR  51  -6.869  -5.551  -8.967
  348    HA   THR  51           HA       THR  51  -8.464  -3.191  -9.314
  349    HB   THR  51           HB       THR  51  -9.338  -5.247 -11.104
  350    HG1  THR  51           HG1      THR  51  -6.529  -5.085 -10.745
  351   HG21  THR  51          HG21      THR  51  -7.395  -2.940 -11.398
  352   HG22  THR  51          HG22      THR  51  -9.136  -2.879 -11.666
  353   HG23  THR  51          HG23      THR  51  -8.110  -3.829 -12.741
  354    H    ARG  52           H        ARG  52  -9.073  -5.585  -7.240
  355    HA   ARG  52           HA       ARG  52 -12.026  -5.607  -7.739
  356    HB2  ARG  52           HB3      ARG  52 -12.071  -7.650  -6.356
  357    HB3  ARG  52           HB2      ARG  52 -10.992  -7.845  -7.738
  358    HG2  ARG  52           HG3      ARG  52  -9.115  -7.057  -6.160
  359    HG3  ARG  52           HG2      ARG  52 -10.260  -7.357  -4.853
  360    HD2  ARG  52           HD3      ARG  52  -8.850  -9.337  -5.227
  361    HD3  ARG  52           HD2      ARG  52 -10.529  -9.690  -5.633
  362    HE   ARG  52           HE       ARG  52  -9.466  -8.901  -8.046
  363   HH11  ARG  52          HH22      ARG  52  -8.567 -11.132  -5.578
  364   HH12  ARG  52          HH21      ARG  52  -7.781 -12.226  -6.666
  365   HH21  ARG  52          HH11      ARG  52  -8.445 -10.316  -9.483
  366   HH22  ARG  52          HH12      ARG  52  -7.712 -11.763  -8.878
  367    H    TRP  53           H        TRP  53  -9.493  -4.698  -5.527
  368    HA   TRP  53           HA       TRP  53 -11.545  -3.962  -3.469
  369    HB2  TRP  53           HB3      TRP  53  -8.549  -4.276  -3.135
  370    HB3  TRP  53           HB2      TRP  53  -9.715  -3.965  -1.851
  371    HD1  TRP  53           HD1      TRP  53 -11.956  -5.991  -2.435
  372    HE1  TRP  53           HE1      TRP  53 -11.553  -8.529  -2.282
  373    HE3  TRP  53           HE3      TRP  53  -6.875  -6.116  -2.951
  374    HZ2  TRP  53           HZ2      TRP  53  -9.371 -10.372  -2.366
  375    HZ3  TRP  53           HZ3      TRP  53  -5.662  -8.279  -2.904
  376    HH2  TRP  53           HH2      TRP  53  -6.904 -10.405  -2.604
  377    H    LEU  54           H        LEU  54  -9.351  -2.759  -5.778
  378    HA   LEU  54           HA       LEU  54  -9.621  -0.001  -4.645
  379    HB2  LEU  54           HB3      LEU  54  -7.338  -1.351  -6.069
  380    HB3  LEU  54           HB2      LEU  54  -7.474   0.403  -6.074
  381    HG   LEU  54           HG       LEU  54  -7.717  -1.044  -3.455
  382   HD11  LEU  54          HD11      LEU  54  -5.048  -0.252  -3.592
  383   HD12  LEU  54          HD12      LEU  54  -5.316  -1.064  -5.129
  384   HD13  LEU  54          HD13      LEU  54  -5.638  -1.910  -3.615
  385   HD21  LEU  54          HD21      LEU  54  -6.656   1.046  -2.642
  386   HD22  LEU  54          HD22      LEU  54  -8.132   1.373  -3.549
  387   HD23  LEU  54          HD23      LEU  54  -6.559   1.625  -4.304
  388    HA   PRO  55           HA       PRO  55 -11.691   0.890  -8.462
  389    HB2  PRO  55           HB2      PRO  55 -11.195   3.551  -8.788
  390    HB3  PRO  55           HB3      PRO  55 -12.303   2.920  -7.554
  391    HG2  PRO  55           HG3      PRO  55  -9.513   3.887  -7.277
  392    HG3  PRO  55           HG2      PRO  55 -10.887   4.075  -6.179
  393    HD2  PRO  55           HD3      PRO  55  -8.868   2.225  -5.819
  394    HD3  PRO  55           HD2      PRO  55 -10.504   2.057  -5.153
  395    H    SER  56           H        SER  56  -8.294   1.342  -8.197
  396    HA   SER  56           HA       SER  56  -7.964   0.846 -11.070
  397    HB2  SER  56           HB3      SER  56  -8.148   3.419 -10.619
  398    HB3  SER  56           HB2      SER  56  -6.527   3.245  -9.953
  399    HG   SER  56           HG       SER  56  -7.462   2.795 -12.574
  400    H    GLU  57           H        GLU  57  -5.646   0.369 -11.561
  401    HA   GLU  57           HA       GLU  57  -4.454  -1.180  -9.449
  402    HB2  GLU  57           HB3      GLU  57  -4.190  -1.777 -11.821
  403    HB3  GLU  57           HB2      GLU  57  -3.289  -0.287 -12.101
  404    HG2  GLU  57           HG3      GLU  57  -1.525  -1.008 -10.601
  405    HG3  GLU  57           HG2      GLU  57  -2.453  -2.430 -10.125
  406    HA   PRO  58           HA       PRO  58  -2.320   2.464  -7.780
  407    HB2  PRO  58           HB2      PRO  58  -0.960   1.191  -5.765
  408    HB3  PRO  58           HB3      PRO  58  -2.630   1.745  -5.637
  409    HG2  PRO  58           HG3      PRO  58  -1.572  -0.974  -6.009
  410    HG3  PRO  58           HG2      PRO  58  -3.067  -0.430  -5.251
  411    HD2  PRO  58           HD3      PRO  58  -2.879  -1.569  -7.789
  412    HD3  PRO  58           HD2      PRO  58  -4.257  -0.623  -7.187
  413    H    ARG  59           H        ARG  59  -0.652   3.177  -8.979
  414    HA   ARG  59           HA       ARG  59   1.631   1.375  -9.558
  415    HB2  ARG  59           HB3      ARG  59   0.413   3.686 -10.848
  416    HB3  ARG  59           HB2      ARG  59   2.159   3.872 -10.691
  417    HG2  ARG  59           HG3      ARG  59   2.509   1.680 -11.743
  418    HG3  ARG  59           HG2      ARG  59   0.764   1.452 -11.871
  419    HD2  ARG  59           HD3      ARG  59   2.339   3.686 -13.185
  420    HD3  ARG  59           HD2      ARG  59   1.722   2.253 -14.006
  421    HE   ARG  59           HE       ARG  59   0.168   4.590 -13.289
  422   HH11  ARG  59          HH22      ARG  59   0.152   1.160 -13.636
  423   HH12  ARG  59          HH21      ARG  59  -1.545   1.069 -13.973
  424   HH21  ARG  59          HH11      ARG  59  -2.047   4.491 -13.724
  425   HH22  ARG  59          HH12      ARG  59  -2.789   2.955 -14.022
  426    H    ALA  60           H        ALA  60   0.719   3.813  -7.355
  427    HA   ALA  60           HA       ALA  60   3.486   3.889  -6.312
  428    HB1  ALA  60           HB1      ALA  60   3.196   5.848  -7.879
  429    HB2  ALA  60           HB2      ALA  60   3.575   6.302  -6.217
  430    HB3  ALA  60           HB3      ALA  60   1.920   6.434  -6.811
  431    H    TRP  61           H        TRP  61   3.569   4.689  -4.106
  432    HA   TRP  61           HA       TRP  61   0.963   4.967  -2.703
  433    HB2  TRP  61           HB3      TRP  61   1.676   3.344  -0.963
  434    HB3  TRP  61           HB2      TRP  61   1.499   2.572  -2.538
  435    HD1  TRP  61           HD1      TRP  61   3.976   2.638  -4.002
  436    HE1  TRP  61           HE1      TRP  61   6.283   1.922  -3.104
  437    HE3  TRP  61           HE3      TRP  61   3.113   2.987   1.016
  438    HZ2  TRP  61           HZ2      TRP  61   7.588   1.541  -0.587
  439    HZ3  TRP  61           HZ3      TRP  61   4.902   2.437   2.642
  440    HH2  TRP  61           HH2      TRP  61   7.137   1.716   1.847
  441    H    ARG  62           H        ARG  62   1.213   6.097  -0.668
  442    HA   ARG  62           HA       ARG  62   3.912   7.321  -0.245
  443    HB2  ARG  62           HB3      ARG  62   2.356   8.853  -1.447
  444    HB3  ARG  62           HB2      ARG  62   1.267   8.768  -0.062
  445    HG2  ARG  62           HG3      ARG  62   3.026   9.665   1.400
  446    HG3  ARG  62           HG2      ARG  62   4.145   9.716   0.037
  447    HD2  ARG  62           HD3      ARG  62   2.380  11.192  -1.127
  448    HD3  ARG  62           HD2      ARG  62   1.654  11.365   0.470
  449    HE   ARG  62           HE       ARG  62   4.471  11.952   0.587
  450   HH11  ARG  62          HH22      ARG  62   1.405  13.126  -0.461
  451   HH12  ARG  62          HH21      ARG  62   1.843  14.795  -0.309
  452   HH21  ARG  62          HH11      ARG  62   5.062  14.123   0.792
  453   HH22  ARG  62          HH12      ARG  62   3.914  15.360   0.400
  454    HA   PRO  63           HA       PRO  63   2.642   5.698   3.851
  455    HB2  PRO  63           HB2      PRO  63   5.231   6.368   4.893
  456    HB3  PRO  63           HB3      PRO  63   4.573   4.763   4.549
  457    HG2  PRO  63           HG3      PRO  63   6.601   6.125   3.153
  458    HG3  PRO  63           HG2      PRO  63   5.840   4.588   2.728
  459    HD2  PRO  63           HD3      PRO  63   5.506   7.190   1.470
  460    HD3  PRO  63           HD2      PRO  63   4.926   5.602   0.927
  461    H    THR  64           H        THR  64   1.477   7.056   5.191
  462    HA   THR  64           HA       THR  64   2.387   9.869   5.462
  463    HB   THR  64           HB       THR  64  -0.016   9.747   6.752
  464    HG1  THR  64           HG1      THR  64  -0.130   7.497   6.186
  465   HG21  THR  64          HG21      THR  64  -0.988  10.576   4.644
  466   HG22  THR  64          HG22      THR  64   0.410   9.971   3.757
  467   HG23  THR  64          HG23      THR  64   0.601  11.285   4.918
  468    HA   PRO  65           HA       PRO  65   3.765   9.281   9.620
  469    HB2  PRO  65           HB2      PRO  65   2.867  11.575  10.857
  470    HB3  PRO  65           HB3      PRO  65   4.275  11.511   9.782
  471    HG2  PRO  65           HG3      PRO  65   1.500  12.414   9.215
  472    HG3  PRO  65           HG2      PRO  65   3.044  13.074   8.649
  473    HD2  PRO  65           HD3      PRO  65   1.456  11.508   7.084
  474    HD3  PRO  65           HD2      PRO  65   3.223  11.542   6.925
  475    H    ALA  66           H        ALA  66   1.043   8.189   8.964
  476    HA   ALA  66           HA       ALA  66   0.207   7.666  11.702
  477    HB1  ALA  66           HB1      ALA  66  -1.197   9.457  11.820
  478    HB2  ALA  66           HB2      ALA  66  -2.244   8.478  10.792
  479    HB3  ALA  66           HB3      ALA  66  -1.189   9.695  10.071
  480    H    GLY  67           H        GLY  67   0.100   7.119   8.313
  481    HA2  GLY  67           HA3      GLY  67  -0.671   4.378   8.638
  482    HA3  GLY  67           HA2      GLY  67  -2.045   5.305   8.045
  483    H    ILE  68           H        ILE  68  -1.427   3.570   6.229
  484    HA   ILE  68           HA       ILE  68   0.613   4.746   4.400
  485    HB   ILE  68           HB       ILE  68  -0.700   2.022   4.494
  486   HG12  ILE  68          HG13      ILE  68   2.234   2.747   4.615
  487   HG13  ILE  68          HG12      ILE  68   1.234   2.652   6.065
  488   HG21  ILE  68          HG21      ILE  68   0.985   1.581   2.589
  489   HG22  ILE  68          HG22      ILE  68   1.039   3.335   2.405
  490   HG23  ILE  68          HG23      ILE  68  -0.481   2.471   2.178
  491   HD11  ILE  68          HD11      ILE  68   0.712   0.331   5.639
  492   HD12  ILE  68          HD12      ILE  68   2.464   0.517   5.526
  493   HD13  ILE  68          HD13      ILE  68   1.492   0.398   4.058
  494    H    ALA  69           H        ALA  69   0.043   5.248   2.243
  495    HA   ALA  69           HA       ALA  69  -2.886   5.224   1.627
  496    HB1  ALA  69           HB1      ALA  69  -1.631   7.442   0.337
  497    HB2  ALA  69           HB2      ALA  69  -1.206   7.500   2.048
  498    HB3  ALA  69           HB3      ALA  69  -2.901   7.473   1.563
  499    H    LEU  70           H        LEU  70  -3.385   4.908  -0.579
  500    HA   LEU  70           HA       LEU  70  -1.079   4.030  -2.278
  501    HB2  LEU  70           HB3      LEU  70  -3.936   3.085  -2.178
  502    HB3  LEU  70           HB2      LEU  70  -2.817   2.631  -3.457
  503    HG   LEU  70           HG       LEU  70  -1.744   2.274  -0.739
  504   HD11  LEU  70          HD11      LEU  70  -4.213   0.811  -1.678
  505   HD12  LEU  70          HD12      LEU  70  -3.918   1.566  -0.113
  506   HD13  LEU  70          HD13      LEU  70  -3.082   0.073  -0.543
  507   HD21  LEU  70          HD21      LEU  70  -0.821   0.305  -1.713
  508   HD22  LEU  70          HD22      LEU  70  -0.801   1.506  -3.007
  509   HD23  LEU  70          HD23      LEU  70  -2.051   0.261  -2.976
  510    H    LEU  71           H        LEU  71  -0.880   4.993  -4.280
  511    HA   LEU  71           HA       LEU  71  -2.998   6.977  -5.036
  512    HB2  LEU  71           HB3      LEU  71  -0.027   7.041  -5.654
  513    HB3  LEU  71           HB2      LEU  71  -1.202   8.274  -6.104
  514    HG   LEU  71           HG       LEU  71  -0.944   7.491  -3.214
  515   HD11  LEU  71          HD11      LEU  71   1.348   7.890  -3.727
  516   HD12  LEU  71          HD12      LEU  71   0.747   9.406  -3.055
  517   HD13  LEU  71          HD13      LEU  71   0.949   9.234  -4.797
  518   HD21  LEU  71          HD21      LEU  71  -2.597   9.207  -4.483
  519   HD22  LEU  71          HD22      LEU  71  -1.237  10.290  -4.196
  520   HD23  LEU  71          HD23      LEU  71  -2.027   9.488  -2.839
  521    H    GLU  72           H        GLU  72  -3.074   7.369  -7.452
  522    HA   GLU  72           HA       GLU  72  -2.711   4.776  -8.902
  523    HB2  GLU  72           HB3      GLU  72  -4.399   6.053 -10.508
  524    HB3  GLU  72           HB2      GLU  72  -4.978   5.197  -9.079
  525    HG2  GLU  72           HG3      GLU  72  -5.025   7.253  -7.794
  526    HG3  GLU  72           HG2      GLU  72  -4.264   8.142  -9.113
  527    H    ARG  73           H        ARG  73  -0.844   7.264  -8.510
  528    HA   ARG  73           HA       ARG  73   0.920   8.045  -9.856
  529    HB2  ARG  73           HB3      ARG  73   0.135   5.955 -11.370
  530    HB3  ARG  73           HB2      ARG  73  -0.362   7.275 -12.427
  531    HG2  ARG  73           HG3      ARG  73   2.023   8.234 -11.909
  532    HG3  ARG  73           HG2      ARG  73   2.393   6.570 -11.455
  533    HD2  ARG  73           HD3      ARG  73   1.527   5.828 -13.688
  534    HD3  ARG  73           HD2      ARG  73   1.345   7.524 -14.133
  535    HE   ARG  73           HE       ARG  73   4.033   6.886 -13.207
  536   HH11  ARG  73          HH22      ARG  73   1.803   6.888 -15.837
  537   HH12  ARG  73          HH21      ARG  73   3.034   6.965 -17.054
  538   HH21  ARG  73          HH11      ARG  73   5.653   6.986 -14.782
  539   HH22  ARG  73          HH12      ARG  73   5.212   7.020 -16.456
  540    H    GLY  74           H        GLY  74  -1.521   9.461  -9.112
  541    HA2  GLY  74           HA3      GLY  74  -1.313  11.638 -11.108
  542    HA3  GLY  74           HA2      GLY  74  -2.926  10.997 -10.791
  543    H    GLY  75           H        GLY  75  -1.771  10.496  -7.917
  544    HA2  GLY  75           HA3      GLY  75  -1.236  11.964  -6.035
  545    HA3  GLY  75           HA2      GLY  75  -1.935  13.311  -6.933
  546    H    LEU  76           H        LEU  76  -3.969  10.813  -7.521
  547    HA   LEU  76           HA       LEU  76  -5.884  11.782  -5.493
  548    HB2  LEU  76           HB3      LEU  76  -6.129   9.936  -7.879
  549    HB3  LEU  76           HB2      LEU  76  -7.458  10.218  -6.755
  550    HG   LEU  76           HG       LEU  76  -6.107  12.656  -7.754
  551   HD11  LEU  76          HD11      LEU  76  -6.082  11.572  -9.856
  552   HD12  LEU  76          HD12      LEU  76  -7.594  12.479  -9.865
  553   HD13  LEU  76          HD13      LEU  76  -7.607  10.744  -9.545
  554   HD21  LEU  76          HD21      LEU  76  -8.155  12.558  -6.277
  555   HD22  LEU  76          HD22      LEU  76  -9.030  11.855  -7.637
  556   HD23  LEU  76          HD23      LEU  76  -8.379  13.490  -7.757
  557    H    THR  77           H        THR  77  -5.248  10.849  -3.532
  558    HA   THR  77           HA       THR  77  -4.241   8.269  -3.083
  559    HB   THR  77           HB       THR  77  -6.250   9.251  -1.126
  560    HG1  THR  77           HG1      THR  77  -4.985  11.006  -0.581
  561   HG21  THR  77          HG21      THR  77  -4.406   7.409  -0.905
  562   HG22  THR  77          HG22      THR  77  -4.670   8.525   0.434
  563   HG23  THR  77          HG23      THR  77  -3.319   8.778  -0.671
  564    H    LEU  78           H        LEU  78  -5.128   6.241  -3.172
  565    HA   LEU  78           HA       LEU  78  -7.966   6.042  -4.001
  566    HB2  LEU  78           HB3      LEU  78  -5.920   3.818  -3.772
  567    HB3  LEU  78           HB2      LEU  78  -7.471   3.752  -4.601
  568    HG   LEU  78           HG       LEU  78  -5.570   5.888  -5.461
  569   HD11  LEU  78          HD11      LEU  78  -4.105   3.923  -5.265
  570   HD12  LEU  78          HD12      LEU  78  -4.417   4.289  -6.962
  571   HD13  LEU  78          HD13      LEU  78  -5.265   2.957  -6.176
  572   HD21  LEU  78          HD21      LEU  78  -7.952   5.345  -6.338
  573   HD22  LEU  78          HD22      LEU  78  -7.185   3.966  -7.128
  574   HD23  LEU  78          HD23      LEU  78  -6.677   5.608  -7.526
  575    H    MET  79           H        MET  79  -5.795   4.748  -1.471
  576    HA   MET  79           HA       MET  79  -8.172   4.466   0.288
  577    HB2  MET  79           HB3      MET  79  -7.720   2.280  -0.955
  578    HB3  MET  79           HB2      MET  79  -6.212   2.190  -0.047
  579    HG2  MET  79           HG3      MET  79  -7.816   0.938   1.216
  580    HG3  MET  79           HG2      MET  79  -7.604   2.468   2.067
  581    HE1  MET  79           HE1      MET  79 -11.280   0.738   0.104
  582    HE2  MET  79           HE2      MET  79 -10.027  -0.028   1.091
  583    HE3  MET  79           HE3      MET  79  -9.658   0.510  -0.546
  584    H    LEU  80           H        LEU  80  -7.698   4.962   2.381
  585    HA   LEU  80           HA       LEU  80  -4.858   5.558   3.035
  586    HB2  LEU  80           HB3      LEU  80  -6.561   7.344   3.405
  587    HB3  LEU  80           HB2      LEU  80  -7.404   6.279   4.526
  588    HG   LEU  80           HG       LEU  80  -5.375   6.190   5.954
  589   HD11  LEU  80          HD11      LEU  80  -3.497   6.569   4.661
  590   HD12  LEU  80          HD12      LEU  80  -3.730   8.191   5.311
  591   HD13  LEU  80          HD13      LEU  80  -4.287   7.805   3.685
  592   HD21  LEU  80          HD21      LEU  80  -6.933   7.838   6.632
  593   HD22  LEU  80          HD22      LEU  80  -6.574   8.867   5.245
  594   HD23  LEU  80          HD23      LEU  80  -5.400   8.706   6.551
  595    H    LEU  81           H        LEU  81  -4.103   3.467   3.508
  596    HA   LEU  81           HA       LEU  81  -5.537   1.678   5.292
  597    HB2  LEU  81           HB3      LEU  81  -3.125   1.622   3.671
  598    HB3  LEU  81           HB2      LEU  81  -2.813   0.955   5.269
  599    HG   LEU  81           HG       LEU  81  -4.831  -0.512   4.993
  600   HD11  LEU  81          HD11      LEU  81  -4.981  -0.345   2.123
  601   HD12  LEU  81          HD12      LEU  81  -5.296   1.246   2.814
  602   HD13  LEU  81          HD13      LEU  81  -6.273  -0.139   3.305
  603   HD21  LEU  81          HD21      LEU  81  -3.299  -2.007   4.296
  604   HD22  LEU  81          HD22      LEU  81  -2.281  -0.699   3.693
  605   HD23  LEU  81          HD23      LEU  81  -3.499  -1.425   2.644
  606    H    GLY  82           H        GLY  82  -5.668   1.999   7.474
  607    HA2  GLY  82           HA3      GLY  82  -3.717   3.828   8.753
  608    HA3  GLY  82           HA2      GLY  82  -5.241   3.296   9.454
  609    H    ARG  83           H        ARG  83  -2.168   3.136  10.129
  610    HA   ARG  83           HA       ARG  83  -1.556   0.341  10.419
  611    HB2  ARG  83           HB3      ARG  83   0.093   2.245  10.512
  612    HB3  ARG  83           HB2      ARG  83  -0.542   2.638  12.104
  613    HG2  ARG  83           HG3      ARG  83  -0.036  -0.142  12.135
  614    HG3  ARG  83           HG2      ARG  83   1.371   0.602  11.374
  615    HD2  ARG  83           HD3      ARG  83   1.660   0.515  13.814
  616    HD3  ARG  83           HD2      ARG  83   1.549   2.186  13.263
  617    HE   ARG  83           HE       ARG  83  -1.071   1.447  13.913
  618   HH11  ARG  83          HH22      ARG  83   2.020   1.592  15.434
  619   HH12  ARG  83          HH21      ARG  83   1.377   1.914  17.010
  620   HH21  ARG  83          HH11      ARG  83  -1.927   1.867  15.962
  621   HH22  ARG  83          HH12      ARG  83  -0.857   2.070  17.309
  622    H    GLN  84           H        GLN  84  -2.528  -1.102  11.866
  623    HA   GLN  84           HA       GLN  84  -3.696   0.030  14.370
  624    HB2  GLN  84           HB3      GLN  84  -4.675  -2.326  12.726
  625    HB3  GLN  84           HB2      GLN  84  -5.393  -1.749  14.230
  626    HG2  GLN  84           HG3      GLN  84  -5.097  -0.032  11.751
  627    HG3  GLN  84           HG2      GLN  84  -6.562  -0.934  12.143
  628   HE21  GLN  84          HE22      GLN  84  -7.164  -0.526  14.685
  629   HE22  GLN  84          HE21      GLN  84  -7.183   1.114  15.121
  630    H    GLY  85           H        GLY  85  -1.240  -0.516  14.749
  631    HA2  GLY  85           HA3      GLY  85  -0.926  -2.499  16.646
  632    HA3  GLY  85           HA2      GLY  85  -0.563  -3.327  15.127
  633    H    GLU  86           H        GLU  86   1.605  -3.249  14.541
  634    HA   GLU  86           HA       GLU  86   3.103  -0.764  15.125
  635    HB2  GLU  86           HB3      GLU  86   3.484  -2.937  16.710
  636    HB3  GLU  86           HB2      GLU  86   4.576  -3.336  15.382
  637    HG2  GLU  86           HG3      GLU  86   5.876  -2.081  16.953
  638    HG3  GLU  86           HG2      GLU  86   5.524  -0.982  15.619
  639    H    GLY  87           H        GLY  87   1.965  -3.038  13.107
  640    HA2  GLY  87           HA3      GLY  87   3.379  -2.094  10.785
  641    HA3  GLY  87           HA2      GLY  87   3.950  -3.694  11.236
  642    H    ASP  88           H        ASP  88   0.711  -3.163  12.131
  643    HA   ASP  88           HA       ASP  88  -0.227  -4.752   9.778
  644    HB2  ASP  88           HB3      ASP  88  -0.386  -5.675  12.213
  645    HB3  ASP  88           HB2      ASP  88  -1.703  -4.518  12.395
  646    H    TYR  89           H        TYR  89  -1.505  -3.633   8.404
  647    HA   TYR  89           HA       TYR  89  -2.905  -1.202   9.432
  648    HB2  TYR  89           HB3      TYR  89  -2.083  -1.809   6.602
  649    HB3  TYR  89           HB2      TYR  89  -2.752  -0.311   7.181
  650    HD1  TYR  89           HD1      TYR  89   0.155  -2.632   7.795
  651    HD2  TYR  89           HD2      TYR  89  -1.312   1.417   7.821
  652    HE1  TYR  89           HE1      TYR  89   2.425  -1.805   8.327
  653    HE2  TYR  89           HE2      TYR  89   0.968   2.233   8.352
  654    HH   TYR  89           HH       TYR  89   3.690  -0.039   8.745
  655    H    ARG  90           H        ARG  90  -5.067  -0.883   8.831
  656    HA   ARG  90           HA       ARG  90  -6.377  -2.991   7.226
  657    HB2  ARG  90           HB3      ARG  90  -7.697  -2.292   9.813
  658    HB3  ARG  90           HB2      ARG  90  -7.746  -3.802   8.904
  659    HG2  ARG  90           HG3      ARG  90  -5.407  -4.272   9.576
  660    HG3  ARG  90           HG2      ARG  90  -5.383  -2.778  10.510
  661    HD2  ARG  90           HD3      ARG  90  -5.859  -4.769  11.920
  662    HD3  ARG  90           HD2      ARG  90  -7.171  -3.591  11.947
  663    HE   ARG  90           HE       ARG  90  -7.969  -5.267   9.944
  664   HH11  ARG  90          HH22      ARG  90  -6.748  -5.762  13.133
  665   HH12  ARG  90          HH21      ARG  90  -7.594  -7.255  13.365
  666   HH21  ARG  90          HH11      ARG  90  -9.074  -7.215  10.230
  667   HH22  ARG  90          HH12      ARG  90  -8.911  -8.077  11.724
  668    H    VAL  91           H        VAL  91  -8.550  -2.339   6.557
  669    HA   VAL  91           HA       VAL  91  -9.309   0.471   7.105
  670    HB   VAL  91           HB       VAL  91  -7.766   0.340   5.047
  671   HG11  VAL  91          HG11      VAL  91  -8.587  -0.615   3.060
  672   HG12  VAL  91          HG12      VAL  91 -10.246  -0.664   3.659
  673   HG13  VAL  91          HG13      VAL  91  -9.048  -1.797   4.284
  674   HG21  VAL  91          HG21      VAL  91  -9.183   2.279   5.465
  675   HG22  VAL  91          HG22      VAL  91 -10.590   1.431   4.823
  676   HG23  VAL  91          HG23      VAL  91  -9.263   1.878   3.749
  677    H    GLN  92           H        GLN  92 -11.551   0.878   6.649
  678    HA   GLN  92           HA       GLN  92 -13.210  -1.535   6.732
  679    HB2  GLN  92           HB3      GLN  92 -13.861   1.425   6.756
  680    HB3  GLN  92           HB2      GLN  92 -15.093   0.165   6.824
  681    HG2  GLN  92           HG3      GLN  92 -14.718  -0.175   9.019
  682    HG3  GLN  92           HG2      GLN  92 -12.986  -0.362   8.747
  683   HE21  GLN  92          HE22      GLN  92 -14.866   1.373  10.674
  684   HE22  GLN  92          HE21      GLN  92 -14.082   2.878  10.657
  685    H    LYS  93           H        LYS  93 -13.756  -2.563   4.877
  686    HA   LYS  93           HA       LYS  93 -13.911  -0.993   2.348
  687    HB2  LYS  93           HB3      LYS  93 -12.514  -3.164   2.613
  688    HB3  LYS  93           HB2      LYS  93 -14.071  -3.995   2.554
  689    HG2  LYS  93           HG3      LYS  93 -14.470  -2.497   0.430
  690    HG3  LYS  93           HG2      LYS  93 -12.711  -2.374   0.423
  691    HD2  LYS  93           HD3      LYS  93 -12.885  -4.296  -0.815
  692    HD3  LYS  93           HD2      LYS  93 -12.961  -5.039   0.782
  693    HE2  LYS  93           HE3      LYS  93 -14.806  -5.926  -0.470
  694    HE3  LYS  93           HE2      LYS  93 -15.484  -4.763   0.669
  695    HZ1  LYS  93           HZ1      LYS  93 -15.652  -4.754  -2.125
  696    HZ2  LYS  93           HZ2      LYS  93 -14.753  -3.394  -1.658
  697    HZ3  LYS  93           HZ3      LYS  93 -16.312  -3.637  -1.027
  698    H    GLY  94           H        GLY  94 -15.737  -3.511   4.125
  699    HA2  GLY  94           HA3      GLY  94 -18.247  -2.270   3.130
  700    HA3  GLY  94           HA2      GLY  94 -17.988  -3.986   2.810
  701    H    ASP  95           H        ASP  95 -19.245  -5.118   4.208
  702    HA   ASP  95           HA       ASP  95 -19.621  -4.095   6.972
  703    HB2  ASP  95           HB3      ASP  95 -21.541  -4.916   5.452
  704    HB3  ASP  95           HB2      ASP  95 -20.935  -6.539   5.785
  705    H    GLY  96           H        GLY  96 -17.725  -6.365   5.262
  706    HA2  GLY  96           HA3      GLY  96 -16.678  -7.409   7.808
  707    HA3  GLY  96           HA2      GLY  96 -17.409  -8.615   6.750
  708    H    GLY  97           H        GLY  97 -16.408  -6.756   4.442
  709    HA2  GLY  97           HA3      GLY  97 -14.045  -8.278   3.863
  710    HA3  GLY  97           HA2      GLY  97 -14.564  -6.841   2.980
  711    H    GLN  98           H        GLN  98 -12.664  -8.024   5.672
  712    HA   GLN  98           HA       GLN  98 -11.603  -5.295   6.175
  713    HB2  GLN  98           HB3      GLN  98 -12.299  -7.213   7.950
  714    HB3  GLN  98           HB2      GLN  98 -10.602  -7.629   7.716
  715    HG2  GLN  98           HG3      GLN  98  -9.937  -5.319   8.221
  716    HG3  GLN  98           HG2      GLN  98 -11.635  -4.881   8.455
  717   HE21  GLN  98          HE22      GLN  98 -11.435  -7.997   9.566
  718   HE22  GLN  98          HE21      GLN  98 -11.112  -7.696  11.205
  719    H    LEU  99           H        LEU  99  -9.919  -4.726   4.973
  720    HA   LEU  99           HA       LEU  99  -8.169  -6.749   3.762
  721    HB2  LEU  99           HB3      LEU  99  -7.613  -3.797   3.736
  722    HB3  LEU  99           HB2      LEU  99  -7.263  -4.997   2.503
  723    HG   LEU  99           HG       LEU  99 -10.040  -4.058   3.255
  724   HD11  LEU  99          HD11      LEU  99  -9.331  -3.462   0.562
  725   HD12  LEU  99          HD12      LEU  99  -8.031  -2.870   1.597
  726   HD13  LEU  99          HD13      LEU  99  -9.687  -2.328   1.867
  727   HD21  LEU  99          HD21      LEU  99  -9.004  -5.872   1.055
  728   HD22  LEU  99          HD22      LEU  99 -10.658  -5.275   1.156
  729   HD23  LEU  99          HD23      LEU  99 -10.033  -6.350   2.407
  730    H    VAL 100           H        VAL 100  -5.995  -7.065   4.359
  731    HA   VAL 100           HA       VAL 100  -4.997  -5.546   6.716
  732    HB   VAL 100           HB       VAL 100  -5.066  -8.571   6.523
  733   HG11  VAL 100          HG11      VAL 100  -4.395  -7.794   9.109
  734   HG12  VAL 100          HG12      VAL 100  -3.473  -6.689   8.091
  735   HG13  VAL 100          HG13      VAL 100  -3.280  -8.432   7.902
  736   HG21  VAL 100          HG21      VAL 100  -7.254  -7.747   7.102
  737   HG22  VAL 100          HG22      VAL 100  -6.574  -6.565   8.221
  738   HG23  VAL 100          HG23      VAL 100  -6.497  -8.286   8.601
  739    H    LEU 101           H        LEU 101  -3.186  -4.635   5.783
  740    HA   LEU 101           HA       LEU 101  -1.493  -6.241   3.945
  741    HB2  LEU 101           HB3      LEU 101  -2.062  -3.823   3.468
  742    HB3  LEU 101           HB2      LEU 101  -1.164  -3.399   4.905
  743    HG   LEU 101           HG       LEU 101   0.470  -5.119   3.321
  744   HD11  LEU 101          HD11      LEU 101   0.733  -3.552   1.373
  745   HD12  LEU 101          HD12      LEU 101  -0.712  -2.701   1.921
  746   HD13  LEU 101          HD13      LEU 101  -0.824  -4.379   1.392
  747   HD21  LEU 101          HD21      LEU 101   0.679  -2.151   3.918
  748   HD22  LEU 101          HD22      LEU 101   2.006  -3.227   3.486
  749   HD23  LEU 101          HD23      LEU 101   1.174  -3.426   5.029
  750    H    ARG 102           H        ARG 102   0.145  -7.476   4.892
  751    HA   ARG 102           HA       ARG 102   1.584  -6.290   7.210
  752    HB2  ARG 102           HB3      ARG 102  -0.160  -7.946   8.007
  753    HB3  ARG 102           HB2      ARG 102   0.689  -9.186   7.083
  754    HG2  ARG 102           HG3      ARG 102   2.648  -7.806   8.617
  755    HG3  ARG 102           HG2      ARG 102   1.307  -8.176   9.701
  756    HD2  ARG 102           HD3      ARG 102   2.732 -10.164   7.905
  757    HD3  ARG 102           HD2      ARG 102   2.916 -10.038   9.655
  758    HE   ARG 102           HE       ARG 102   0.169 -10.385   9.205
  759   HH11  ARG 102          HH22      ARG 102   3.136 -12.014   8.554
  760   HH12  ARG 102          HH21      ARG 102   2.434 -13.596   8.612
  761   HH21  ARG 102          HH11      ARG 102  -0.766 -12.443   9.285
  762   HH22  ARG 102          HH12      ARG 102   0.226 -13.840   9.024
  763    H    ARG 103           H        ARG 103   3.733  -6.585   7.081
  764    HA   ARG 103           HA       ARG 103   5.097  -7.161   4.765
  765    HB2  ARG 103           HB3      ARG 103   6.989  -7.955   6.390
  766    HB3  ARG 103           HB2      ARG 103   6.448  -6.284   6.451
  767    HG2  ARG 103           HG3      ARG 103   4.919  -8.137   8.176
  768    HG3  ARG 103           HG2      ARG 103   6.609  -7.932   8.629
  769    HD2  ARG 103           HD3      ARG 103   4.864  -5.550   8.021
  770    HD3  ARG 103           HD2      ARG 103   4.906  -6.260   9.632
  771    HE   ARG 103           HE       ARG 103   7.006  -4.656   8.422
  772   HH11  ARG 103          HH22      ARG 103   6.244  -7.225  10.588
  773   HH12  ARG 103          HH21      ARG 103   7.662  -7.006  11.558
  774   HH21  ARG 103          HH11      ARG 103   8.862  -4.354   9.675
  775   HH22  ARG 103          HH12      ARG 103   9.144  -5.380  11.041
  776    H    ALA 104           H        ALA 104   5.654  -8.980   3.633
  777    HA   ALA 104           HA       ALA 104   4.625 -11.572   4.657
  778    HB1  ALA 104           HB1      ALA 104   5.794 -11.083   1.918
  779    HB2  ALA 104           HB2      ALA 104   4.133 -10.629   2.298
  780    HB3  ALA 104           HB3      ALA 104   4.635 -12.317   2.412
  781    H    THR 105           H        THR 105   6.380 -11.865   6.205
  782    HA   THR 105           HA       THR 105   8.879 -12.858   4.898
  783    HB   THR 105           HB       THR 105  10.058 -11.997   7.018
  784    HG1  THR 105           HG1      THR 105   7.761 -10.339   7.053
  785   HG21  THR 105          HG21      THR 105   8.904  -9.986   5.065
  786   HG22  THR 105          HG22      THR 105  10.325 -10.991   4.773
  787   HG23  THR 105          HG23      THR 105  10.357  -9.765   6.040
  788    HA   PRO 106           HA       PRO 106   6.828 -15.785   7.999
  789    HB2  PRO 106           HB2      PRO 106   6.337 -17.817   6.217
  790    HB3  PRO 106           HB3      PRO 106   5.168 -16.541   6.601
  791    HG2  PRO 106           HG3      PRO 106   6.957 -16.822   4.248
  792    HG3  PRO 106           HG2      PRO 106   5.299 -16.208   4.342
  793    HD2  PRO 106           HD3      PRO 106   7.491 -14.575   4.145
  794    HD3  PRO 106           HD2      PRO 106   5.976 -14.081   4.933
  Start of MODEL    9
    1    H1   SER   1           H        SER   1  14.503  21.154  -7.252
    2    H2   SER   1           H2       SER   1  15.913  22.056  -7.546
    3    H3   SER   1           1HT      SER   1  15.942  20.363  -7.678
    4    HA   SER   1           HA       SER   1  16.878  20.597  -5.626
    5    HB2  SER   1           HB3      SER   1  16.542  23.112  -5.723
    6    HB3  SER   1           HB2      SER   1  14.946  22.851  -5.022
    7    HG   SER   1           HG       SER   1  16.024  21.777  -3.279
    8    H    SER   2           H        SER   2  15.926  18.556  -5.234
    9    HA   SER   2           HA       SER   2  13.759  18.564  -3.276
   10    HB2  SER   2           HB3      SER   2  13.051  16.746  -5.472
   11    HB3  SER   2           HB2      SER   2  12.027  17.837  -4.543
   12    HG   SER   2           HG       SER   2  13.882  18.836  -6.413
   13    H    LEU   3           H        LEU   3  15.787  16.641  -5.479
   14    HA   LEU   3           HA       LEU   3  16.795  14.538  -5.160
   15    HB2  LEU   3           HB3      LEU   3  16.943  15.329  -2.251
   16    HB3  LEU   3           HB2      LEU   3  18.106  14.393  -3.191
   17    HG   LEU   3           HG       LEU   3  17.483  17.344  -3.500
   18   HD11  LEU   3          HD11      LEU   3  19.879  17.583  -2.891
   19   HD12  LEU   3          HD12      LEU   3  19.978  15.839  -2.656
   20   HD13  LEU   3          HD13      LEU   3  18.950  16.812  -1.607
   21   HD21  LEU   3          HD21      LEU   3  19.499  17.102  -5.142
   22   HD22  LEU   3          HD22      LEU   3  17.896  16.628  -5.705
   23   HD23  LEU   3          HD23      LEU   3  19.049  15.397  -5.186
   24    H    ILE   4           H        ILE   4  16.761  12.688  -3.152
   25    HA   ILE   4           HA       ILE   4  13.992  11.740  -3.271
   26    HB   ILE   4           HB       ILE   4  15.210   9.924  -1.693
   27   HG12  ILE   4          HG13      ILE   4  17.474  10.965  -3.404
   28   HG13  ILE   4          HG12      ILE   4  17.270  11.477  -1.728
   29   HG21  ILE   4          HG21      ILE   4  15.583  10.225  -4.688
   30   HG22  ILE   4          HG22      ILE   4  14.203   9.474  -3.886
   31   HG23  ILE   4          HG23      ILE   4  15.797   8.725  -3.788
   32   HD11  ILE   4          HD11      ILE   4  17.787   9.394  -0.882
   33   HD12  ILE   4          HD12      ILE   4  18.745   9.341  -2.363
   34   HD13  ILE   4          HD13      ILE   4  17.171   8.548  -2.302
   35    H    LEU   5           H        LEU   5  12.596  11.501  -1.493
   36    HA   LEU   5           HA       LEU   5  13.065  13.341   0.727
   37    HB2  LEU   5           HB3      LEU   5  10.818  11.336   0.409
   38    HB3  LEU   5           HB2      LEU   5  10.821  12.782   1.417
   39    HG   LEU   5           HG       LEU   5  11.014  12.748  -1.610
   40   HD11  LEU   5          HD11      LEU   5   8.773  12.471   0.071
   41   HD12  LEU   5          HD12      LEU   5   8.764  12.856  -1.650
   42   HD13  LEU   5          HD13      LEU   5   8.758  14.155  -0.456
   43   HD21  LEU   5          HD21      LEU   5  11.162  14.906   0.483
   44   HD22  LEU   5          HD22      LEU   5  10.493  15.275  -1.107
   45   HD23  LEU   5          HD23      LEU   5  12.152  14.690  -0.962
   46    H    LEU   6           H        LEU   6  13.407   9.922   0.152
   47    HA   LEU   6           HA       LEU   6  14.220   8.206   1.530
   48    HB2  LEU   6           HB3      LEU   6  15.914  10.155   1.951
   49    HB3  LEU   6           HB2      LEU   6  15.096  10.300   3.508
   50    HG   LEU   6           HG       LEU   6  15.448   7.648   3.505
   51   HD11  LEU   6          HD11      LEU   6  17.846   8.682   1.967
   52   HD12  LEU   6          HD12      LEU   6  16.531   7.762   1.233
   53   HD13  LEU   6          HD13      LEU   6  17.544   7.018   2.471
   54   HD21  LEU   6          HD21      LEU   6  17.481   9.780   4.221
   55   HD22  LEU   6          HD22      LEU   6  17.623   8.097   4.728
   56   HD23  LEU   6          HD23      LEU   6  16.258   9.070   5.277
   57    H    SER   7           H        SER   7  11.484   9.137   1.875
   58    HA   SER   7           HA       SER   7  11.046   8.956   4.805
   59    HB2  SER   7           HB3      SER   7   9.781  10.449   2.911
   60    HB3  SER   7           HB2      SER   7   8.721   9.045   2.972
   61    HG   SER   7           HG       SER   7   8.327  10.830   4.522
   62    H    ALA   8           H        ALA   8  10.569   7.118   1.836
   63    HA   ALA   8           HA       ALA   8   9.147   4.983   3.324
   64    HB1  ALA   8           HB1      ALA   8   9.951   4.877   0.418
   65    HB2  ALA   8           HB2      ALA   8   8.539   5.797   0.941
   66    HB3  ALA   8           HB3      ALA   8   8.610   4.057   1.218
   67    H    SER   9           H        SER   9  12.318   5.798   2.241
   68    HA   SER   9           HA       SER   9  13.552   3.356   1.738
   69    HB2  SER   9           HB3      SER   9  14.435   5.919   2.285
   70    HB3  SER   9           HB2      SER   9  15.085   4.990   3.634
   71    HG   SER   9           HG       SER   9  15.705   4.923   0.949
   72    H    ASP  10           H        ASP  10  12.110   4.438   4.695
   73    HA   ASP  10           HA       ASP  10  13.412   2.260   6.247
   74    HB2  ASP  10           HB3      ASP  10  11.367   3.945   7.556
   75    HB3  ASP  10           HB2      ASP  10  12.980   3.497   8.110
   76    H    LEU  11           H        LEU  11  10.460   3.050   4.632
   77    HA   LEU  11           HA       LEU  11   9.005   0.852   6.022
   78    HB2  LEU  11           HB3      LEU  11   8.067   3.025   4.130
   79    HB3  LEU  11           HB2      LEU  11   7.023   1.756   4.768
   80    HG   LEU  11           HG       LEU  11   8.642   3.274   6.752
   81   HD11  LEU  11          HD11      LEU  11   7.946   5.175   5.534
   82   HD12  LEU  11          HD12      LEU  11   6.700   4.990   6.767
   83   HD13  LEU  11          HD13      LEU  11   6.395   4.449   5.116
   84   HD21  LEU  11          HD21      LEU  11   5.736   2.405   6.673
   85   HD22  LEU  11          HD22      LEU  11   6.626   2.959   8.091
   86   HD23  LEU  11          HD23      LEU  11   7.051   1.427   7.326
   87    H    ALA  12           H        ALA  12  11.108   1.019   3.585
   88    HA   ALA  12           HA       ALA  12   9.689  -0.274   1.419
   89    HB1  ALA  12           HB1      ALA  12  11.623   0.125   0.335
   90    HB2  ALA  12           HB2      ALA  12  12.511  -0.908   1.454
   91    HB3  ALA  12           HB3      ALA  12  12.269   0.798   1.833
   92    H    GLY  13           H        GLY  13  10.160  -2.539   0.716
   93    HA2  GLY  13           HA3      GLY  13  11.342  -4.643   1.840
   94    HA3  GLY  13           HA2      GLY  13  10.121  -4.343   3.070
   95    H    GLN  14           H        GLN  14   9.205  -6.446   2.565
   96    HA   GLN  14           HA       GLN  14   7.633  -6.468   0.018
   97    HB2  GLN  14           HB3      GLN  14   9.273  -8.520   1.341
   98    HB3  GLN  14           HB2      GLN  14   7.646  -9.073   0.946
   99    HG2  GLN  14           HG3      GLN  14   7.947  -8.333  -1.383
  100    HG3  GLN  14           HG2      GLN  14   9.567  -7.754  -0.995
  101   HE21  GLN  14          HE22      GLN  14   8.794  -9.942  -2.902
  102   HE22  GLN  14          HE21      GLN  14   9.605 -11.329  -2.354
  103    H    TRP  15           H        TRP  15   5.414  -7.097   0.254
  104    HA   TRP  15           HA       TRP  15   4.428  -7.587   2.997
  105    HB2  TRP  15           HB3      TRP  15   3.413  -5.296   1.291
  106    HB3  TRP  15           HB2      TRP  15   2.733  -5.802   2.824
  107    HD1  TRP  15           HD1      TRP  15   6.154  -4.514   1.463
  108    HE1  TRP  15           HE1      TRP  15   7.239  -3.102   3.317
  109    HE3  TRP  15           HE3      TRP  15   2.690  -5.100   5.181
  110    HZ2  TRP  15           HZ2      TRP  15   6.719  -2.310   6.010
  111    HZ3  TRP  15           HZ3      TRP  15   3.014  -3.997   7.375
  112    HH2  TRP  15           HH2      TRP  15   5.020  -2.602   7.794
  113    H    THR  16           H        THR  16   1.881  -7.792   2.784
  114    HA   THR  16           HA       THR  16   1.099  -8.930   0.152
  115    HB   THR  16           HB       THR  16   0.124 -10.870   1.778
  116    HG1  THR  16           HG1      THR  16   1.278 -10.032   3.559
  117   HG21  THR  16          HG21      THR  16   2.112 -12.230   1.007
  118   HG22  THR  16          HG22      THR  16   2.793 -10.734   0.369
  119   HG23  THR  16          HG23      THR  16   1.271 -11.355  -0.272
  120    H    LEU  17           H        LEU  17  -1.286  -9.460   0.176
  121    HA   LEU  17           HA       LEU  17  -2.750  -7.673   2.091
  122    HB2  LEU  17           HB3      LEU  17  -2.720  -7.619  -0.724
  123    HB3  LEU  17           HB2      LEU  17  -4.254  -8.369  -0.292
  124    HG   LEU  17           HG       LEU  17  -4.648  -6.482   1.323
  125   HD11  LEU  17          HD11      LEU  17  -1.929  -5.953   0.706
  126   HD12  LEU  17          HD12      LEU  17  -2.988  -5.036   1.779
  127   HD13  LEU  17          HD13      LEU  17  -2.868  -4.601   0.074
  128   HD21  LEU  17          HD21      LEU  17  -5.870  -6.085  -0.589
  129   HD22  LEU  17          HD22      LEU  17  -4.459  -6.202  -1.638
  130   HD23  LEU  17          HD23      LEU  17  -4.749  -4.729  -0.716
  131    H    GLN  18           H        GLN  18  -4.799  -8.465   2.837
  132    HA   GLN  18           HA       GLN  18  -5.450 -11.279   2.230
  133    HB2  GLN  18           HB3      GLN  18  -4.520 -10.279   4.913
  134    HB3  GLN  18           HB2      GLN  18  -5.586 -11.673   4.791
  135    HG2  GLN  18           HG3      GLN  18  -3.938 -12.741   3.237
  136    HG3  GLN  18           HG2      GLN  18  -2.852 -11.380   3.519
  137   HE21  GLN  18          HE22      GLN  18  -2.712 -10.925   6.120
  138   HE22  GLN  18          HE21      GLN  18  -2.378 -12.318   7.032
  139    H    GLN  19           H        GLN  19  -7.604 -11.394   1.994
  140    HA   GLN  19           HA       GLN  19  -9.304  -9.290   3.241
  141    HB2  GLN  19           HB3      GLN  19 -10.718 -11.164   1.525
  142    HB3  GLN  19           HB2      GLN  19 -10.555  -9.417   1.361
  143    HG2  GLN  19           HG3      GLN  19  -8.511 -11.473   0.460
  144    HG3  GLN  19           HG2      GLN  19  -9.602 -10.574  -0.589
  145   HE21  GLN  19          HE22      GLN  19  -9.340  -8.125  -0.550
  146   HE22  GLN  19          HE21      GLN  19  -7.796  -7.487  -0.251
  147    H    ASP  20           H        ASP  20 -10.243  -9.870   5.159
  148    HA   ASP  20           HA       ASP  20 -10.957 -11.260   6.920
  149    HB2  ASP  20           HB3      ASP  20 -12.375 -12.242   4.454
  150    HB3  ASP  20           HB2      ASP  20 -12.661 -13.014   6.012
  151    H    GLU  21           H        GLU  21 -11.482 -14.171   5.266
  152    HA   GLU  21           HA       GLU  21  -9.325 -15.477   6.692
  153    HB2  GLU  21           HB3      GLU  21 -11.564 -16.298   4.991
  154    HB3  GLU  21           HB2      GLU  21 -10.102 -17.229   4.653
  155    HG2  GLU  21           HG3      GLU  21  -9.898 -17.900   6.946
  156    HG3  GLU  21           HG2      GLU  21 -11.148 -16.763   7.454
  157    H    ALA  22           H        ALA  22  -9.856 -14.370   3.395
  158    HA   ALA  22           HA       ALA  22  -8.227 -13.577   1.872
  159    HB1  ALA  22           HB1      ALA  22  -6.663 -13.602   3.995
  160    HB2  ALA  22           HB2      ALA  22  -5.971 -13.531   2.376
  161    HB3  ALA  22           HB3      ALA  22  -6.013 -15.059   3.247
  162    HA   PRO  23           HA       PRO  23  -8.698 -17.991   0.331
  163    HB2  PRO  23           HB2      PRO  23 -10.236 -16.629  -1.795
  164    HB3  PRO  23           HB3      PRO  23 -10.679 -18.040  -0.817
  165    HG2  PRO  23           HG3      PRO  23 -11.836 -15.639  -0.487
  166    HG3  PRO  23           HG2      PRO  23 -11.584 -16.773   0.851
  167    HD2  PRO  23           HD3      PRO  23 -10.057 -14.284   0.177
  168    HD3  PRO  23           HD2      PRO  23 -10.461 -14.972   1.765
  169    H    ALA  24           H        ALA  24  -7.275 -15.109  -0.475
  170    HA   ALA  24           HA       ALA  24  -5.492 -16.344  -2.425
  171    HB1  ALA  24           HB1      ALA  24  -7.146 -15.771  -4.036
  172    HB2  ALA  24           HB2      ALA  24  -5.979 -14.452  -4.112
  173    HB3  ALA  24           HB3      ALA  24  -7.498 -14.235  -3.243
  174    H    ILE  25           H        ILE  25  -3.526 -15.524  -1.880
  175    HA   ILE  25           HA       ILE  25  -3.420 -12.916  -0.448
  176    HB   ILE  25           HB       ILE  25  -1.411 -15.165  -0.754
  177   HG12  ILE  25          HG13      ILE  25  -2.626 -14.067   1.783
  178   HG13  ILE  25          HG12      ILE  25  -3.453 -15.308   0.841
  179   HG21  ILE  25          HG21      ILE  25  -1.158 -12.367   0.288
  180   HG22  ILE  25          HG22      ILE  25   0.012 -13.336  -0.605
  181   HG23  ILE  25          HG23      ILE  25  -0.274 -13.657   1.106
  182   HD11  ILE  25          HD11      ILE  25  -1.816 -16.033   2.760
  183   HD12  ILE  25          HD12      ILE  25  -0.562 -15.677   1.573
  184   HD13  ILE  25          HD13      ILE  25  -1.784 -16.899   1.224
  185    H    CYS  26           H        CYS  26  -2.723 -11.132  -1.529
  186    HA   CYS  26           HA       CYS  26  -1.492 -11.505  -4.210
  187    HB2  CYS  26           HB3      CYS  26  -3.061  -9.351  -2.889
  188    HB3  CYS  26           HB2      CYS  26  -1.818  -8.836  -4.022
  189    H    HIS  27           H        HIS  27   0.675 -11.347  -4.369
  190    HA   HIS  27           HA       HIS  27   2.327 -10.469  -2.163
  191    HB2  HIS  27           HB3      HIS  27   3.867 -10.422  -4.536
  192    HB3  HIS  27           HB2      HIS  27   3.798 -11.713  -3.337
  193    HD1  HIS  27           HD1      HIS  27   2.898 -10.925  -6.802
  194    HD2  HIS  27           HD2      HIS  27   1.665 -13.688  -3.930
  195    HE1  HIS  27           HE1      HIS  27   1.615 -12.725  -8.042
  196    HE2  HIS  27           HE2      HIS  27   0.860 -14.411  -6.303
  197    H    LEU  28           H        LEU  28   3.035  -8.430  -1.744
  198    HA   LEU  28           HA       LEU  28   2.621  -6.336  -3.843
  199    HB2  LEU  28           HB3      LEU  28   1.798  -6.488  -1.016
  200    HB3  LEU  28           HB2      LEU  28   2.606  -4.988  -1.442
  201    HG   LEU  28           HG       LEU  28   0.124  -4.890  -1.746
  202   HD11  LEU  28          HD11      LEU  28   0.817  -4.614  -4.524
  203   HD12  LEU  28          HD12      LEU  28   2.164  -4.056  -3.534
  204   HD13  LEU  28          HD13      LEU  28   0.562  -3.350  -3.323
  205   HD21  LEU  28          HD21      LEU  28   0.329  -6.540  -4.209
  206   HD22  LEU  28          HD22      LEU  28  -1.023  -6.333  -3.099
  207   HD23  LEU  28          HD23      LEU  28   0.308  -7.409  -2.674
  208    H    GLU  29           H        GLU  29   4.199  -4.548  -3.731
  209    HA   GLU  29           HA       GLU  29   6.679  -5.152  -2.203
  210    HB2  GLU  29           HB3      GLU  29   6.346  -5.536  -5.033
  211    HB3  GLU  29           HB2      GLU  29   7.475  -4.209  -4.762
  212    HG2  GLU  29           HG3      GLU  29   8.813  -5.618  -3.266
  213    HG3  GLU  29           HG2      GLU  29   7.665  -6.943  -3.464
  214    H    LEU  30           H        LEU  30   6.950  -3.346  -1.028
  215    HA   LEU  30           HA       LEU  30   6.024  -0.742  -2.030
  216    HB2  LEU  30           HB3      LEU  30   7.002  -1.857   0.549
  217    HB3  LEU  30           HB2      LEU  30   7.315  -0.146   0.264
  218    HG   LEU  30           HG       LEU  30   4.927   0.229  -0.199
  219   HD11  LEU  30          HD11      LEU  30   3.991  -1.678  -1.082
  220   HD12  LEU  30          HD12      LEU  30   3.495  -1.886   0.598
  221   HD13  LEU  30          HD13      LEU  30   4.906  -2.746  -0.019
  222   HD21  LEU  30          HD21      LEU  30   4.271   0.253   2.031
  223   HD22  LEU  30          HD22      LEU  30   6.010   0.024   2.221
  224   HD23  LEU  30          HD23      LEU  30   4.920  -1.357   2.344
  225    H    ARG  31           H        ARG  31   7.360   0.096  -3.604
  226    HA   ARG  31           HA       ARG  31  10.247  -0.363  -3.535
  227    HB2  ARG  31           HB3      ARG  31   8.292   0.792  -5.389
  228    HB3  ARG  31           HB2      ARG  31   9.816   1.682  -5.352
  229    HG2  ARG  31           HG3      ARG  31  11.056  -0.419  -5.734
  230    HG3  ARG  31           HG2      ARG  31   9.534  -1.309  -5.773
  231    HD2  ARG  31           HD3      ARG  31  10.049  -0.917  -8.055
  232    HD3  ARG  31           HD2      ARG  31   8.841   0.305  -7.657
  233    HE   ARG  31           HE       ARG  31  10.493   1.958  -7.982
  234   HH11  ARG  31          HH22      ARG  31  11.856  -1.179  -7.555
  235   HH12  ARG  31          HH21      ARG  31  13.472  -0.673  -7.918
  236   HH21  ARG  31          HH11      ARG  31  12.597   2.638  -8.460
  237   HH22  ARG  31          HH12      ARG  31  13.891   1.487  -8.431
  238    H    ASP  32           H        ASP  32  11.829   1.417  -3.428
  239    HA   ASP  32           HA       ASP  32  10.953   3.521  -1.501
  240    HB2  ASP  32           HB3      ASP  32  13.403   3.733  -1.031
  241    HB3  ASP  32           HB2      ASP  32  12.770   2.124  -0.682
  242    H    SER  33           H        SER  33  10.973   3.342  -4.648
  243    HA   SER  33           HA       SER  33  12.763   5.498  -5.433
  244    HB2  SER  33           HB3      SER  33  10.603   5.214  -7.285
  245    HB3  SER  33           HB2      SER  33  12.271   4.679  -7.471
  246    HG   SER  33           HG       SER  33  11.615   2.812  -6.189
  247    H    GLU  34           H        GLU  34  11.999   7.617  -6.200
  248    HA   GLU  34           HA       GLU  34   9.760   8.612  -4.513
  249    HB2  GLU  34           HB3      GLU  34  10.683  10.877  -5.278
  250    HB3  GLU  34           HB2      GLU  34  11.737   9.916  -4.240
  251    HG2  GLU  34           HG3      GLU  34  13.081   9.217  -6.077
  252    HG3  GLU  34           HG2      GLU  34  11.891   9.770  -7.254
  253    H    VAL  35           H        VAL  35   8.019   9.794  -5.434
  254    HA   VAL  35           HA       VAL  35   7.858   9.861  -8.410
  255    HB   VAL  35           HB       VAL  35   5.681   8.738  -6.619
  256   HG11  VAL  35          HG11      VAL  35   4.326   9.194  -8.356
  257   HG12  VAL  35          HG12      VAL  35   5.300   8.116  -9.355
  258   HG13  VAL  35          HG13      VAL  35   5.681   9.836  -9.285
  259   HG21  VAL  35          HG21      VAL  35   6.190   6.614  -7.857
  260   HG22  VAL  35          HG22      VAL  35   7.515   7.148  -6.823
  261   HG23  VAL  35          HG23      VAL  35   7.595   7.411  -8.565
  262    H    ALA  36           H        ALA  36   7.467  11.968  -8.873
  263    HA   ALA  36           HA       ALA  36   6.149  13.687  -6.878
  264    HB1  ALA  36           HB1      ALA  36   6.791  15.526  -8.309
  265    HB2  ALA  36           HB2      ALA  36   7.152  14.426  -9.639
  266    HB3  ALA  36           HB3      ALA  36   8.167  14.428  -8.196
  267    H    GLU  37           H        GLU  37   5.363  12.078  -9.886
  268    HA   GLU  37           HA       GLU  37   3.114  13.689 -10.631
  269    HB2  GLU  37           HB3      GLU  37   4.253  11.870 -12.025
  270    HB3  GLU  37           HB2      GLU  37   3.332  10.704 -11.073
  271    HG2  GLU  37           HG3      GLU  37   2.043  11.154 -13.051
  272    HG3  GLU  37           HG2      GLU  37   1.237  11.988 -11.721
  273    H    ALA  38           H        ALA  38   3.433  10.867  -8.503
  274    HA   ALA  38           HA       ALA  38   0.572  11.154  -7.727
  275    HB1  ALA  38           HB1      ALA  38   2.309   8.996  -6.616
  276    HB2  ALA  38           HB2      ALA  38   1.865   8.892  -8.320
  277    HB3  ALA  38           HB3      ALA  38   0.609   8.935  -7.083
  278    H    SER  39           H        SER  39   3.698  11.981  -6.736
  279    HA   SER  39           HA       SER  39   4.397  13.149  -4.832
  280    HB2  SER  39           HB3      SER  39   1.757  12.953  -3.486
  281    HB3  SER  39           HB2      SER  39   2.829  14.340  -3.658
  282    HG   SER  39           HG       SER  39   2.176  14.471  -5.839
  283    H    GLY  40           H        GLY  40   4.627  10.304  -5.003
  284    HA2  GLY  40           HA3      GLY  40   4.974   9.704  -2.164
  285    HA3  GLY  40           HA2      GLY  40   3.744   8.712  -2.944
  286    H    TYR  41           H        TYR  41   5.045   6.816  -2.647
  287    HA   TYR  41           HA       TYR  41   7.537   6.698  -4.283
  288    HB2  TYR  41           HB3      TYR  41   6.566   4.925  -2.024
  289    HB3  TYR  41           HB2      TYR  41   8.070   4.694  -2.915
  290    HD1  TYR  41           HD1      TYR  41   6.208   7.281  -0.936
  291    HD2  TYR  41           HD2      TYR  41  10.021   5.767  -2.198
  292    HE1  TYR  41           HE1      TYR  41   7.344   8.921   0.530
  293    HE2  TYR  41           HE2      TYR  41  11.162   7.403  -0.724
  294    HH   TYR  41           HH       TYR  41  10.196   8.730   1.635
  295    H    ASP  42           H        ASP  42   7.839   4.796  -5.625
  296    HA   ASP  42           HA       ASP  42   5.533   4.076  -7.130
  297    HB2  ASP  42           HB3      ASP  42   7.801   4.008  -8.066
  298    HB3  ASP  42           HB2      ASP  42   8.220   2.688  -6.977
  299    H    LEU  43           H        LEU  43   4.765   1.855  -7.469
  300    HA   LEU  43           HA       LEU  43   4.894   0.120  -5.045
  301    HB2  LEU  43           HB3      LEU  43   2.824   1.535  -4.885
  302    HB3  LEU  43           HB2      LEU  43   2.291   0.858  -6.421
  303    HG   LEU  43           HG       LEU  43   2.320  -1.410  -5.443
  304   HD11  LEU  43          HD11      LEU  43   2.422  -1.254  -2.774
  305   HD12  LEU  43          HD12      LEU  43   3.509   0.083  -3.151
  306   HD13  LEU  43          HD13      LEU  43   3.865  -1.537  -3.744
  307   HD21  LEU  43          HD21      LEU  43   0.181  -0.704  -5.147
  308   HD22  LEU  43          HD22      LEU  43   0.668   0.806  -4.383
  309   HD23  LEU  43          HD23      LEU  43   0.623  -0.686  -3.444
  310    H    GLY  44           H        GLY  44   6.153  -1.363  -6.283
  311    HA2  GLY  44           HA3      GLY  44   4.989  -2.461  -8.761
  312    HA3  GLY  44           HA2      GLY  44   6.538  -2.921  -8.051
  313    H    GLY  45           H        GLY  45   5.494  -5.148  -8.601
  314    HA2  GLY  45           HA3      GLY  45   5.068  -7.113  -7.241
  315    HA3  GLY  45           HA2      GLY  45   4.125  -6.118  -6.144
  316    H    ASP  46           H        ASP  46   2.284  -7.492  -6.342
  317    HA   ASP  46           HA       ASP  46   1.062  -7.789  -9.005
  318    HB2  ASP  46           HB3      ASP  46   1.167  -9.640  -7.198
  319    HB3  ASP  46           HB2      ASP  46  -0.111  -8.732  -6.386
  320    H    THR  47           H        THR  47   0.623  -5.521  -9.260
  321    HA   THR  47           HA       THR  47  -1.412  -4.349  -7.432
  322    HB   THR  47           HB       THR  47  -0.923  -2.262  -8.404
  323    HG1  THR  47           HG1      THR  47  -0.350  -3.843 -10.615
  324   HG21  THR  47          HG21      THR  47   1.499  -2.080  -8.465
  325   HG22  THR  47          HG22      THR  47   1.654  -3.812  -8.762
  326   HG23  THR  47          HG23      THR  47   1.042  -3.233  -7.212
  327    H    ALA  48           H        ALA  48  -1.054  -6.115 -10.257
  328    HA   ALA  48           HA       ALA  48  -3.505  -5.173 -11.588
  329    HB1  ALA  48           HB1      ALA  48  -2.445  -7.789 -12.414
  330    HB2  ALA  48           HB2      ALA  48  -1.245  -6.499 -12.460
  331    HB3  ALA  48           HB3      ALA  48  -2.743  -6.343 -13.378
  332    H    CYS  49           H        CYS  49  -3.226  -6.669  -8.808
  333    HA   CYS  49           HA       CYS  49  -5.526  -8.524  -9.296
  334    HB2  CYS  49           HB3      CYS  49  -4.666 -10.060  -7.702
  335    HB3  CYS  49           HB2      CYS  49  -3.269  -9.613  -8.682
  336    H    LEU  50           H        LEU  50  -5.233  -5.612  -8.409
  337    HA   LEU  50           HA       LEU  50  -6.691  -5.860  -5.801
  338    HB2  LEU  50           HB3      LEU  50  -5.161  -3.462  -6.838
  339    HB3  LEU  50           HB2      LEU  50  -5.911  -3.617  -5.260
  340    HG   LEU  50           HG       LEU  50  -3.763  -5.519  -6.204
  341   HD11  LEU  50          HD11      LEU  50  -3.363  -3.066  -4.477
  342   HD12  LEU  50          HD12      LEU  50  -2.957  -3.125  -6.189
  343   HD13  LEU  50          HD13      LEU  50  -2.120  -4.176  -5.050
  344   HD21  LEU  50          HD21      LEU  50  -4.931  -4.790  -3.506
  345   HD22  LEU  50          HD22      LEU  50  -3.466  -5.751  -3.701
  346   HD23  LEU  50          HD23      LEU  50  -5.002  -6.356  -4.316
  347    H    THR  51           H        THR  51  -7.161  -5.383  -9.020
  348    HA   THR  51           HA       THR  51  -8.901  -3.098  -9.078
  349    HB   THR  51           HB       THR  51  -9.804  -4.214 -11.177
  350    HG1  THR  51           HG1      THR  51  -8.858  -6.323 -10.056
  351   HG21  THR  51          HG21      THR  51  -8.113  -2.782 -11.764
  352   HG22  THR  51          HG22      THR  51  -7.300  -4.296 -12.160
  353   HG23  THR  51          HG23      THR  51  -6.974  -3.495 -10.623
  354    H    ARG  52           H        ARG  52  -9.211  -5.776  -7.280
  355    HA   ARG  52           HA       ARG  52 -12.173  -6.000  -7.603
  356    HB2  ARG  52           HB3      ARG  52 -11.859  -8.010  -6.071
  357    HB3  ARG  52           HB2      ARG  52 -11.115  -8.156  -7.665
  358    HG2  ARG  52           HG3      ARG  52  -8.942  -7.519  -6.748
  359    HG3  ARG  52           HG2      ARG  52  -9.662  -7.258  -5.161
  360    HD2  ARG  52           HD3      ARG  52  -8.521  -9.483  -5.385
  361    HD3  ARG  52           HD2      ARG  52 -10.232  -9.609  -4.970
  362    HE   ARG  52           HE       ARG  52  -9.774  -9.709  -7.843
  363   HH11  ARG  52          HH22      ARG  52  -9.799 -11.442  -4.863
  364   HH12  ARG  52          HH21      ARG  52 -10.093 -12.978  -5.606
  365   HH21  ARG  52          HH11      ARG  52 -10.158 -11.705  -8.830
  366   HH22  ARG  52          HH12      ARG  52 -10.296 -13.127  -7.854
  367    H    TRP  53           H        TRP  53  -9.644  -4.865  -5.522
  368    HA   TRP  53           HA       TRP  53 -11.647  -4.283  -3.369
  369    HB2  TRP  53           HB3      TRP  53  -8.635  -4.378  -3.088
  370    HB3  TRP  53           HB2      TRP  53  -9.831  -4.315  -1.792
  371    HD1  TRP  53           HD1      TRP  53 -11.844  -6.509  -2.788
  372    HE1  TRP  53           HE1      TRP  53 -11.169  -8.992  -2.787
  373    HE3  TRP  53           HE3      TRP  53  -6.754  -6.046  -2.771
  374    HZ2  TRP  53           HZ2      TRP  53  -8.795 -10.578  -2.777
  375    HZ3  TRP  53           HZ3      TRP  53  -5.314  -8.068  -2.758
  376    HH2  TRP  53           HH2      TRP  53  -6.328 -10.328  -2.762
  377    H    LEU  54           H        LEU  54  -9.391  -2.952  -5.635
  378    HA   LEU  54           HA       LEU  54  -9.876  -0.220  -4.514
  379    HB2  LEU  54           HB3      LEU  54  -7.544  -1.317  -6.104
  380    HB3  LEU  54           HB2      LEU  54  -7.753   0.394  -5.767
  381    HG   LEU  54           HG       LEU  54  -7.634  -1.736  -3.608
  382   HD11  LEU  54          HD11      LEU  54  -5.423   0.210  -4.220
  383   HD12  LEU  54          HD12      LEU  54  -5.501  -1.343  -5.048
  384   HD13  LEU  54          HD13      LEU  54  -5.355  -1.288  -3.294
  385   HD21  LEU  54          HD21      LEU  54  -6.833   0.744  -2.610
  386   HD22  LEU  54          HD22      LEU  54  -8.383  -0.042  -2.325
  387   HD23  LEU  54          HD23      LEU  54  -8.213   1.122  -3.635
  388    HA   PRO  55           HA       PRO  55 -11.927   0.486  -8.396
  389    HB2  PRO  55           HB2      PRO  55 -11.752   3.186  -8.678
  390    HB3  PRO  55           HB3      PRO  55 -12.796   2.409  -7.473
  391    HG2  PRO  55           HG3      PRO  55 -10.190   3.762  -7.127
  392    HG3  PRO  55           HG2      PRO  55 -11.573   3.668  -6.028
  393    HD2  PRO  55           HD3      PRO  55  -9.245   2.141  -5.822
  394    HD3  PRO  55           HD2      PRO  55 -10.782   1.779  -5.026
  395    H    SER  56           H        SER  56  -8.599   1.318  -8.064
  396    HA   SER  56           HA       SER  56  -8.233   1.024 -10.978
  397    HB2  SER  56           HB3      SER  56  -6.548   3.184 -10.192
  398    HB3  SER  56           HB2      SER  56  -7.852   3.205 -11.375
  399    HG   SER  56           HG       SER  56  -8.287   3.390  -8.582
  400    H    GLU  57           H        GLU  57  -5.987   0.511 -11.508
  401    HA   GLU  57           HA       GLU  57  -4.713  -1.092  -9.501
  402    HB2  GLU  57           HB3      GLU  57  -4.339  -1.796 -11.714
  403    HB3  GLU  57           HB2      GLU  57  -3.928  -0.171 -12.257
  404    HG2  GLU  57           HG3      GLU  57  -2.227  -1.435 -10.145
  405    HG3  GLU  57           HG2      GLU  57  -2.032  -1.974 -11.811
  406    HA   PRO  58           HA       PRO  58  -2.606   2.515  -7.681
  407    HB2  PRO  58           HB2      PRO  58  -1.175   1.095  -5.783
  408    HB3  PRO  58           HB3      PRO  58  -2.807   1.730  -5.562
  409    HG2  PRO  58           HG3      PRO  58  -1.914  -1.018  -6.019
  410    HG3  PRO  58           HG2      PRO  58  -3.394  -0.410  -5.285
  411    HD2  PRO  58           HD3      PRO  58  -3.163  -1.508  -7.850
  412    HD3  PRO  58           HD2      PRO  58  -4.546  -0.578  -7.235
  413    H    ARG  59           H        ARG  59  -0.968   3.304  -8.877
  414    HA   ARG  59           HA       ARG  59   1.366   1.602  -9.529
  415    HB2  ARG  59           HB3      ARG  59   0.045   3.387 -11.071
  416    HB3  ARG  59           HB2      ARG  59   1.273   4.452 -10.383
  417    HG2  ARG  59           HG3      ARG  59   2.977   2.644 -11.035
  418    HG3  ARG  59           HG2      ARG  59   1.687   1.939 -12.010
  419    HD2  ARG  59           HD3      ARG  59   1.439   4.394 -12.928
  420    HD3  ARG  59           HD2      ARG  59   3.094   4.568 -12.346
  421    HE   ARG  59           HE       ARG  59   3.782   3.250 -14.168
  422   HH11  ARG  59          HH22      ARG  59   0.454   2.749 -13.414
  423   HH12  ARG  59          HH21      ARG  59   0.173   1.689 -14.755
  424   HH21  ARG  59          HH11      ARG  59   3.432   1.873 -15.925
  425   HH22  ARG  59          HH12      ARG  59   1.858   1.194 -16.176
  426    H    ALA  60           H        ALA  60   0.381   3.858  -7.187
  427    HA   ALA  60           HA       ALA  60   3.124   3.978  -6.120
  428    HB1  ALA  60           HB1      ALA  60   1.629   6.569  -6.547
  429    HB2  ALA  60           HB2      ALA  60   2.782   5.950  -7.731
  430    HB3  ALA  60           HB3      ALA  60   3.320   6.347  -6.099
  431    H    TRP  61           H        TRP  61   3.130   5.027  -3.940
  432    HA   TRP  61           HA       TRP  61   0.496   5.188  -2.581
  433    HB2  TRP  61           HB3      TRP  61   1.176   3.629  -0.818
  434    HB3  TRP  61           HB2      TRP  61   1.228   2.810  -2.377
  435    HD1  TRP  61           HD1      TRP  61   3.858   3.170  -3.587
  436    HE1  TRP  61           HE1      TRP  61   6.102   2.652  -2.436
  437    HE3  TRP  61           HE3      TRP  61   2.393   3.309   1.298
  438    HZ2  TRP  61           HZ2      TRP  61   7.140   2.332   0.207
  439    HZ3  TRP  61           HZ3      TRP  61   4.026   2.890   3.112
  440    HH2  TRP  61           HH2      TRP  61   6.396   2.401   2.574
  441    H    ARG  62           H        ARG  62   0.727   6.332  -0.489
  442    HA   ARG  62           HA       ARG  62   3.372   7.682  -0.134
  443    HB2  ARG  62           HB3      ARG  62   1.707   9.101  -1.383
  444    HB3  ARG  62           HB2      ARG  62   0.707   9.088   0.069
  445    HG2  ARG  62           HG3      ARG  62   2.821   9.923   1.301
  446    HG3  ARG  62           HG2      ARG  62   3.454  10.279  -0.305
  447    HD2  ARG  62           HD3      ARG  62   1.134  11.521   1.132
  448    HD3  ARG  62           HD2      ARG  62   2.422  12.298   0.212
  449    HE   ARG  62           HE       ARG  62   0.818  10.673  -1.534
  450   HH11  ARG  62          HH22      ARG  62   0.848  13.588   0.308
  451   HH12  ARG  62          HH21      ARG  62  -0.268  14.411  -0.730
  452   HH21  ARG  62          HH11      ARG  62  -0.637  11.731  -2.900
  453   HH22  ARG  62          HH12      ARG  62  -1.109  13.360  -2.546
  454    HA   PRO  63           HA       PRO  63   2.236   6.053   4.008
  455    HB2  PRO  63           HB2      PRO  63   4.770   7.194   4.909
  456    HB3  PRO  63           HB3      PRO  63   4.251   5.502   4.895
  457    HG2  PRO  63           HG3      PRO  63   6.144   6.626   3.233
  458    HG3  PRO  63           HG2      PRO  63   5.311   5.094   2.965
  459    HD2  PRO  63           HD3      PRO  63   4.969   7.651   1.569
  460    HD3  PRO  63           HD2      PRO  63   4.445   6.025   1.085
  461    H    THR  64           H        THR  64   0.901   7.300   5.306
  462    HA   THR  64           HA       THR  64   1.399  10.221   5.419
  463    HB   THR  64           HB       THR  64  -0.915   9.823   6.811
  464    HG1  THR  64           HG1      THR  64  -0.559   7.511   6.228
  465   HG21  THR  64          HG21      THR  64  -0.633   9.926   3.793
  466   HG22  THR  64          HG22      THR  64  -0.592  11.322   4.870
  467   HG23  THR  64          HG23      THR  64  -2.073  10.377   4.708
  468    HA   PRO  65           HA       PRO  65   2.986  10.076   9.543
  469    HB2  PRO  65           HB2      PRO  65   1.742  12.246  10.711
  470    HB3  PRO  65           HB3      PRO  65   3.136  12.362   9.622
  471    HG2  PRO  65           HG3      PRO  65   0.254  12.810   9.064
  472    HG3  PRO  65           HG2      PRO  65   1.676  13.655   8.430
  473    HD2  PRO  65           HD3      PRO  65   0.302  11.795   6.981
  474    HD3  PRO  65           HD2      PRO  65   2.043  12.081   6.773
  475    H    ALA  66           H        ALA  66   0.307   8.686   8.961
  476    HA   ALA  66           HA       ALA  66  -0.257   7.912  11.682
  477    HB1  ALA  66           HB1      ALA  66  -1.443  10.235  11.253
  478    HB2  ALA  66           HB2      ALA  66  -2.295   8.949  12.107
  479    HB3  ALA  66           HB3      ALA  66  -2.620   9.238  10.397
  480    H    GLY  67           H        GLY  67   0.258   6.819   8.920
  481    HA2  GLY  67           HA3      GLY  67  -0.969   4.415   8.927
  482    HA3  GLY  67           HA2      GLY  67  -2.256   5.416   8.283
  483    H    ILE  68           H        ILE  68  -2.185   4.400   6.209
  484    HA   ILE  68           HA       ILE  68   0.090   5.299   4.519
  485    HB   ILE  68           HB       ILE  68  -0.894   2.450   4.793
  486   HG12  ILE  68          HG13      ILE  68   1.927   3.554   4.696
  487   HG13  ILE  68          HG12      ILE  68   1.041   3.334   6.201
  488   HG21  ILE  68          HG21      ILE  68   0.777   2.138   2.799
  489   HG22  ILE  68          HG22      ILE  68   0.460   3.845   2.496
  490   HG23  ILE  68          HG23      ILE  68  -0.864   2.684   2.458
  491   HD11  ILE  68          HD11      ILE  68   1.369   1.099   6.189
  492   HD12  ILE  68          HD12      ILE  68   2.575   1.399   4.938
  493   HD13  ILE  68          HD13      ILE  68   0.925   0.970   4.487
  494    H    ALA  69           H        ALA  69  -0.506   5.586   2.310
  495    HA   ALA  69           HA       ALA  69  -3.412   5.221   1.684
  496    HB1  ALA  69           HB1      ALA  69  -3.145   7.416   0.362
  497    HB2  ALA  69           HB2      ALA  69  -1.684   7.671   1.317
  498    HB3  ALA  69           HB3      ALA  69  -3.251   7.551   2.117
  499    H    LEU  70           H        LEU  70  -3.854   4.783  -0.538
  500    HA   LEU  70           HA       LEU  70  -1.438   3.987  -2.128
  501    HB2  LEU  70           HB3      LEU  70  -4.257   2.945  -2.065
  502    HB3  LEU  70           HB2      LEU  70  -3.151   2.557  -3.377
  503    HG   LEU  70           HG       LEU  70  -2.058   2.184  -0.653
  504   HD11  LEU  70          HD11      LEU  70  -4.216   1.315  -0.140
  505   HD12  LEU  70          HD12      LEU  70  -3.241  -0.094  -0.559
  506   HD13  LEU  70          HD13      LEU  70  -4.378   0.572  -1.732
  507   HD21  LEU  70          HD21      LEU  70  -0.958   0.354  -1.690
  508   HD22  LEU  70          HD22      LEU  70  -1.034   1.585  -2.952
  509   HD23  LEU  70          HD23      LEU  70  -2.174   0.239  -2.963
  510    H    LEU  71           H        LEU  71  -1.144   4.938  -4.115
  511    HA   LEU  71           HA       LEU  71  -3.348   6.695  -5.149
  512    HB2  LEU  71           HB3      LEU  71  -0.355   7.189  -5.315
  513    HB3  LEU  71           HB2      LEU  71  -1.618   8.254  -5.925
  514    HG   LEU  71           HG       LEU  71  -1.738   7.473  -3.039
  515   HD11  LEU  71          HD11      LEU  71   0.563   8.017  -3.105
  516   HD12  LEU  71          HD12      LEU  71  -0.229   9.517  -2.618
  517   HD13  LEU  71          HD13      LEU  71   0.311   9.304  -4.284
  518   HD21  LEU  71          HD21      LEU  71  -2.038  10.242  -4.137
  519   HD22  LEU  71          HD22      LEU  71  -2.934   9.450  -2.841
  520   HD23  LEU  71          HD23      LEU  71  -3.287   9.059  -4.524
  521    H    GLU  72           H        GLU  72  -3.383   6.880  -7.506
  522    HA   GLU  72           HA       GLU  72  -2.267   4.479  -8.835
  523    HB2  GLU  72           HB3      GLU  72  -3.806   5.619 -10.755
  524    HB3  GLU  72           HB2      GLU  72  -4.421   4.476  -9.562
  525    HG2  GLU  72           HG3      GLU  72  -5.342   6.163  -8.218
  526    HG3  GLU  72           HG2      GLU  72  -4.332   7.417  -8.929
  527    H    ARG  73           H        ARG  73  -2.564   7.910  -9.512
  528    HA   ARG  73           HA       ARG  73   0.179   8.227 -10.306
  529    HB2  ARG  73           HB3      ARG  73  -1.085   6.870 -12.247
  530    HB3  ARG  73           HB2      ARG  73  -1.567   8.496 -12.714
  531    HG2  ARG  73           HG3      ARG  73   0.486   7.979 -13.877
  532    HG3  ARG  73           HG2      ARG  73   0.849   9.177 -12.638
  533    HD2  ARG  73           HD3      ARG  73   2.179   7.745 -11.474
  534    HD3  ARG  73           HD2      ARG  73   1.100   6.376 -11.728
  535    HE   ARG  73           HE       ARG  73   2.429   5.768 -13.572
  536   HH11  ARG  73          HH22      ARG  73   2.837   9.089 -12.734
  537   HH12  ARG  73          HH21      ARG  73   4.102   9.361 -13.885
  538   HH21  ARG  73          HH11      ARG  73   4.079   6.106 -15.079
  539   HH22  ARG  73          HH12      ARG  73   4.805   7.674 -15.212
  540    H    GLY  74           H        GLY  74  -3.130   9.446 -10.758
  541    HA2  GLY  74           HA3      GLY  74  -2.104  12.197 -11.054
  542    HA3  GLY  74           HA2      GLY  74  -3.793  11.708 -11.177
  543    H    GLY  75           H        GLY  75  -1.646  10.775  -8.562
  544    HA2  GLY  75           HA3      GLY  75  -1.771  11.198  -6.258
  545    HA3  GLY  75           HA2      GLY  75  -2.327  12.813  -6.698
  546    H    LEU  76           H        LEU  76  -4.155  10.137  -7.898
  547    HA   LEU  76           HA       LEU  76  -6.468  11.002  -6.312
  548    HB2  LEU  76           HB3      LEU  76  -6.036   9.606  -8.785
  549    HB3  LEU  76           HB2      LEU  76  -7.031   8.597  -7.734
  550    HG   LEU  76           HG       LEU  76  -7.583  11.521  -8.319
  551   HD11  LEU  76          HD11      LEU  76  -8.132   9.115  -9.848
  552   HD12  LEU  76          HD12      LEU  76  -8.437  10.798 -10.276
  553   HD13  LEU  76          HD13      LEU  76  -9.632   9.895  -9.346
  554   HD21  LEU  76          HD21      LEU  76  -9.084  11.363  -6.646
  555   HD22  LEU  76          HD22      LEU  76  -8.508   9.732  -6.303
  556   HD23  LEU  76          HD23      LEU  76  -9.838   9.977  -7.434
  557    H    THR  77           H        THR  77  -6.147  10.368  -4.174
  558    HA   THR  77           HA       THR  77  -4.939   7.985  -3.272
  559    HB   THR  77           HB       THR  77  -7.265   8.829  -1.689
  560    HG1  THR  77           HG1      THR  77  -6.661  10.769  -2.815
  561   HG21  THR  77          HG21      THR  77  -5.700   8.772   0.086
  562   HG22  THR  77          HG22      THR  77  -4.334   9.012  -1.005
  563   HG23  THR  77          HG23      THR  77  -5.196   7.472  -0.994
  564    H    LEU  78           H        LEU  78  -5.611   5.878  -3.205
  565    HA   LEU  78           HA       LEU  78  -8.300   5.273  -4.324
  566    HB2  LEU  78           HB3      LEU  78  -6.009   3.378  -3.754
  567    HB3  LEU  78           HB2      LEU  78  -7.438   3.036  -4.706
  568    HG   LEU  78           HG       LEU  78  -5.426   5.190  -5.409
  569   HD11  LEU  78          HD11      LEU  78  -5.263   2.334  -5.708
  570   HD12  LEU  78          HD12      LEU  78  -4.110   3.564  -6.222
  571   HD13  LEU  78          HD13      LEU  78  -5.417   3.076  -7.301
  572   HD21  LEU  78          HD21      LEU  78  -8.038   4.356  -6.464
  573   HD22  LEU  78          HD22      LEU  78  -6.777   4.389  -7.693
  574   HD23  LEU  78          HD23      LEU  78  -7.135   5.838  -6.753
  575    H    MET  79           H        MET  79  -6.187   4.458  -1.564
  576    HA   MET  79           HA       MET  79  -8.603   4.066   0.092
  577    HB2  MET  79           HB3      MET  79  -8.073   1.859  -0.988
  578    HB3  MET  79           HB2      MET  79  -6.522   1.876  -0.160
  579    HG2  MET  79           HG3      MET  79  -7.982   0.596   1.232
  580    HG3  MET  79           HG2      MET  79  -7.847   2.168   2.014
  581    HE1  MET  79           HE1      MET  79 -10.391  -0.484   1.356
  582    HE2  MET  79           HE2      MET  79  -9.665  -0.157  -0.225
  583    HE3  MET  79           HE3      MET  79 -11.378   0.155   0.043
  584    H    LEU  80           H        LEU  80  -8.231   4.610   2.205
  585    HA   LEU  80           HA       LEU  80  -5.481   5.494   2.899
  586    HB2  LEU  80           HB3      LEU  80  -7.199   7.167   3.264
  587    HB3  LEU  80           HB2      LEU  80  -8.190   6.020   4.161
  588    HG   LEU  80           HG       LEU  80  -6.569   5.933   5.965
  589   HD11  LEU  80          HD11      LEU  80  -4.591   7.630   5.739
  590   HD12  LEU  80          HD12      LEU  80  -4.882   7.476   4.005
  591   HD13  LEU  80          HD13      LEU  80  -4.452   6.056   4.957
  592   HD21  LEU  80          HD21      LEU  80  -6.532   8.376   6.610
  593   HD22  LEU  80          HD22      LEU  80  -8.120   7.775   6.128
  594   HD23  LEU  80          HD23      LEU  80  -7.166   8.744   5.005
  595    H    LEU  81           H        LEU  81  -4.502   3.507   3.445
  596    HA   LEU  81           HA       LEU  81  -5.819   1.645   5.273
  597    HB2  LEU  81           HB3      LEU  81  -3.495   1.640   3.556
  598    HB3  LEU  81           HB2      LEU  81  -3.040   1.097   5.166
  599    HG   LEU  81           HG       LEU  81  -4.964  -0.515   5.101
  600   HD11  LEU  81          HD11      LEU  81  -5.256  -0.503   2.222
  601   HD12  LEU  81          HD12      LEU  81  -5.712   1.064   2.887
  602   HD13  LEU  81          HD13      LEU  81  -6.505  -0.403   3.460
  603   HD21  LEU  81          HD21      LEU  81  -2.477  -0.630   3.697
  604   HD22  LEU  81          HD22      LEU  81  -3.687  -1.461   2.722
  605   HD23  LEU  81          HD23      LEU  81  -3.397  -1.966   4.386
  606    H    GLY  82           H        GLY  82  -5.826   1.878   7.449
  607    HA2  GLY  82           HA3      GLY  82  -3.927   3.827   8.673
  608    HA3  GLY  82           HA2      GLY  82  -5.467   3.344   9.370
  609    H    ARG  83           H        ARG  83  -2.559   3.234  10.324
  610    HA   ARG  83           HA       ARG  83  -1.896   0.431  10.638
  611    HB2  ARG  83           HB3      ARG  83  -0.360   2.509  10.872
  612    HB3  ARG  83           HB2      ARG  83  -1.004   2.623  12.498
  613    HG2  ARG  83           HG3      ARG  83  -0.391  -0.002  12.460
  614    HG3  ARG  83           HG2      ARG  83   0.802   0.583  11.301
  615    HD2  ARG  83           HD3      ARG  83   0.512   1.257  14.211
  616    HD3  ARG  83           HD2      ARG  83   1.963   0.836  13.303
  617    HE   ARG  83           HE       ARG  83   0.753   3.363  12.465
  618   HH11  ARG  83          HH22      ARG  83   2.905   1.718  14.601
  619   HH12  ARG  83          HH21      ARG  83   3.870   3.119  14.921
  620   HH21  ARG  83          HH11      ARG  83   2.002   5.201  12.872
  621   HH22  ARG  83          HH12      ARG  83   3.359   5.092  13.943
  622    H    GLN  84           H        GLN  84  -2.898  -0.986  12.032
  623    HA   GLN  84           HA       GLN  84  -4.568   0.168  14.225
  624    HB2  GLN  84           HB3      GLN  84  -4.732  -2.292  12.542
  625    HB3  GLN  84           HB2      GLN  84  -5.375  -2.361  14.182
  626    HG2  GLN  84           HG3      GLN  84  -6.092  -0.114  12.297
  627    HG3  GLN  84           HG2      GLN  84  -7.006  -1.622  12.328
  628   HE21  GLN  84          HE22      GLN  84  -6.987   1.448  13.646
  629   HE22  GLN  84          HE21      GLN  84  -7.833   1.133  15.084
  630    H    GLY  85           H        GLY  85  -1.941  -2.074  13.533
  631    HA2  GLY  85           HA3      GLY  85  -1.683  -2.648  16.461
  632    HA3  GLY  85           HA2      GLY  85  -1.042  -3.679  15.183
  633    H    GLU  86           H        GLU  86   1.022  -3.286  14.439
  634    HA   GLU  86           HA       GLU  86   2.287  -0.685  15.046
  635    HB2  GLU  86           HB3      GLU  86   2.933  -2.104  16.938
  636    HB3  GLU  86           HB2      GLU  86   3.435  -3.381  15.830
  637    HG2  GLU  86           HG3      GLU  86   5.329  -2.228  15.139
  638    HG3  GLU  86           HG2      GLU  86   4.635  -0.653  15.522
  639    H    GLY  87           H        GLY  87   1.593  -3.200  13.069
  640    HA2  GLY  87           HA3      GLY  87   3.212  -2.164  10.880
  641    HA3  GLY  87           HA2      GLY  87   3.712  -3.769  11.404
  642    H    ASP  88           H        ASP  88   0.414  -3.247  11.940
  643    HA   ASP  88           HA       ASP  88  -0.290  -4.704   9.421
  644    HB2  ASP  88           HB3      ASP  88  -2.210  -4.904  11.625
  645    HB3  ASP  88           HB2      ASP  88  -1.503  -6.183  10.637
  646    H    TYR  89           H        TYR  89  -1.235  -3.230   8.099
  647    HA   TYR  89           HA       TYR  89  -2.954  -1.123   9.305
  648    HB2  TYR  89           HB3      TYR  89  -1.881  -1.285   6.484
  649    HB3  TYR  89           HB2      TYR  89  -2.716   0.064   7.200
  650    HD1  TYR  89           HD1      TYR  89   0.304  -2.113   7.887
  651    HD2  TYR  89           HD2      TYR  89  -1.439   1.821   8.031
  652    HE1  TYR  89           HE1      TYR  89   2.447  -1.187   8.689
  653    HE2  TYR  89           HE2      TYR  89   0.720   2.739   8.826
  654    HH   TYR  89           HH       TYR  89   3.630   0.846   8.844
  655    H    ARG  90           H        ARG  90  -5.088  -1.255   9.055
  656    HA   ARG  90           HA       ARG  90  -6.198  -3.069   6.955
  657    HB2  ARG  90           HB3      ARG  90  -7.911  -3.025   9.254
  658    HB3  ARG  90           HB2      ARG  90  -7.070  -4.404   8.548
  659    HG2  ARG  90           HG3      ARG  90  -5.065  -3.904   9.846
  660    HG3  ARG  90           HG2      ARG  90  -5.807  -2.441  10.482
  661    HD2  ARG  90           HD3      ARG  90  -5.938  -4.286  12.113
  662    HD3  ARG  90           HD2      ARG  90  -7.542  -3.774  11.591
  663    HE   ARG  90           HE       ARG  90  -7.813  -5.869  10.501
  664   HH11  ARG  90          HH22      ARG  90  -4.570  -5.298  11.533
  665   HH12  ARG  90          HH21      ARG  90  -4.056  -6.928  11.258
  666   HH21  ARG  90          HH11      ARG  90  -7.156  -8.000  10.139
  667   HH22  ARG  90          HH12      ARG  90  -5.517  -8.458  10.470
  668    H    VAL  91           H        VAL  91  -8.509  -2.553   6.464
  669    HA   VAL  91           HA       VAL  91  -9.397   0.151   7.279
  670    HB   VAL  91           HB       VAL  91  -7.957   0.298   5.158
  671   HG11  VAL  91          HG11      VAL  91 -10.420  -0.810   3.815
  672   HG12  VAL  91          HG12      VAL  91  -9.077  -1.860   4.262
  673   HG13  VAL  91          HG13      VAL  91  -8.822  -0.538   3.123
  674   HG21  VAL  91          HG21      VAL  91  -9.477   2.095   5.770
  675   HG22  VAL  91          HG22      VAL  91 -10.857   1.190   5.148
  676   HG23  VAL  91          HG23      VAL  91  -9.631   1.803   4.038
  677    H    GLN  92           H        GLN  92 -11.674   0.452   6.948
  678    HA   GLN  92           HA       GLN  92 -13.191  -2.043   6.958
  679    HB2  GLN  92           HB3      GLN  92 -14.162   0.833   6.949
  680    HB3  GLN  92           HB2      GLN  92 -15.143  -0.589   7.312
  681    HG2  GLN  92           HG3      GLN  92 -14.560  -0.196   9.471
  682    HG3  GLN  92           HG2      GLN  92 -13.014  -0.920   9.022
  683   HE21  GLN  92          HE22      GLN  92 -13.513   1.279  11.004
  684   HE22  GLN  92          HE21      GLN  92 -12.588   2.596  10.465
  685    H    LYS  93           H        LYS  93 -13.705  -3.047   5.072
  686    HA   LYS  93           HA       LYS  93 -13.858  -1.460   2.580
  687    HB2  LYS  93           HB3      LYS  93 -12.692  -3.775   2.867
  688    HB3  LYS  93           HB2      LYS  93 -14.328  -4.429   2.769
  689    HG2  LYS  93           HG3      LYS  93 -14.648  -3.205   0.618
  690    HG3  LYS  93           HG2      LYS  93 -12.966  -2.679   0.701
  691    HD2  LYS  93           HD3      LYS  93 -12.550  -4.578  -0.477
  692    HD3  LYS  93           HD2      LYS  93 -12.698  -5.372   1.090
  693    HE2  LYS  93           HE3      LYS  93 -14.833  -5.062  -1.031
  694    HE3  LYS  93           HE2      LYS  93 -14.153  -6.559  -0.396
  695    HZ1  LYS  93           HZ1      LYS  93 -16.405  -5.786   0.490
  696    HZ2  LYS  93           HZ2      LYS  93 -15.524  -4.641   1.378
  697    HZ3  LYS  93           HZ3      LYS  93 -15.242  -6.300   1.617
  698    H    GLY  94           H        GLY  94 -15.891  -0.507   3.844
  699    HA2  GLY  94           HA3      GLY  94 -18.214  -0.190   3.586
  700    HA3  GLY  94           HA2      GLY  94 -18.230  -1.557   2.471
  701    H    ASP  95           H        ASP  95 -18.471  -3.689   3.340
  702    HA   ASP  95           HA       ASP  95 -18.651  -4.202   6.171
  703    HB2  ASP  95           HB3      ASP  95 -21.120  -3.417   4.693
  704    HB3  ASP  95           HB2      ASP  95 -21.253  -4.775   5.812
  705    H    GLY  96           H        GLY  96 -17.235  -5.854   5.078
  706    HA2  GLY  96           HA3      GLY  96 -18.041  -8.404   5.082
  707    HA3  GLY  96           HA2      GLY  96 -18.701  -7.905   3.525
  708    H    GLY  97           H        GLY  97 -15.606  -7.693   5.325
  709    HA2  GLY  97           HA3      GLY  97 -13.854  -9.115   3.928
  710    HA3  GLY  97           HA2      GLY  97 -14.158  -7.852   2.735
  711    H    GLN  98           H        GLN  98 -12.400  -8.715   5.520
  712    HA   GLN  98           HA       GLN  98 -11.604  -5.901   6.061
  713    HB2  GLN  98           HB3      GLN  98 -12.184  -7.804   7.846
  714    HB3  GLN  98           HB2      GLN  98 -10.482  -8.195   7.607
  715    HG2  GLN  98           HG3      GLN  98  -9.859  -5.863   8.090
  716    HG3  GLN  98           HG2      GLN  98 -11.561  -5.464   8.344
  717   HE21  GLN  98          HE22      GLN  98 -11.085  -4.912  10.624
  718   HE22  GLN  98          HE21      GLN  98 -10.823  -6.138  11.768
  719    H    LEU  99           H        LEU  99  -9.868  -5.143   5.063
  720    HA   LEU  99           HA       LEU  99  -7.970  -6.986   3.777
  721    HB2  LEU  99           HB3      LEU  99  -7.867  -3.965   3.888
  722    HB3  LEU  99           HB2      LEU  99  -7.076  -5.020   2.725
  723    HG   LEU  99           HG       LEU  99 -10.068  -4.711   3.054
  724   HD11  LEU  99          HD11      LEU  99  -9.216  -3.995   0.463
  725   HD12  LEU  99          HD12      LEU  99  -8.098  -3.201   1.571
  726   HD13  LEU  99          HD13      LEU  99  -9.832  -2.916   1.715
  727   HD21  LEU  99          HD21      LEU  99  -8.323  -6.559   1.500
  728   HD22  LEU  99          HD22      LEU  99  -9.742  -5.921   0.672
  729   HD23  LEU  99          HD23      LEU  99  -9.930  -6.831   2.171
  730    H    VAL 100           H        VAL 100  -5.809  -7.205   4.419
  731    HA   VAL 100           HA       VAL 100  -4.918  -5.683   6.820
  732    HB   VAL 100           HB       VAL 100  -4.602  -8.685   6.614
  733   HG11  VAL 100          HG11      VAL 100  -4.157  -8.422   9.060
  734   HG12  VAL 100          HG12      VAL 100  -4.271  -6.674   8.857
  735   HG13  VAL 100          HG13      VAL 100  -2.984  -7.572   8.054
  736   HG21  VAL 100          HG21      VAL 100  -6.998  -8.162   6.756
  737   HG22  VAL 100          HG22      VAL 100  -6.695  -7.079   8.114
  738   HG23  VAL 100          HG23      VAL 100  -6.429  -8.814   8.293
  739    H    LEU 101           H        LEU 101  -3.067  -4.718   6.097
  740    HA   LEU 101           HA       LEU 101  -1.327  -6.157   4.147
  741    HB2  LEU 101           HB3      LEU 101  -1.963  -3.730   3.785
  742    HB3  LEU 101           HB2      LEU 101  -1.086  -3.366   5.253
  743    HG   LEU 101           HG       LEU 101   0.622  -4.958   3.637
  744   HD11  LEU 101          HD11      LEU 101  -0.628  -2.575   2.236
  745   HD12  LEU 101          HD12      LEU 101  -0.700  -4.253   1.708
  746   HD13  LEU 101          HD13      LEU 101   0.836  -3.393   1.695
  747   HD21  LEU 101          HD21      LEU 101   2.071  -2.999   3.825
  748   HD22  LEU 101          HD22      LEU 101   1.248  -3.263   5.362
  749   HD23  LEU 101          HD23      LEU 101   0.696  -1.993   4.271
  750    H    ARG 102           H        ARG 102   0.342  -7.381   5.054
  751    HA   ARG 102           HA       ARG 102   1.734  -6.240   7.425
  752    HB2  ARG 102           HB3      ARG 102  -0.036  -8.159   7.885
  753    HB3  ARG 102           HB2      ARG 102   1.259  -9.193   7.278
  754    HG2  ARG 102           HG3      ARG 102   2.812  -8.126   8.931
  755    HG3  ARG 102           HG2      ARG 102   1.435  -7.250   9.598
  756    HD2  ARG 102           HD3      ARG 102   1.545  -9.138  10.984
  757    HD3  ARG 102           HD2      ARG 102   0.341  -9.615   9.787
  758    HE   ARG 102           HE       ARG 102   1.872 -11.214   8.949
  759   HH11  ARG 102          HH22      ARG 102   3.359  -8.924  11.052
  760   HH12  ARG 102          HH21      ARG 102   4.866  -9.773  11.130
  761   HH21  ARG 102          HH11      ARG 102   3.832 -12.338   9.038
  762   HH22  ARG 102          HH12      ARG 102   5.133 -11.707   9.990
  763    H    ARG 103           H        ARG 103   3.886  -6.439   7.307
  764    HA   ARG 103           HA       ARG 103   5.315  -6.843   5.000
  765    HB2  ARG 103           HB3      ARG 103   7.194  -7.680   6.622
  766    HB3  ARG 103           HB2      ARG 103   6.608  -6.027   6.752
  767    HG2  ARG 103           HG3      ARG 103   5.084  -8.001   8.346
  768    HG3  ARG 103           HG2      ARG 103   6.759  -7.785   8.846
  769    HD2  ARG 103           HD3      ARG 103   4.973  -5.411   8.319
  770    HD3  ARG 103           HD2      ARG 103   5.013  -6.201   9.897
  771    HE   ARG 103           HE       ARG 103   7.693  -5.704   9.202
  772   HH11  ARG 103          HH22      ARG 103   4.765  -3.962   9.729
  773   HH12  ARG 103          HH21      ARG 103   5.561  -2.540  10.315
  774   HH21  ARG 103          HH11      ARG 103   8.748  -3.858   9.961
  775   HH22  ARG 103          HH12      ARG 103   7.816  -2.481  10.447
  776    H    ALA 104           H        ALA 104   5.850  -8.569   3.738
  777    HA   ALA 104           HA       ALA 104   4.650 -11.097   3.999
  778    HB1  ALA 104           HB1      ALA 104   5.812 -10.143   1.949
  779    HB2  ALA 104           HB2      ALA 104   6.142 -11.845   2.271
  780    HB3  ALA 104           HB3      ALA 104   7.339 -10.619   2.691
  781    H    THR 105           H        THR 105   5.124 -12.894   5.198
  782    HA   THR 105           HA       THR 105   7.379 -12.714   7.096
  783    HB   THR 105           HB       THR 105   5.872 -13.756   8.413
  784    HG1  THR 105           HG1      THR 105   5.336 -16.032   7.410
  785   HG21  THR 105          HG21      THR 105   4.096 -12.935   6.931
  786   HG22  THR 105          HG22      THR 105   3.700 -14.547   7.527
  787   HG23  THR 105          HG23      THR 105   4.306 -14.339   5.883
  788    HA   PRO 106           HA       PRO 106  10.044 -15.484   4.935
  789    HB2  PRO 106           HB2      PRO 106  11.024 -17.078   6.944
  790    HB3  PRO 106           HB3      PRO 106  11.528 -15.396   6.689
  791    HG2  PRO 106           HG3      PRO 106   9.607 -16.518   8.660
  792    HG3  PRO 106           HG2      PRO 106  10.785 -15.207   8.846
  793    HD2  PRO 106           HD3      PRO 106   8.108 -14.763   8.471
  794    HD3  PRO 106           HD2      PRO 106   9.365 -13.621   7.946
  Start of MODEL   10
    1    H1   SER   1           H        SER   1  11.529  22.199  -2.150
    2    H2   SER   1           H2       SER   1  10.662  21.317  -3.314
    3    H3   SER   1           1HT      SER   1  12.111  22.097  -3.740
    4    HA   SER   1           HA       SER   1  11.161  24.225  -3.567
    5    HB2  SER   1           HB3      SER   1  10.170  23.918  -5.566
    6    HB3  SER   1           HB2      SER   1  10.043  22.192  -5.242
    7    HG   SER   1           HG       SER   1   8.006  22.457  -4.806
    8    H    SER   2           H        SER   2   9.505  21.778  -1.786
    9    HA   SER   2           HA       SER   2   8.112  23.865  -0.240
   10    HB2  SER   2           HB3      SER   2   6.410  23.410  -1.876
   11    HB3  SER   2           HB2      SER   2   6.665  21.672  -1.748
   12    HG   SER   2           HG       SER   2   5.387  23.450   0.000
   13    H    LEU   3           H        LEU   3  10.032  22.726   0.993
   14    HA   LEU   3           HA       LEU   3  10.707  21.254   2.697
   15    HB2  LEU   3           HB3      LEU   3   7.715  21.087   3.161
   16    HB3  LEU   3           HB2      LEU   3   8.978  20.720   4.334
   17    HG   LEU   3           HG       LEU   3   9.572  23.298   3.366
   18   HD11  LEU   3          HD11      LEU   3   7.488  24.530   3.808
   19   HD12  LEU   3          HD12      LEU   3   6.638  23.010   4.084
   20   HD13  LEU   3          HD13      LEU   3   7.262  23.393   2.478
   21   HD21  LEU   3          HD21      LEU   3   8.993  23.951   5.698
   22   HD22  LEU   3          HD22      LEU   3   9.963  22.479   5.647
   23   HD23  LEU   3          HD23      LEU   3   8.225  22.380   5.927
   24    H    ILE   4           H        ILE   4  11.522  19.477   1.561
   25    HA   ILE   4           HA       ILE   4   9.675  17.454   0.486
   26    HB   ILE   4           HB       ILE   4  12.675  17.190   0.727
   27   HG12  ILE   4          HG13      ILE   4  12.369  19.344  -0.295
   28   HG13  ILE   4          HG12      ILE   4  12.693  18.211  -1.607
   29   HG21  ILE   4          HG21      ILE   4  10.816  16.250  -1.463
   30   HG22  ILE   4          HG22      ILE   4  11.125  15.283  -0.021
   31   HG23  ILE   4          HG23      ILE   4  12.452  15.692  -1.108
   32   HD11  ILE   4          HD11      ILE   4  10.830  19.457  -2.369
   33   HD12  ILE   4          HD12      ILE   4  10.052  19.420  -0.786
   34   HD13  ILE   4          HD13      ILE   4  10.126  17.956  -1.767
   35    H    LEU   5           H        LEU   5   9.412  15.365   1.352
   36    HA   LEU   5           HA       LEU   5   9.809  15.138   4.225
   37    HB2  LEU   5           HB3      LEU   5   8.986  12.939   2.311
   38    HB3  LEU   5           HB2      LEU   5   8.645  13.044   4.037
   39    HG   LEU   5           HG       LEU   5   7.636  15.431   3.039
   40   HD11  LEU   5          HD11      LEU   5   7.973  14.419   0.740
   41   HD12  LEU   5          HD12      LEU   5   6.311  14.885   1.102
   42   HD13  LEU   5          HD13      LEU   5   6.789  13.190   1.185
   43   HD21  LEU   5          HD21      LEU   5   5.412  14.267   3.384
   44   HD22  LEU   5          HD22      LEU   5   6.535  14.112   4.737
   45   HD23  LEU   5          HD23      LEU   5   6.310  12.767   3.618
   46    H    LEU   6           H        LEU   6  10.596  12.591   4.729
   47    HA   LEU   6           HA       LEU   6  13.455  12.689   4.008
   48    HB2  LEU   6           HB3      LEU   6  13.502  10.654   5.600
   49    HB3  LEU   6           HB2      LEU   6  13.103  12.221   6.306
   50    HG   LEU   6           HG       LEU   6  10.779  10.753   5.247
   51   HD11  LEU   6          HD11      LEU   6  12.048   8.843   6.105
   52   HD12  LEU   6          HD12      LEU   6  10.705   9.198   7.192
   53   HD13  LEU   6          HD13      LEU   6  12.342   9.693   7.623
   54   HD21  LEU   6          HD21      LEU   6   9.819  11.517   7.379
   55   HD22  LEU   6          HD22      LEU   6  10.666  12.845   6.584
   56   HD23  LEU   6          HD23      LEU   6  11.419  12.003   7.939
   57    H    SER   7           H        SER   7  14.362  10.244   3.737
   58    HA   SER   7           HA       SER   7  12.997   9.240   1.307
   59    HB2  SER   7           HB3      SER   7  15.723   8.784   2.522
   60    HB3  SER   7           HB2      SER   7  15.117   7.774   1.212
   61    HG   SER   7           HG       SER   7  16.023   9.375   0.115
   62    H    ALA   8           H        ALA   8  12.995   6.756   1.084
   63    HA   ALA   8           HA       ALA   8  11.784   5.642   3.551
   64    HB1  ALA   8           HB1      ALA   8  10.591   5.463   1.355
   65    HB2  ALA   8           HB2      ALA   8  10.905   3.896   2.101
   66    HB3  ALA   8           HB3      ALA   8  11.911   4.454   0.763
   67    H    SER   9           H        SER   9  13.114   4.531   4.882
   68    HA   SER   9           HA       SER   9  15.186   2.748   3.669
   69    HB2  SER   9           HB3      SER   9  16.523   3.418   5.836
   70    HB3  SER   9           HB2      SER   9  16.577   4.460   4.418
   71    HG   SER   9           HG       SER   9  14.644   4.751   6.466
   72    H    ASP  10           H        ASP  10  12.617   3.193   5.842
   73    HA   ASP  10           HA       ASP  10  13.379   0.825   7.481
   74    HB2  ASP  10           HB3      ASP  10  10.856   2.415   7.862
   75    HB3  ASP  10           HB2      ASP  10  11.811   1.545   9.062
   76    H    LEU  11           H        LEU  11  11.597   1.644   4.727
   77    HA   LEU  11           HA       LEU  11   9.959  -0.856   4.952
   78    HB2  LEU  11           HB3      LEU  11   9.284   1.548   3.243
   79    HB3  LEU  11           HB2      LEU  11   8.236   0.195   3.663
   80    HG   LEU  11           HG       LEU  11   9.341   2.236   5.619
   81   HD11  LEU  11          HD11      LEU  11   7.612   3.171   4.144
   82   HD12  LEU  11          HD12      LEU  11   6.983   2.969   5.779
   83   HD13  LEU  11          HD13      LEU  11   6.546   1.816   4.517
   84   HD21  LEU  11          HD21      LEU  11   7.325   0.989   6.918
   85   HD22  LEU  11          HD22      LEU  11   8.998   0.445   7.016
   86   HD23  LEU  11          HD23      LEU  11   7.878  -0.343   5.905
   87    H    ALA  12           H        ALA  12   9.206  -0.454   2.083
   88    HA   ALA  12           HA       ALA  12   9.992  -1.065  -0.038
   89    HB1  ALA  12           HB1      ALA  12  12.828  -0.554   0.814
   90    HB2  ALA  12           HB2      ALA  12  11.719   0.805   0.657
   91    HB3  ALA  12           HB3      ALA  12  12.050  -0.228  -0.733
   92    H    GLY  13           H        GLY  13   9.396  -3.275   0.598
   93    HA2  GLY  13           HA3      GLY  13  11.680  -5.087   0.421
   94    HA3  GLY  13           HA2      GLY  13  10.806  -5.191   1.948
   95    H    GLN  14           H        GLN  14   9.330  -6.842   1.913
   96    HA   GLN  14           HA       GLN  14   7.723  -7.219  -0.570
   97    HB2  GLN  14           HB3      GLN  14   9.589  -9.008  -0.039
   98    HB3  GLN  14           HB2      GLN  14   8.450  -9.539   1.200
   99    HG2  GLN  14           HG3      GLN  14   6.701  -9.432  -0.763
  100    HG3  GLN  14           HG2      GLN  14   8.133  -9.545  -1.787
  101   HE21  GLN  14          HE22      GLN  14   5.892 -11.403  -0.008
  102   HE22  GLN  14          HE21      GLN  14   6.758 -12.864   0.015
  103    H    TRP  15           H        TRP  15   5.518  -7.699  -0.114
  104    HA   TRP  15           HA       TRP  15   4.742  -7.961   2.733
  105    HB2  TRP  15           HB3      TRP  15   3.728  -5.758   0.913
  106    HB3  TRP  15           HB2      TRP  15   3.047  -6.147   2.481
  107    HD1  TRP  15           HD1      TRP  15   6.503  -5.072   1.011
  108    HE1  TRP  15           HE1      TRP  15   7.681  -3.633   2.786
  109    HE3  TRP  15           HE3      TRP  15   3.068  -5.317   4.795
  110    HZ2  TRP  15           HZ2      TRP  15   7.237  -2.695   5.447
  111    HZ3  TRP  15           HZ3      TRP  15   3.476  -4.135   6.936
  112    HH2  TRP  15           HH2      TRP  15   5.554  -2.824   7.264
  113    H    THR  16           H        THR  16   2.156  -8.065   2.701
  114    HA   THR  16           HA       THR  16   1.182  -9.428   0.249
  115    HB   THR  16           HB       THR  16   0.306 -11.312   1.766
  116    HG1  THR  16           HG1      THR  16   0.938 -10.095   3.690
  117   HG21  THR  16          HG21      THR  16   2.373 -12.586   1.530
  118   HG22  THR  16          HG22      THR  16   3.302 -11.096   1.376
  119   HG23  THR  16          HG23      THR  16   2.159 -11.557   0.116
  120    H    LEU  17           H        LEU  17  -1.221  -9.918   0.503
  121    HA   LEU  17           HA       LEU  17  -2.502  -7.850   2.259
  122    HB2  LEU  17           HB3      LEU  17  -2.651  -8.195  -0.542
  123    HB3  LEU  17           HB2      LEU  17  -4.202  -8.740   0.098
  124    HG   LEU  17           HG       LEU  17  -4.322  -6.610   1.430
  125   HD11  LEU  17          HD11      LEU  17  -2.545  -5.237   1.546
  126   HD12  LEU  17          HD12      LEU  17  -2.472  -5.122  -0.213
  127   HD13  LEU  17          HD13      LEU  17  -1.621  -6.422   0.621
  128   HD21  LEU  17          HD21      LEU  17  -5.620  -6.552  -0.524
  129   HD22  LEU  17          HD22      LEU  17  -4.208  -6.631  -1.578
  130   HD23  LEU  17          HD23      LEU  17  -4.583  -5.139  -0.716
  131    H    GLN  18           H        GLN  18  -4.673  -8.455   3.066
  132    HA   GLN  18           HA       GLN  18  -5.279 -11.360   3.021
  133    HB2  GLN  18           HB3      GLN  18  -3.812 -10.330   5.104
  134    HB3  GLN  18           HB2      GLN  18  -5.460 -10.187   5.716
  135    HG2  GLN  18           HG3      GLN  18  -4.682 -12.367   6.354
  136    HG3  GLN  18           HG2      GLN  18  -5.813 -12.603   5.022
  137   HE21  GLN  18          HE22      GLN  18  -5.030 -13.692   3.189
  138   HE22  GLN  18          HE21      GLN  18  -3.394 -14.059   2.920
  139    H    GLN  19           H        GLN  19  -7.396 -11.471   2.515
  140    HA   GLN  19           HA       GLN  19  -9.192  -9.186   3.027
  141    HB2  GLN  19           HB3      GLN  19  -9.437 -10.335   0.899
  142    HB3  GLN  19           HB2      GLN  19  -9.560 -11.894   1.695
  143    HG2  GLN  19           HG3      GLN  19 -11.724 -11.540   2.389
  144    HG3  GLN  19           HG2      GLN  19 -11.527  -9.788   2.466
  145   HE21  GLN  19          HE22      GLN  19 -12.004  -8.559   0.568
  146   HE22  GLN  19          HE21      GLN  19 -12.580  -9.259  -0.867
  147    H    ASP  20           H        ASP  20 -10.905  -9.245   4.617
  148    HA   ASP  20           HA       ASP  20 -10.605 -10.695   6.943
  149    HB2  ASP  20           HB3      ASP  20 -12.404  -8.851   6.036
  150    HB3  ASP  20           HB2      ASP  20 -13.415 -10.286   6.147
  151    H    GLU  21           H        GLU  21 -12.407 -11.737   4.042
  152    HA   GLU  21           HA       GLU  21 -13.445 -14.073   5.390
  153    HB2  GLU  21           HB3      GLU  21 -13.553 -12.976   2.651
  154    HB3  GLU  21           HB2      GLU  21 -13.551 -14.741   2.722
  155    HG2  GLU  21           HG3      GLU  21 -15.501 -14.805   4.048
  156    HG3  GLU  21           HG2      GLU  21 -15.362 -13.102   4.491
  157    H    ALA  22           H        ALA  22 -10.854 -13.765   2.876
  158    HA   ALA  22           HA       ALA  22  -8.757 -15.011   3.953
  159    HB1  ALA  22           HB1      ALA  22  -9.610 -16.930   4.858
  160    HB2  ALA  22           HB2      ALA  22  -9.221 -17.535   3.250
  161    HB3  ALA  22           HB3      ALA  22 -10.874 -17.087   3.643
  162    HA   PRO  23           HA       PRO  23  -8.642 -16.853  -0.570
  163    HB2  PRO  23           HB2      PRO  23 -10.833 -16.016  -2.105
  164    HB3  PRO  23           HB3      PRO  23 -10.584 -17.647  -1.452
  165    HG2  PRO  23           HG3      PRO  23 -12.238 -15.417  -0.397
  166    HG3  PRO  23           HG2      PRO  23 -12.551 -17.162  -0.391
  167    HD2  PRO  23           HD3      PRO  23 -11.755 -15.911   1.839
  168    HD3  PRO  23           HD2      PRO  23 -11.169 -17.543   1.449
  169    H    ALA  24           H        ALA  24  -8.824 -15.577  -2.873
  170    HA   ALA  24           HA       ALA  24  -7.947 -13.715  -4.001
  171    HB1  ALA  24           HB1      ALA  24  -9.627 -12.218  -1.968
  172    HB2  ALA  24           HB2      ALA  24 -10.260 -12.928  -3.453
  173    HB3  ALA  24           HB3      ALA  24  -9.088 -11.613  -3.534
  174    H    ILE  25           H        ILE  25  -5.911 -14.524  -2.602
  175    HA   ILE  25           HA       ILE  25  -5.072 -12.380  -0.712
  176    HB   ILE  25           HB       ILE  25  -3.807 -15.055  -1.397
  177   HG12  ILE  25          HG13      ILE  25  -5.012 -14.275   1.251
  178   HG13  ILE  25          HG12      ILE  25  -6.047 -14.881  -0.043
  179   HG21  ILE  25          HG21      ILE  25  -3.046 -12.821   0.485
  180   HG22  ILE  25          HG22      ILE  25  -2.038 -13.643  -0.706
  181   HG23  ILE  25          HG23      ILE  25  -2.519 -14.480   0.770
  182   HD11  ILE  25          HD11      ILE  25  -5.002 -16.581   1.658
  183   HD12  ILE  25          HD12      ILE  25  -3.543 -16.377   0.688
  184   HD13  ILE  25          HD13      ILE  25  -5.022 -16.983  -0.059
  185    H    CYS  26           H        CYS  26  -4.218 -10.685  -1.862
  186    HA   CYS  26           HA       CYS  26  -2.668 -11.260  -4.323
  187    HB2  CYS  26           HB3      CYS  26  -3.937  -8.814  -3.138
  188    HB3  CYS  26           HB2      CYS  26  -2.643  -8.634  -4.317
  189    H    HIS  27           H        HIS  27  -0.525 -11.632  -4.020
  190    HA   HIS  27           HA       HIS  27   0.935 -10.717  -1.702
  191    HB2  HIS  27           HB3      HIS  27   1.499 -12.240  -4.149
  192    HB3  HIS  27           HB2      HIS  27   2.828 -11.177  -3.692
  193    HD1  HIS  27           HD1      HIS  27   4.421 -12.241  -2.108
  194    HD2  HIS  27           HD2      HIS  27   0.558 -13.737  -1.616
  195    HE1  HIS  27           HE1      HIS  27   4.555 -13.987  -0.276
  196    HE2  HIS  27           HE2      HIS  27   2.210 -14.904   0.031
  197    H    LEU  28           H        LEU  28   2.141  -8.801  -1.502
  198    HA   LEU  28           HA       LEU  28   2.007  -6.921  -3.835
  199    HB2  LEU  28           HB3      LEU  28   1.113  -6.650  -1.065
  200    HB3  LEU  28           HB2      LEU  28   2.216  -5.366  -1.537
  201    HG   LEU  28           HG       LEU  28  -0.178  -4.815  -2.003
  202   HD11  LEU  28          HD11      LEU  28   2.062  -4.540  -3.716
  203   HD12  LEU  28          HD12      LEU  28   0.619  -3.529  -3.667
  204   HD13  LEU  28          HD13      LEU  28   0.684  -4.921  -4.749
  205   HD21  LEU  28          HD21      LEU  28  -1.539  -6.145  -3.253
  206   HD22  LEU  28          HD22      LEU  28  -0.413  -7.409  -2.767
  207   HD23  LEU  28          HD23      LEU  28  -0.241  -6.633  -4.341
  208    H    GLU  29           H        GLU  29   3.848  -5.634  -4.200
  209    HA   GLU  29           HA       GLU  29   6.263  -6.324  -2.567
  210    HB2  GLU  29           HB3      GLU  29   5.744  -6.789  -5.375
  211    HB3  GLU  29           HB2      GLU  29   7.111  -5.692  -5.181
  212    HG2  GLU  29           HG3      GLU  29   8.151  -7.288  -3.597
  213    HG3  GLU  29           HG2      GLU  29   6.793  -8.389  -3.832
  214    H    LEU  30           H        LEU  30   6.782  -4.493  -1.518
  215    HA   LEU  30           HA       LEU  30   6.210  -1.851  -2.668
  216    HB2  LEU  30           HB3      LEU  30   7.103  -2.951  -0.058
  217    HB3  LEU  30           HB2      LEU  30   7.699  -1.343  -0.457
  218    HG   LEU  30           HG       LEU  30   5.449  -0.513  -0.760
  219   HD11  LEU  30          HD11      LEU  30   3.626  -2.347  -0.026
  220   HD12  LEU  30          HD12      LEU  30   4.811  -3.410  -0.780
  221   HD13  LEU  30          HD13      LEU  30   4.093  -2.095  -1.707
  222   HD21  LEU  30          HD21      LEU  30   5.226  -2.226   1.702
  223   HD22  LEU  30          HD22      LEU  30   4.741  -0.545   1.479
  224   HD23  LEU  30          HD23      LEU  30   6.452  -0.960   1.612
  225    H    ARG  31           H        ARG  31   7.587  -1.532  -4.440
  226    HA   ARG  31           HA       ARG  31  10.400  -2.302  -4.293
  227    HB2  ARG  31           HB3      ARG  31   8.568  -1.211  -6.318
  228    HB3  ARG  31           HB2      ARG  31  10.219  -0.604  -6.451
  229    HG2  ARG  31           HG3      ARG  31  11.114  -2.817  -6.636
  230    HG3  ARG  31           HG2      ARG  31   9.580  -3.548  -6.157
  231    HD2  ARG  31           HD3      ARG  31   8.766  -3.451  -8.264
  232    HD3  ARG  31           HD2      ARG  31   9.302  -1.784  -8.475
  233    HE   ARG  31           HE       ARG  31  11.587  -3.486  -8.584
  234   HH11  ARG  31          HH22      ARG  31   8.696  -2.693 -10.286
  235   HH12  ARG  31          HH21      ARG  31   9.348  -3.079 -11.843
  236   HH21  ARG  31          HH11      ARG  31  12.456  -3.993 -10.608
  237   HH22  ARG  31          HH12      ARG  31  11.477  -3.814 -12.026
  238    H    ASP  32           H        ASP  32  12.112  -0.570  -4.854
  239    HA   ASP  32           HA       ASP  32  11.652   1.793  -3.085
  240    HB2  ASP  32           HB3      ASP  32  13.939   1.753  -2.553
  241    HB3  ASP  32           HB2      ASP  32  13.528   0.039  -2.641
  242    H    SER  33           H        SER  33  11.421   1.133  -6.233
  243    HA   SER  33           HA       SER  33  13.171   3.111  -7.426
  244    HB2  SER  33           HB3      SER  33  12.461   1.610  -9.038
  245    HB3  SER  33           HB2      SER  33  10.858   1.450  -8.333
  246    HG   SER  33           HG       SER  33  11.466   2.871 -10.387
  247    H    GLU  34           H        GLU  34  12.902   5.294  -7.262
  248    HA   GLU  34           HA       GLU  34  10.581   6.438  -5.987
  249    HB2  GLU  34           HB3      GLU  34  11.638   8.585  -6.442
  250    HB3  GLU  34           HB2      GLU  34  12.873   7.440  -5.915
  251    HG2  GLU  34           HG3      GLU  34  13.093   6.953  -8.499
  252    HG3  GLU  34           HG2      GLU  34  12.374   8.556  -8.654
  253    H    VAL  35           H        VAL  35   9.035   7.895  -6.952
  254    HA   VAL  35           HA       VAL  35   8.789   7.750  -9.922
  255    HB   VAL  35           HB       VAL  35   6.454   7.252  -8.058
  256   HG11  VAL  35          HG11      VAL  35   6.749   6.656 -11.011
  257   HG12  VAL  35          HG12      VAL  35   6.104   8.184 -10.411
  258   HG13  VAL  35          HG13      VAL  35   5.266   6.676 -10.055
  259   HG21  VAL  35          HG21      VAL  35   8.392   5.364  -9.380
  260   HG22  VAL  35          HG22      VAL  35   6.722   4.869  -9.103
  261   HG23  VAL  35          HG23      VAL  35   7.745   5.316  -7.739
  262    H    ALA  36           H        ALA  36   8.906   9.888 -10.444
  263    HA   ALA  36           HA       ALA  36   7.967  11.969  -8.638
  264    HB1  ALA  36           HB1      ALA  36   9.898  12.215 -10.252
  265    HB2  ALA  36           HB2      ALA  36   8.709  13.516 -10.331
  266    HB3  ALA  36           HB3      ALA  36   8.715  12.251 -11.559
  267    H    GLU  37           H        GLU  37   6.715  10.378 -11.541
  268    HA   GLU  37           HA       GLU  37   4.579  12.183 -12.086
  269    HB2  GLU  37           HB3      GLU  37   5.382  10.183 -13.495
  270    HB3  GLU  37           HB2      GLU  37   4.385   9.187 -12.435
  271    HG2  GLU  37           HG3      GLU  37   3.014   9.752 -14.323
  272    HG3  GLU  37           HG2      GLU  37   2.449  10.747 -12.979
  273    H    ALA  38           H        ALA  38   4.879   9.512  -9.798
  274    HA   ALA  38           HA       ALA  38   2.113  10.036  -8.826
  275    HB1  ALA  38           HB1      ALA  38   3.133   7.656  -9.365
  276    HB2  ALA  38           HB2      ALA  38   2.091   7.876  -7.959
  277    HB3  ALA  38           HB3      ALA  38   3.843   7.835  -7.761
  278    H    SER  39           H        SER  39   5.374  10.669  -8.127
  279    HA   SER  39           HA       SER  39   6.321  11.866  -6.357
  280    HB2  SER  39           HB3      SER  39   3.732  12.113  -4.911
  281    HB3  SER  39           HB2      SER  39   4.974  13.327  -5.200
  282    HG   SER  39           HG       SER  39   3.772  13.950  -6.795
  283    H    GLY  40           H        GLY  40   6.250   9.029  -6.272
  284    HA2  GLY  40           HA3      GLY  40   6.643   8.620  -3.407
  285    HA3  GLY  40           HA2      GLY  40   5.271   7.722  -4.051
  286    H    TYR  41           H        TYR  41   6.308   5.696  -3.698
  287    HA   TYR  41           HA       TYR  41   8.703   5.162  -5.393
  288    HB2  TYR  41           HB3      TYR  41   7.629   3.718  -2.958
  289    HB3  TYR  41           HB2      TYR  41   9.029   3.196  -3.896
  290    HD1  TYR  41           HD1      TYR  41   7.668   6.177  -2.073
  291    HD2  TYR  41           HD2      TYR  41  11.150   4.054  -3.406
  292    HE1  TYR  41           HE1      TYR  41   9.111   7.771  -0.846
  293    HE2  TYR  41           HE2      TYR  41  12.597   5.641  -2.166
  294    HH   TYR  41           HH       TYR  41  12.389   7.187  -0.230
  295    H    ASP  42           H        ASP  42   8.703   3.167  -6.623
  296    HA   ASP  42           HA       ASP  42   6.285   2.665  -8.016
  297    HB2  ASP  42           HB3      ASP  42   8.674   2.185  -8.775
  298    HB3  ASP  42           HB2      ASP  42   8.566   0.699  -7.834
  299    H    LEU  43           H        LEU  43   5.112   0.656  -8.173
  300    HA   LEU  43           HA       LEU  43   5.014  -0.955  -5.656
  301    HB2  LEU  43           HB3      LEU  43   3.170   0.733  -5.616
  302    HB3  LEU  43           HB2      LEU  43   2.588   0.097  -7.152
  303    HG   LEU  43           HG       LEU  43   2.223  -2.112  -6.107
  304   HD11  LEU  43          HD11      LEU  43   3.568  -0.740  -3.821
  305   HD12  LEU  43          HD12      LEU  43   3.685  -2.420  -4.351
  306   HD13  LEU  43          HD13      LEU  43   2.274  -1.876  -3.441
  307   HD21  LEU  43          HD21      LEU  43   0.863   0.356  -5.392
  308   HD22  LEU  43          HD22      LEU  43   0.692  -0.857  -4.125
  309   HD23  LEU  43          HD23      LEU  43   0.178  -1.225  -5.769
  310    H    GLY  44           H        GLY  44   6.040  -2.707  -6.740
  311    HA2  GLY  44           HA3      GLY  44   4.758  -3.755  -9.194
  312    HA3  GLY  44           HA2      GLY  44   6.257  -4.348  -8.479
  313    H    GLY  45           H        GLY  45   4.036  -6.011  -9.279
  314    HA2  GLY  45           HA3      GLY  45   3.778  -8.064  -7.694
  315    HA3  GLY  45           HA2      GLY  45   2.911  -6.920  -6.675
  316    H    ASP  46           H        ASP  46   1.196  -8.651  -7.104
  317    HA   ASP  46           HA       ASP  46  -0.044  -8.810  -9.703
  318    HB2  ASP  46           HB3      ASP  46  -1.990  -9.764  -8.368
  319    HB3  ASP  46           HB2      ASP  46  -0.452 -10.604  -8.168
  320    H    THR  47           H        THR  47   0.396  -6.089  -8.463
  321    HA   THR  47           HA       THR  47  -1.712  -4.675  -7.522
  322    HB   THR  47           HB       THR  47  -1.082  -2.794  -9.061
  323    HG1  THR  47           HG1      THR  47  -0.612  -4.313 -10.819
  324   HG21  THR  47          HG21      THR  47   1.273  -4.326  -7.927
  325   HG22  THR  47          HG22      THR  47   0.188  -3.311  -6.977
  326   HG23  THR  47          HG23      THR  47   1.199  -2.590  -8.230
  327    H    ALA  48           H        ALA  48  -1.635  -6.250 -10.647
  328    HA   ALA  48           HA       ALA  48  -4.048  -4.941 -11.644
  329    HB1  ALA  48           HB1      ALA  48  -3.751  -6.212 -13.553
  330    HB2  ALA  48           HB2      ALA  48  -3.222  -7.632 -12.650
  331    HB3  ALA  48           HB3      ALA  48  -2.110  -6.288 -12.909
  332    H    CYS  49           H        CYS  49  -3.995  -6.371  -8.968
  333    HA   CYS  49           HA       CYS  49  -6.476  -7.966  -9.407
  334    HB2  CYS  49           HB3      CYS  49  -5.756  -9.641  -7.839
  335    HB3  CYS  49           HB2      CYS  49  -4.430  -9.432  -8.984
  336    H    LEU  50           H        LEU  50  -5.729  -5.173  -8.482
  337    HA   LEU  50           HA       LEU  50  -6.940  -5.264  -5.744
  338    HB2  LEU  50           HB3      LEU  50  -5.293  -3.096  -7.078
  339    HB3  LEU  50           HB2      LEU  50  -5.972  -2.994  -5.460
  340    HG   LEU  50           HG       LEU  50  -4.121  -5.234  -6.291
  341   HD11  LEU  50          HD11      LEU  50  -2.265  -4.001  -5.346
  342   HD12  LEU  50          HD12      LEU  50  -3.330  -2.674  -4.883
  343   HD13  LEU  50          HD13      LEU  50  -3.019  -3.002  -6.586
  344   HD21  LEU  50          HD21      LEU  50  -5.168  -4.167  -3.669
  345   HD22  LEU  50          HD22      LEU  50  -3.689  -5.122  -3.740
  346   HD23  LEU  50          HD23      LEU  50  -5.211  -5.816  -4.287
  347    H    THR  51           H        THR  51  -7.784  -4.876  -8.883
  348    HA   THR  51           HA       THR  51  -9.337  -2.450  -8.835
  349    HB   THR  51           HB       THR  51 -10.474  -3.401 -10.810
  350    HG1  THR  51           HG1      THR  51 -10.396  -5.587  -9.841
  351   HG21  THR  51          HG21      THR  51  -8.290  -2.381 -11.152
  352   HG22  THR  51          HG22      THR  51  -8.437  -3.798 -12.191
  353   HG23  THR  51          HG23      THR  51  -7.487  -3.888 -10.709
  354    H    ARG  52           H        ARG  52  -9.627  -5.015  -6.871
  355    HA   ARG  52           HA       ARG  52 -12.610  -5.069  -6.884
  356    HB2  ARG  52           HB3      ARG  52 -12.431  -7.052  -5.508
  357    HB3  ARG  52           HB2      ARG  52 -11.335  -7.242  -6.878
  358    HG2  ARG  52           HG3      ARG  52  -9.561  -6.167  -5.287
  359    HG3  ARG  52           HG2      ARG  52 -10.676  -6.642  -4.005
  360    HD2  ARG  52           HD3      ARG  52  -9.454  -8.482  -6.082
  361    HD3  ARG  52           HD2      ARG  52  -9.039  -8.425  -4.370
  362    HE   ARG  52           HE       ARG  52 -11.734  -8.921  -4.300
  363   HH11  ARG  52          HH22      ARG  52  -9.067 -10.261  -6.026
  364   HH12  ARG  52          HH21      ARG  52  -9.752 -11.850  -6.115
  365   HH21  ARG  52          HH11      ARG  52 -12.644 -10.989  -4.406
  366   HH22  ARG  52          HH12      ARG  52 -11.776 -12.262  -5.198
  367    H    TRP  53           H        TRP  53  -9.831  -4.007  -5.058
  368    HA   TRP  53           HA       TRP  53 -11.629  -3.114  -2.829
  369    HB2  TRP  53           HB3      TRP  53  -8.616  -3.471  -2.858
  370    HB3  TRP  53           HB2      TRP  53  -9.583  -2.983  -1.467
  371    HD1  TRP  53           HD1      TRP  53 -11.886  -4.945  -1.371
  372    HE1  TRP  53           HE1      TRP  53 -11.527  -7.479  -1.041
  373    HE3  TRP  53           HE3      TRP  53  -7.043  -5.355  -2.918
  374    HZ2  TRP  53           HZ2      TRP  53  -9.455  -9.421  -1.392
  375    HZ3  TRP  53           HZ3      TRP  53  -5.902  -7.556  -2.910
  376    HH2  TRP  53           HH2      TRP  53  -7.097  -9.581  -2.151
  377    H    LEU  54           H        LEU  54  -9.280  -2.159  -5.225
  378    HA   LEU  54           HA       LEU  54  -9.475   0.684  -4.352
  379    HB2  LEU  54           HB3      LEU  54  -7.554  -0.704  -6.242
  380    HB3  LEU  54           HB2      LEU  54  -7.509   1.011  -5.866
  381    HG   LEU  54           HG       LEU  54  -7.261  -1.202  -3.807
  382   HD11  LEU  54          HD11      LEU  54  -5.340  -0.311  -5.648
  383   HD12  LEU  54          HD12      LEU  54  -5.048  -1.254  -4.188
  384   HD13  LEU  54          HD13      LEU  54  -4.944   0.505  -4.138
  385   HD21  LEU  54          HD21      LEU  54  -6.211   1.054  -2.700
  386   HD22  LEU  54          HD22      LEU  54  -7.873   0.523  -2.453
  387   HD23  LEU  54          HD23      LEU  54  -7.510   1.743  -3.673
  388    HA   PRO  55           HA       PRO  55 -12.032   1.409  -7.921
  389    HB2  PRO  55           HB2      PRO  55 -11.647   4.059  -8.378
  390    HB3  PRO  55           HB3      PRO  55 -12.548   3.452  -6.975
  391    HG2  PRO  55           HG3      PRO  55  -9.778   4.499  -7.139
  392    HG3  PRO  55           HG2      PRO  55 -10.976   4.663  -5.846
  393    HD2  PRO  55           HD3      PRO  55  -8.856   2.867  -5.820
  394    HD3  PRO  55           HD2      PRO  55 -10.319   2.722  -4.833
  395    H    SER  56           H        SER  56  -8.629   1.895  -8.107
  396    HA   SER  56           HA       SER  56  -8.717   1.445 -11.024
  397    HB2  SER  56           HB3      SER  56  -8.174   4.031  -9.858
  398    HB3  SER  56           HB2      SER  56  -6.732   3.429 -10.671
  399    HG   SER  56           HG       SER  56  -8.612   4.594 -11.860
  400    H    GLU  57           H        GLU  57  -6.558   0.788 -11.839
  401    HA   GLU  57           HA       GLU  57  -5.202  -0.911  -9.958
  402    HB2  GLU  57           HB3      GLU  57  -5.367  -1.372 -12.409
  403    HB3  GLU  57           HB2      GLU  57  -4.257  -0.034 -12.697
  404    HG2  GLU  57           HG3      GLU  57  -2.523  -1.138 -11.376
  405    HG3  GLU  57           HG2      GLU  57  -3.634  -2.448 -10.974
  406    HA   PRO  58           HA       PRO  58  -2.515   2.418  -8.469
  407    HB2  PRO  58           HB2      PRO  58  -0.804   0.857  -6.970
  408    HB3  PRO  58           HB3      PRO  58  -2.363   1.468  -6.399
  409    HG2  PRO  58           HG3      PRO  58  -1.604  -1.232  -7.281
  410    HG3  PRO  58           HG2      PRO  58  -2.861  -0.719  -6.148
  411    HD2  PRO  58           HD3      PRO  58  -3.312  -1.570  -8.763
  412    HD3  PRO  58           HD2      PRO  58  -4.451  -0.625  -7.783
  413    H    ARG  59           H        ARG  59  -0.044   2.705  -8.245
  414    HA   ARG  59           HA       ARG  59   1.597   1.130 -10.091
  415    HB2  ARG  59           HB3      ARG  59   0.287   3.515 -11.002
  416    HB3  ARG  59           HB2      ARG  59   2.023   3.822 -10.915
  417    HG2  ARG  59           HG3      ARG  59   2.434   1.733 -12.199
  418    HG3  ARG  59           HG2      ARG  59   0.691   1.500 -12.342
  419    HD2  ARG  59           HD3      ARG  59   0.429   3.395 -13.721
  420    HD3  ARG  59           HD2      ARG  59   1.993   4.063 -13.249
  421    HE   ARG  59           HE       ARG  59   2.993   2.731 -14.917
  422   HH11  ARG  59          HH22      ARG  59  -0.161   1.620 -14.085
  423   HH12  ARG  59          HH21      ARG  59  -0.215   0.423 -15.337
  424   HH21  ARG  59          HH11      ARG  59   2.943   1.179 -16.556
  425   HH22  ARG  59          HH12      ARG  59   1.544   0.174 -16.737
  426    H    ALA  60           H        ALA  60   1.169   3.362  -7.525
  427    HA   ALA  60           HA       ALA  60   3.973   3.041  -6.757
  428    HB1  ALA  60           HB1      ALA  60   2.840   5.831  -7.067
  429    HB2  ALA  60           HB2      ALA  60   3.899   5.081  -8.260
  430    HB3  ALA  60           HB3      ALA  60   4.490   5.392  -6.627
  431    H    TRP  61           H        TRP  61   4.307   4.038  -4.545
  432    HA   TRP  61           HA       TRP  61   1.785   4.385  -2.999
  433    HB2  TRP  61           HB3      TRP  61   2.665   2.853  -1.235
  434    HB3  TRP  61           HB2      TRP  61   2.344   2.012  -2.750
  435    HD1  TRP  61           HD1      TRP  61   4.703   2.059  -4.439
  436    HE1  TRP  61           HE1      TRP  61   7.071   1.350  -3.722
  437    HE3  TRP  61           HE3      TRP  61   4.242   2.469   0.629
  438    HZ2  TRP  61           HZ2      TRP  61   8.570   0.988  -1.314
  439    HZ3  TRP  61           HZ3      TRP  61   6.152   1.917   2.108
  440    HH2  TRP  61           HH2      TRP  61   8.313   1.182   1.145
  441    H    ARG  62           H        ARG  62   2.117   5.684  -1.111
  442    HA   ARG  62           HA       ARG  62   4.848   6.872  -0.827
  443    HB2  ARG  62           HB3      ARG  62   3.664   8.522  -2.025
  444    HB3  ARG  62           HB2      ARG  62   2.195   8.263  -1.088
  445    HG2  ARG  62           HG3      ARG  62   2.979   9.452   0.737
  446    HG3  ARG  62           HG2      ARG  62   4.669   9.095   0.371
  447    HD2  ARG  62           HD3      ARG  62   4.015  11.493  -0.056
  448    HD3  ARG  62           HD2      ARG  62   4.673  10.665  -1.467
  449    HE   ARG  62           HE       ARG  62   1.935  10.273  -1.677
  450   HH11  ARG  62          HH22      ARG  62   4.067  12.953  -1.284
  451   HH12  ARG  62          HH21      ARG  62   3.049  14.059  -2.144
  452   HH21  ARG  62          HH11      ARG  62   0.592  11.703  -2.800
  453   HH22  ARG  62          HH12      ARG  62   1.081  13.353  -3.002
  454    HA   PRO  63           HA       PRO  63   3.596   5.505   3.378
  455    HB2  PRO  63           HB2      PRO  63   6.251   6.249   4.268
  456    HB3  PRO  63           HB3      PRO  63   5.527   4.638   4.173
  457    HG2  PRO  63           HG3      PRO  63   7.546   5.653   2.549
  458    HG3  PRO  63           HG2      PRO  63   6.610   4.181   2.279
  459    HD2  PRO  63           HD3      PRO  63   6.461   6.737   0.867
  460    HD3  PRO  63           HD2      PRO  63   5.780   5.160   0.415
  461    H    THR  64           H        THR  64   2.490   6.936   4.682
  462    HA   THR  64           HA       THR  64   3.439   9.751   4.802
  463    HB   THR  64           HB       THR  64   1.056   9.715   6.140
  464    HG1  THR  64           HG1      THR  64   1.188   7.523   4.401
  465   HG21  THR  64          HG21      THR  64   0.058  10.490   4.023
  466   HG22  THR  64          HG22      THR  64   1.432   9.835   3.134
  467   HG23  THR  64          HG23      THR  64   1.664  11.183   4.247
  468    HA   PRO  65           HA       PRO  65   4.880   9.287   8.954
  469    HB2  PRO  65           HB2      PRO  65   4.030  11.634  10.130
  470    HB3  PRO  65           HB3      PRO  65   5.429  11.510   9.050
  471    HG2  PRO  65           HG3      PRO  65   2.675  12.462   8.477
  472    HG3  PRO  65           HG2      PRO  65   4.229  13.053   7.864
  473    HD2  PRO  65           HD3      PRO  65   2.563  11.470   6.388
  474    HD3  PRO  65           HD2      PRO  65   4.327  11.463   6.187
  475    H    ALA  66           H        ALA  66   2.067   8.303   8.345
  476    HA   ALA  66           HA       ALA  66   1.316   7.670  11.051
  477    HB1  ALA  66           HB1      ALA  66  -0.130   9.905   9.655
  478    HB2  ALA  66           HB2      ALA  66   0.371   9.790  11.341
  479    HB3  ALA  66           HB3      ALA  66  -1.008   8.853  10.764
  480    H    GLY  67           H        GLY  67   1.641   6.601   8.198
  481    HA2  GLY  67           HA3      GLY  67   0.132   4.361   8.173
  482    HA3  GLY  67           HA2      GLY  67  -1.056   5.547   7.635
  483    H    ILE  68           H        ILE  68  -0.578   3.642   5.821
  484    HA   ILE  68           HA       ILE  68   1.473   4.724   3.940
  485    HB   ILE  68           HB       ILE  68   0.059   2.043   3.991
  486   HG12  ILE  68          HG13      ILE  68   3.001   2.563   4.399
  487   HG13  ILE  68          HG12      ILE  68   1.875   2.629   5.752
  488   HG21  ILE  68          HG21      ILE  68   1.777   3.423   2.005
  489   HG22  ILE  68          HG22      ILE  68   0.575   2.154   1.766
  490   HG23  ILE  68          HG23      ILE  68   2.191   1.741   2.338
  491   HD11  ILE  68          HD11      ILE  68   1.134   0.339   5.279
  492   HD12  ILE  68          HD12      ILE  68   2.883   0.376   5.508
  493   HD13  ILE  68          HD13      ILE  68   2.209   0.267   3.882
  494    H    ALA  69           H        ALA  69   0.864   5.214   1.798
  495    HA   ALA  69           HA       ALA  69  -2.080   5.246   1.241
  496    HB1  ALA  69           HB1      ALA  69  -1.655   7.397   0.006
  497    HB2  ALA  69           HB2      ALA  69  -0.021   7.396   0.668
  498    HB3  ALA  69           HB3      ALA  69  -1.409   7.523   1.747
  499    H    LEU  70           H        LEU  70  -2.650   4.792  -0.922
  500    HA   LEU  70           HA       LEU  70  -0.408   3.763  -2.626
  501    HB2  LEU  70           HB3      LEU  70  -3.285   2.938  -2.353
  502    HB3  LEU  70           HB2      LEU  70  -2.300   2.431  -3.716
  503    HG   LEU  70           HG       LEU  70  -1.019   2.060  -1.089
  504   HD11  LEU  70          HD11      LEU  70  -2.405  -0.078  -0.744
  505   HD12  LEU  70          HD12      LEU  70  -3.591   0.655  -1.823
  506   HD13  LEU  70          HD13      LEU  70  -3.177   1.445  -0.301
  507   HD21  LEU  70          HD21      LEU  70  -1.559   0.185  -3.414
  508   HD22  LEU  70          HD22      LEU  70  -0.400  -0.075  -2.110
  509   HD23  LEU  70          HD23      LEU  70  -0.141   1.225  -3.272
  510    H    LEU  71           H        LEU  71  -0.137   4.728  -4.607
  511    HA   LEU  71           HA       LEU  71  -2.175   6.764  -5.418
  512    HB2  LEU  71           HB3      LEU  71   0.645   6.623  -6.472
  513    HB3  LEU  71           HB2      LEU  71  -0.440   8.008  -6.411
  514    HG   LEU  71           HG       LEU  71   0.869   6.655  -4.033
  515   HD11  LEU  71          HD11      LEU  71   2.243   8.192  -5.558
  516   HD12  LEU  71          HD12      LEU  71   2.189   8.628  -3.850
  517   HD13  LEU  71          HD13      LEU  71   1.187   9.495  -5.012
  518   HD21  LEU  71          HD21      LEU  71  -1.069   7.425  -3.050
  519   HD22  LEU  71          HD22      LEU  71  -1.346   8.638  -4.301
  520   HD23  LEU  71          HD23      LEU  71  -0.154   8.930  -3.036
  521    H    GLU  72           H        GLU  72  -1.854   7.144  -7.963
  522    HA   GLU  72           HA       GLU  72  -1.746   4.510  -9.359
  523    HB2  GLU  72           HB3      GLU  72  -3.782   5.494 -10.705
  524    HB3  GLU  72           HB2      GLU  72  -4.071   4.700  -9.158
  525    HG2  GLU  72           HG3      GLU  72  -5.267   6.877  -9.344
  526    HG3  GLU  72           HG2      GLU  72  -4.116   6.854  -8.013
  527    H    ARG  73           H        ARG  73   0.404   5.955  -9.646
  528    HA   ARG  73           HA       ARG  73   1.740   7.038 -11.182
  529    HB2  ARG  73           HB3      ARG  73   0.215   5.489 -12.688
  530    HB3  ARG  73           HB2      ARG  73  -0.460   7.032 -13.211
  531    HG2  ARG  73           HG3      ARG  73   1.755   7.826 -13.866
  532    HG3  ARG  73           HG2      ARG  73   2.498   6.351 -13.251
  533    HD2  ARG  73           HD3      ARG  73   2.136   5.339 -15.218
  534    HD3  ARG  73           HD2      ARG  73   0.401   5.591 -15.032
  535    HE   ARG  73           HE       ARG  73   2.216   7.223 -16.660
  536   HH11  ARG  73          HH22      ARG  73  -0.787   6.945 -14.985
  537   HH12  ARG  73          HH21      ARG  73  -1.576   8.164 -15.928
  538   HH21  ARG  73          HH11      ARG  73   1.200   8.815 -17.899
  539   HH22  ARG  73          HH12      ARG  73  -0.452   9.221 -17.576
  540    H    GLY  74           H        GLY  74  -1.618   8.263 -11.324
  541    HA2  GLY  74           HA3      GLY  74  -0.779  10.916 -12.136
  542    HA3  GLY  74           HA2      GLY  74  -2.383  10.478 -11.555
  543    H    GLY  75           H        GLY  75  -0.957   9.263  -9.102
  544    HA2  GLY  75           HA3      GLY  75   0.154  10.148  -7.133
  545    HA3  GLY  75           HA2      GLY  75  -0.144  11.778  -7.730
  546    H    LEU  76           H        LEU  76  -2.881   9.895  -8.202
  547    HA   LEU  76           HA       LEU  76  -4.298  11.310  -6.063
  548    HB2  LEU  76           HB3      LEU  76  -4.992  10.092  -8.548
  549    HB3  LEU  76           HB2      LEU  76  -5.928   9.297  -7.281
  550    HG   LEU  76           HG       LEU  76  -5.726  12.300  -7.650
  551   HD11  LEU  76          HD11      LEU  76  -7.095  11.732  -9.422
  552   HD12  LEU  76          HD12      LEU  76  -8.301  11.763  -8.135
  553   HD13  LEU  76          HD13      LEU  76  -7.621  10.226  -8.669
  554   HD21  LEU  76          HD21      LEU  76  -6.620  12.403  -5.586
  555   HD22  LEU  76          HD22      LEU  76  -6.564  10.644  -5.465
  556   HD23  LEU  76          HD23      LEU  76  -7.990  11.436  -6.137
  557    H    THR  77           H        THR  77  -4.163  10.510  -4.023
  558    HA   THR  77           HA       THR  77  -3.334   7.894  -3.324
  559    HB   THR  77           HB       THR  77  -5.090   9.798  -1.760
  560    HG1  THR  77           HG1      THR  77  -3.155  10.485  -0.900
  561   HG21  THR  77          HG21      THR  77  -3.835   8.464   0.144
  562   HG22  THR  77          HG22      THR  77  -3.726   7.216  -1.096
  563   HG23  THR  77          HG23      THR  77  -5.304   7.809  -0.579
  564    H    LEU  78           H        LEU  78  -4.368   6.043  -3.839
  565    HA   LEU  78           HA       LEU  78  -7.241   6.007  -4.386
  566    HB2  LEU  78           HB3      LEU  78  -5.291   3.701  -4.164
  567    HB3  LEU  78           HB2      LEU  78  -6.891   3.637  -4.880
  568    HG   LEU  78           HG       LEU  78  -4.685   5.459  -5.878
  569   HD11  LEU  78          HD11      LEU  78  -4.904   2.644  -6.183
  570   HD12  LEU  78          HD12      LEU  78  -3.816   3.737  -7.033
  571   HD13  LEU  78          HD13      LEU  78  -5.396   3.361  -7.716
  572   HD21  LEU  78          HD21      LEU  78  -7.480   4.782  -6.779
  573   HD22  LEU  78          HD22      LEU  78  -6.272   5.295  -7.954
  574   HD23  LEU  78          HD23      LEU  78  -6.716   6.366  -6.627
  575    H    MET  79           H        MET  79  -5.083   4.795  -1.827
  576    HA   MET  79           HA       MET  79  -7.416   4.688  -0.018
  577    HB2  MET  79           HB3      MET  79  -7.233   2.450  -1.148
  578    HB3  MET  79           HB2      MET  79  -5.650   2.257  -0.412
  579    HG2  MET  79           HG3      MET  79  -7.231   1.153   1.030
  580    HG3  MET  79           HG2      MET  79  -6.761   2.650   1.835
  581    HE1  MET  79           HE1      MET  79 -10.797   1.351   0.261
  582    HE2  MET  79           HE2      MET  79  -9.455   0.405   0.920
  583    HE3  MET  79           HE3      MET  79  -9.335   1.107  -0.691
  584    H    LEU  80           H        LEU  80  -6.844   5.118   2.081
  585    HA   LEU  80           HA       LEU  80  -3.955   5.623   2.599
  586    HB2  LEU  80           HB3      LEU  80  -5.440   7.531   2.984
  587    HB3  LEU  80           HB2      LEU  80  -6.459   6.557   4.041
  588    HG   LEU  80           HG       LEU  80  -4.628   6.316   5.647
  589   HD11  LEU  80          HD11      LEU  80  -2.630   6.260   4.440
  590   HD12  LEU  80          HD12      LEU  80  -2.581   7.888   5.115
  591   HD13  LEU  80          HD13      LEU  80  -3.079   7.641   3.441
  592   HD21  LEU  80          HD21      LEU  80  -4.311   8.771   6.201
  593   HD22  LEU  80          HD22      LEU  80  -5.987   8.273   5.974
  594   HD23  LEU  80          HD23      LEU  80  -5.144   9.143   4.692
  595    H    LEU  81           H        LEU  81  -3.263   3.525   3.144
  596    HA   LEU  81           HA       LEU  81  -4.704   1.860   5.038
  597    HB2  LEU  81           HB3      LEU  81  -2.236   1.707   3.457
  598    HB3  LEU  81           HB2      LEU  81  -2.052   1.010   5.063
  599    HG   LEU  81           HG       LEU  81  -4.118  -0.346   4.665
  600   HD11  LEU  81          HD11      LEU  81  -4.381   1.456   2.481
  601   HD12  LEU  81          HD12      LEU  81  -5.463   0.137   2.928
  602   HD13  LEU  81          HD13      LEU  81  -4.140  -0.152   1.798
  603   HD21  LEU  81          HD21      LEU  81  -2.485  -1.814   4.137
  604   HD22  LEU  81          HD22      LEU  81  -1.551  -0.586   3.283
  605   HD23  LEU  81          HD23      LEU  81  -2.848  -1.447   2.451
  606    H    GLY  82           H        GLY  82  -4.731   2.190   7.232
  607    HA2  GLY  82           HA3      GLY  82  -2.716   4.070   8.366
  608    HA3  GLY  82           HA2      GLY  82  -4.270   3.687   9.089
  609    H    ARG  83           H        ARG  83  -1.278   3.438   9.895
  610    HA   ARG  83           HA       ARG  83  -0.868   0.612  10.407
  611    HB2  ARG  83           HB3      ARG  83   0.977   2.299  10.313
  612    HB3  ARG  83           HB2      ARG  83   0.347   3.032  11.781
  613    HG2  ARG  83           HG3      ARG  83   0.749   0.123  11.998
  614    HG3  ARG  83           HG2      ARG  83   2.236   1.029  11.710
  615    HD2  ARG  83           HD3      ARG  83   0.218   1.611  13.901
  616    HD3  ARG  83           HD2      ARG  83   1.788   0.840  14.128
  617    HE   ARG  83           HE       ARG  83   1.970   3.449  12.834
  618   HH11  ARG  83          HH22      ARG  83   1.761   1.669  15.781
  619   HH12  ARG  83          HH21      ARG  83   2.534   2.894  16.730
  620   HH21  ARG  83          HH11      ARG  83   2.981   5.059  14.059
  621   HH22  ARG  83          HH12      ARG  83   3.225   4.813  15.756
  622    H    GLN  84           H        GLN  84  -1.812  -0.564  12.060
  623    HA   GLN  84           HA       GLN  84  -3.130   0.972  14.270
  624    HB2  GLN  84           HB3      GLN  84  -3.919  -1.758  13.235
  625    HB3  GLN  84           HB2      GLN  84  -4.818  -0.733  14.354
  626    HG2  GLN  84           HG3      GLN  84  -4.203  -0.074  11.457
  627    HG3  GLN  84           HG2      GLN  84  -5.772  -0.577  12.089
  628   HE21  GLN  84          HE22      GLN  84  -4.548   2.121  10.947
  629   HE22  GLN  84          HE21      GLN  84  -5.132   3.274  12.046
  630    H    GLY  85           H        GLY  85  -1.119  -1.809  13.439
  631    HA2  GLY  85           HA3      GLY  85  -0.399  -2.028  16.325
  632    HA3  GLY  85           HA2      GLY  85  -0.876  -3.482  15.454
  633    H    GLU  86           H        GLU  86   1.077  -0.801  14.190
  634    HA   GLU  86           HA       GLU  86   3.258  -0.794  13.320
  635    HB2  GLU  86           HB3      GLU  86   3.576  -1.514  15.818
  636    HB3  GLU  86           HB2      GLU  86   3.914  -3.102  15.131
  637    HG2  GLU  86           HG3      GLU  86   5.483  -1.679  13.518
  638    HG3  GLU  86           HG2      GLU  86   5.469  -0.561  14.884
  639    H    GLY  87           H        GLY  87   3.622  -1.566  11.309
  640    HA2  GLY  87           HA3      GLY  87   4.056  -3.117   9.592
  641    HA3  GLY  87           HA2      GLY  87   4.171  -4.362  10.831
  642    H    ASP  88           H        ASP  88   1.352  -3.285  11.687
  643    HA   ASP  88           HA       ASP  88  -0.152  -4.951   9.703
  644    HB2  ASP  88           HB3      ASP  88  -0.156  -4.820  12.633
  645    HB3  ASP  88           HB2      ASP  88  -1.772  -4.714  11.933
  646    H    TYR  89           H        TYR  89  -0.918  -3.431   8.277
  647    HA   TYR  89           HA       TYR  89  -2.241  -0.991   9.361
  648    HB2  TYR  89           HB3      TYR  89  -1.545  -1.735   6.522
  649    HB3  TYR  89           HB2      TYR  89  -2.194  -0.200   7.027
  650    HD1  TYR  89           HD1      TYR  89   0.682  -2.507   7.648
  651    HD2  TYR  89           HD2      TYR  89  -0.735   1.546   7.608
  652    HE1  TYR  89           HE1      TYR  89   2.980  -1.695   8.091
  653    HE2  TYR  89           HE2      TYR  89   1.566   2.355   8.050
  654    HH   TYR  89           HH       TYR  89   3.832   0.855   9.296
  655    H    ARG  90           H        ARG  90  -4.471  -0.646   8.956
  656    HA   ARG  90           HA       ARG  90  -5.887  -2.784   7.445
  657    HB2  ARG  90           HB3      ARG  90  -6.843  -1.648  10.089
  658    HB3  ARG  90           HB2      ARG  90  -7.587  -2.949   9.162
  659    HG2  ARG  90           HG3      ARG  90  -5.677  -4.394   9.544
  660    HG3  ARG  90           HG2      ARG  90  -4.787  -3.081  10.314
  661    HD2  ARG  90           HD3      ARG  90  -5.878  -4.717  11.919
  662    HD3  ARG  90           HD2      ARG  90  -6.302  -3.023  12.173
  663    HE   ARG  90           HE       ARG  90  -8.270  -4.005  10.454
  664   HH11  ARG  90          HH22      ARG  90  -6.959  -4.775  13.547
  665   HH12  ARG  90          HH21      ARG  90  -8.445  -5.413  14.166
  666   HH21  ARG  90          HH11      ARG  90 -10.219  -4.834  11.243
  667   HH22  ARG  90          HH12      ARG  90 -10.291  -5.447  12.861
  668    H    VAL  91           H        VAL  91  -7.862  -2.068   6.487
  669    HA   VAL  91           HA       VAL  91  -8.443   0.849   6.679
  670    HB   VAL  91           HB       VAL  91  -6.965   0.449   4.698
  671   HG11  VAL  91          HG11      VAL  91  -9.191  -0.950   3.299
  672   HG12  VAL  91          HG12      VAL  91  -8.234  -1.907   4.430
  673   HG13  VAL  91          HG13      VAL  91  -7.449  -1.101   3.074
  674   HG21  VAL  91          HG21      VAL  91  -9.292   1.077   3.171
  675   HG22  VAL  91          HG22      VAL  91  -8.107   2.194   3.846
  676   HG23  VAL  91          HG23      VAL  91  -9.527   1.740   4.789
  677    H    GLN  92           H        GLN  92 -10.511   0.804   7.449
  678    HA   GLN  92           HA       GLN  92 -12.350  -1.325   7.185
  679    HB2  GLN  92           HB3      GLN  92 -12.628   1.611   7.754
  680    HB3  GLN  92           HB2      GLN  92 -14.078   0.643   7.491
  681    HG2  GLN  92           HG3      GLN  92 -13.442   0.764   9.898
  682    HG3  GLN  92           HG2      GLN  92 -13.427  -0.888   9.281
  683   HE21  GLN  92          HE22      GLN  92 -11.024   1.811   9.141
  684   HE22  GLN  92          HE21      GLN  92  -9.736   0.885   9.746
  685    H    LYS  93           H        LYS  93 -13.423  -2.069   5.433
  686    HA   LYS  93           HA       LYS  93 -13.682  -0.271   3.052
  687    HB2  LYS  93           HB3      LYS  93 -12.571  -2.800   3.222
  688    HB3  LYS  93           HB2      LYS  93 -14.200  -3.124   2.630
  689    HG2  LYS  93           HG3      LYS  93 -13.803  -1.258   0.928
  690    HG3  LYS  93           HG2      LYS  93 -12.104  -1.329   1.399
  691    HD2  LYS  93           HD3      LYS  93 -12.040  -2.867  -0.306
  692    HD3  LYS  93           HD2      LYS  93 -12.528  -3.951   0.998
  693    HE2  LYS  93           HE3      LYS  93 -14.078  -4.403  -0.732
  694    HE3  LYS  93           HE2      LYS  93 -14.950  -3.322   0.357
  695    HZ1  LYS  93           HZ1      LYS  93 -14.115  -1.465  -1.094
  696    HZ2  LYS  93           HZ2      LYS  93 -15.278  -2.481  -1.796
  697    HZ3  LYS  93           HZ3      LYS  93 -13.639  -2.653  -2.213
  698    H    GLY  94           H        GLY  94 -15.415  -2.068   5.449
  699    HA2  GLY  94           HA3      GLY  94 -17.904  -0.894   4.986
  700    HA3  GLY  94           HA2      GLY  94 -17.893  -2.342   3.980
  701    H    ASP  95           H        ASP  95 -19.745  -2.794   5.608
  702    HA   ASP  95           HA       ASP  95 -18.975  -3.539   8.314
  703    HB2  ASP  95           HB3      ASP  95 -21.459  -4.210   6.704
  704    HB3  ASP  95           HB2      ASP  95 -21.265  -4.485   8.436
  705    H    GLY  96           H        GLY  96 -17.109  -4.867   7.149
  706    HA2  GLY  96           HA3      GLY  96 -17.288  -7.543   7.779
  707    HA3  GLY  96           HA2      GLY  96 -17.900  -7.482   6.125
  708    H    GLY  97           H        GLY  97 -16.404  -5.926   4.711
  709    HA2  GLY  97           HA3      GLY  97 -14.033  -7.171   4.099
  710    HA3  GLY  97           HA2      GLY  97 -14.249  -5.440   3.853
  711    H    GLN  98           H        GLN  98 -11.761  -6.453   4.436
  712    HA   GLN  98           HA       GLN  98 -10.843  -4.859   6.552
  713    HB2  GLN  98           HB3      GLN  98 -12.051  -6.625   7.982
  714    HB3  GLN  98           HB2      GLN  98 -10.857  -7.774   7.385
  715    HG2  GLN  98           HG3      GLN  98  -9.303  -5.634   8.153
  716    HG3  GLN  98           HG2      GLN  98 -10.574  -5.654   9.377
  717   HE21  GLN  98          HE22      GLN  98 -10.347  -7.185  11.034
  718   HE22  GLN  98          HE21      GLN  98  -9.272  -8.497  10.991
  719    H    LEU  99           H        LEU  99  -9.277  -4.477   4.994
  720    HA   LEU  99           HA       LEU  99  -7.671  -6.729   4.002
  721    HB2  LEU  99           HB3      LEU  99  -7.148  -3.796   3.591
  722    HB3  LEU  99           HB2      LEU  99  -6.644  -5.131   2.581
  723    HG   LEU  99           HG       LEU  99  -9.494  -4.224   3.024
  724   HD11  LEU  99          HD11      LEU  99  -8.609  -4.262   0.285
  725   HD12  LEU  99          HD12      LEU  99  -7.475  -3.312   1.246
  726   HD13  LEU  99          HD13      LEU  99  -9.188  -2.892   1.235
  727   HD21  LEU  99          HD21      LEU  99  -9.731  -6.508   2.649
  728   HD22  LEU  99          HD22      LEU  99  -8.255  -6.608   1.689
  729   HD23  LEU  99          HD23      LEU  99  -9.714  -5.910   0.990
  730    H    VAL 100           H        VAL 100  -5.478  -7.045   4.557
  731    HA   VAL 100           HA       VAL 100  -4.404  -5.354   6.771
  732    HB   VAL 100           HB       VAL 100  -4.377  -8.383   6.755
  733   HG11  VAL 100          HG11      VAL 100  -2.451  -7.584   7.914
  734   HG12  VAL 100          HG12      VAL 100  -3.639  -7.938   9.168
  735   HG13  VAL 100          HG13      VAL 100  -3.358  -6.271   8.664
  736   HG21  VAL 100          HG21      VAL 100  -6.634  -7.551   7.187
  737   HG22  VAL 100          HG22      VAL 100  -6.012  -6.402   8.371
  738   HG23  VAL 100          HG23      VAL 100  -5.932  -8.134   8.696
  739    H    LEU 101           H        LEU 101  -2.640  -4.474   5.705
  740    HA   LEU 101           HA       LEU 101  -0.981  -6.187   3.949
  741    HB2  LEU 101           HB3      LEU 101  -1.535  -3.794   3.358
  742    HB3  LEU 101           HB2      LEU 101  -0.603  -3.301   4.752
  743    HG   LEU 101           HG       LEU 101   0.961  -5.130   3.202
  744   HD11  LEU 101          HD11      LEU 101  -0.362  -4.414   1.283
  745   HD12  LEU 101          HD12      LEU 101   1.215  -3.628   1.201
  746   HD13  LEU 101          HD13      LEU 101  -0.194  -2.723   1.761
  747   HD21  LEU 101          HD21      LEU 101   2.558  -3.298   3.293
  748   HD22  LEU 101          HD22      LEU 101   1.733  -3.396   4.849
  749   HD23  LEU 101          HD23      LEU 101   1.276  -2.153   3.686
  750    H    ARG 102           H        ARG 102   0.672  -7.414   4.961
  751    HA   ARG 102           HA       ARG 102   2.161  -6.071   7.148
  752    HB2  ARG 102           HB3      ARG 102   0.327  -7.680   8.012
  753    HB3  ARG 102           HB2      ARG 102   1.336  -8.966   7.350
  754    HG2  ARG 102           HG3      ARG 102   3.266  -7.874   8.676
  755    HG3  ARG 102           HG2      ARG 102   2.000  -7.012   9.550
  756    HD2  ARG 102           HD3      ARG 102   0.933  -9.376   9.846
  757    HD3  ARG 102           HD2      ARG 102   2.549  -9.970   9.458
  758    HE   ARG 102           HE       ARG 102   1.763  -8.618  11.930
  759   HH11  ARG 102          HH22      ARG 102   4.275  -9.429   9.713
  760   HH12  ARG 102          HH21      ARG 102   5.540  -9.287  10.888
  761   HH21  ARG 102          HH11      ARG 102   3.401  -8.426  13.477
  762   HH22  ARG 102          HH12      ARG 102   5.045  -8.720  13.019
  763    H    ARG 103           H        ARG 103   4.287  -6.415   7.012
  764    HA   ARG 103           HA       ARG 103   5.626  -7.215   4.758
  765    HB2  ARG 103           HB3      ARG 103   7.594  -7.380   6.080
  766    HB3  ARG 103           HB2      ARG 103   6.577  -6.201   6.899
  767    HG2  ARG 103           HG3      ARG 103   5.674  -8.300   8.198
  768    HG3  ARG 103           HG2      ARG 103   7.195  -9.032   7.685
  769    HD2  ARG 103           HD3      ARG 103   8.369  -6.985   8.629
  770    HD3  ARG 103           HD2      ARG 103   6.821  -6.528   9.342
  771    HE   ARG 103           HE       ARG 103   7.080  -8.280  10.919
  772   HH11  ARG 103          HH22      ARG 103   9.312  -8.497   8.301
  773   HH12  ARG 103          HH21      ARG 103  10.255  -9.751   9.033
  774   HH21  ARG 103          HH11      ARG 103   8.296  -9.918  11.891
  775   HH22  ARG 103          HH12      ARG 103   9.681 -10.556  11.065
  776    H    ALA 104           H        ALA 104   6.123  -9.129   3.762
  777    HA   ALA 104           HA       ALA 104   4.760 -11.516   4.260
  778    HB1  ALA 104           HB1      ALA 104   6.048 -12.427   2.586
  779    HB2  ALA 104           HB2      ALA 104   7.548 -11.780   3.247
  780    HB3  ALA 104           HB3      ALA 104   6.466 -10.732   2.330
  781    H    THR 105           H        THR 105   4.920 -13.047   5.829
  782    HA   THR 105           HA       THR 105   7.053 -12.793   7.836
  783    HB   THR 105           HB       THR 105   5.611 -14.986   8.597
  784    HG1  THR 105           HG1      THR 105   4.032 -15.063   7.200
  785   HG21  THR 105          HG21      THR 105   4.256 -13.361   9.946
  786   HG22  THR 105          HG22      THR 105   4.947 -12.055   8.982
  787   HG23  THR 105          HG23      THR 105   5.990 -13.044  10.002
  788    HA   PRO 106           HA       PRO 106   9.962 -15.878   6.610
  789    HB2  PRO 106           HB2      PRO 106   8.979 -17.524   8.913
  790    HB3  PRO 106           HB3      PRO 106  10.643 -17.129   8.444
  791    HG2  PRO 106           HG3      PRO 106   9.351 -15.881  10.454
  792    HG3  PRO 106           HG2      PRO 106  10.591 -15.096   9.465
  793    HD2  PRO 106           HD3      PRO 106   7.704 -14.574   9.549
  794    HD3  PRO 106           HD2      PRO 106   8.999 -13.595   8.831
  Start of MODEL   11
    1    H1   SER   1           H        SER   1  10.900  21.261  -3.624
    2    H2   SER   1           H2       SER   1  11.723  20.317  -2.477
    3    H3   SER   1           1HT      SER   1  12.577  21.039  -3.757
    4    HA   SER   1           HA       SER   1  11.308  18.520  -3.673
    5    HB2  SER   1           HB3      SER   1   9.991  20.631  -5.257
    6    HB3  SER   1           HB2      SER   1  10.399  19.183  -6.172
    7    HG   SER   1           HG       SER   1   8.664  18.405  -5.274
    8    H    SER   2           H        SER   2  13.662  20.654  -4.397
    9    HA   SER   2           HA       SER   2  14.611  19.557  -6.927
   10    HB2  SER   2           HB3      SER   2  15.770  21.421  -4.862
   11    HB3  SER   2           HB2      SER   2  16.761  20.805  -6.181
   12    HG   SER   2           HG       SER   2  14.571  21.552  -7.323
   13    H    LEU   3           H        LEU   3  16.930  19.792  -4.350
   14    HA   LEU   3           HA       LEU   3  17.552  16.919  -4.708
   15    HB2  LEU   3           HB3      LEU   3  19.028  19.096  -3.195
   16    HB3  LEU   3           HB2      LEU   3  19.618  17.455  -3.462
   17    HG   LEU   3           HG       LEU   3  18.747  18.851  -5.911
   18   HD11  LEU   3          HD11      LEU   3  21.040  19.855  -4.215
   19   HD12  LEU   3          HD12      LEU   3  19.731  20.790  -4.936
   20   HD13  LEU   3          HD13      LEU   3  20.989  20.100  -5.960
   21   HD21  LEU   3          HD21      LEU   3  20.749  17.794  -6.792
   22   HD22  LEU   3          HD22      LEU   3  19.908  16.623  -5.778
   23   HD23  LEU   3          HD23      LEU   3  21.335  17.454  -5.163
   24    H    ILE   4           H        ILE   4  16.227  15.676  -3.426
   25    HA   ILE   4           HA       ILE   4  15.599  16.588  -0.680
   26    HB   ILE   4           HB       ILE   4  14.602  14.360  -2.450
   27   HG12  ILE   4          HG13      ILE   4  12.850  16.153  -0.841
   28   HG13  ILE   4          HG12      ILE   4  13.755  16.907  -2.155
   29   HG21  ILE   4          HG21      ILE   4  13.120  13.860  -0.356
   30   HG22  ILE   4          HG22      ILE   4  14.435  14.613   0.546
   31   HG23  ILE   4          HG23      ILE   4  14.744  13.177  -0.428
   32   HD11  ILE   4          HD11      ILE   4  12.224  14.355  -2.617
   33   HD12  ILE   4          HD12      ILE   4  12.738  15.562  -3.795
   34   HD13  ILE   4          HD13      ILE   4  11.409  15.918  -2.691
   35    H    LEU   5           H        LEU   5  16.838  15.932   1.006
   36    HA   LEU   5           HA       LEU   5  18.787  13.744   0.574
   37    HB2  LEU   5           HB3      LEU   5  18.479  15.462   3.046
   38    HB3  LEU   5           HB2      LEU   5  19.900  14.556   2.526
   39    HG   LEU   5           HG       LEU   5  19.375  16.184   0.349
   40   HD11  LEU   5          HD11      LEU   5  17.718  17.371   1.886
   41   HD12  LEU   5          HD12      LEU   5  18.952  18.398   1.156
   42   HD13  LEU   5          HD13      LEU   5  19.111  17.887   2.837
   43   HD21  LEU   5          HD21      LEU   5  21.221  16.564   2.725
   44   HD22  LEU   5          HD22      LEU   5  21.352  17.491   1.230
   45   HD23  LEU   5          HD23      LEU   5  21.594  15.744   1.209
   46    H    LEU   6           H        LEU   6  19.003  12.052   2.257
   47    HA   LEU   6           HA       LEU   6  18.029  10.277   3.449
   48    HB2  LEU   6           HB3      LEU   6  16.810  12.751   4.662
   49    HB3  LEU   6           HB2      LEU   6  16.329  11.150   5.226
   50    HG   LEU   6           HG       LEU   6  18.653  10.595   5.743
   51   HD11  LEU   6          HD11      LEU   6  19.927  11.728   4.113
   52   HD12  LEU   6          HD12      LEU   6  20.303  12.596   5.602
   53   HD13  LEU   6          HD13      LEU   6  19.151  13.274   4.452
   54   HD21  LEU   6          HD21      LEU   6  19.076  12.470   7.453
   55   HD22  LEU   6          HD22      LEU   6  17.531  11.629   7.572
   56   HD23  LEU   6          HD23      LEU   6  17.612  13.222   6.820
   57    H    SER   7           H        SER   7  16.895   9.153   1.844
   58    HA   SER   7           HA       SER   7  14.169  10.074   1.131
   59    HB2  SER   7           HB3      SER   7  14.415   7.821  -0.280
   60    HB3  SER   7           HB2      SER   7  15.149   9.327  -0.822
   61    HG   SER   7           HG       SER   7  16.952   8.260  -0.714
   62    H    ALA   8           H        ALA   8  12.696   7.878   0.816
   63    HA   ALA   8           HA       ALA   8  12.443   6.841   3.580
   64    HB1  ALA   8           HB1      ALA   8  10.451   7.774   2.387
   65    HB2  ALA   8           HB2      ALA   8  10.227   6.100   2.893
   66    HB3  ALA   8           HB3      ALA   8  10.592   6.470   1.207
   67    H    SER   9           H        SER   9  14.556   5.589   2.953
   68    HA   SER   9           HA       SER   9  14.039   3.193   1.307
   69    HB2  SER   9           HB3      SER   9  16.530   3.673   2.929
   70    HB3  SER   9           HB2      SER   9  16.352   2.788   1.417
   71    HG   SER   9           HG       SER   9  17.271   5.009   1.351
   72    H    ASP  10           H        ASP  10  13.176   4.022   4.328
   73    HA   ASP  10           HA       ASP  10  13.928   1.456   5.619
   74    HB2  ASP  10           HB3      ASP  10  12.728   4.042   6.592
   75    HB3  ASP  10           HB2      ASP  10  12.607   2.579   7.567
   76    H    LEU  11           H        LEU  11  11.124   3.188   4.359
   77    HA   LEU  11           HA       LEU  11   9.211   1.228   5.368
   78    HB2  LEU  11           HB3      LEU  11   9.032   3.523   3.408
   79    HB3  LEU  11           HB2      LEU  11   7.668   2.443   3.707
   80    HG   LEU  11           HG       LEU  11   9.035   3.542   6.108
   81   HD11  LEU  11          HD11      LEU  11   7.416   5.582   5.808
   82   HD12  LEU  11          HD12      LEU  11   7.542   5.200   4.093
   83   HD13  LEU  11          HD13      LEU  11   8.989   5.610   5.014
   84   HD21  LEU  11          HD21      LEU  11   6.742   3.571   6.945
   85   HD22  LEU  11          HD22      LEU  11   7.050   2.018   6.167
   86   HD23  LEU  11          HD23      LEU  11   6.117   3.257   5.327
   87    H    ALA  12           H        ALA  12  11.553   0.945   3.122
   88    HA   ALA  12           HA       ALA  12  10.046  -0.356   0.980
   89    HB1  ALA  12           HB1      ALA  12  12.934  -0.933   1.221
   90    HB2  ALA  12           HB2      ALA  12  12.532   0.780   1.109
   91    HB3  ALA  12           HB3      ALA  12  12.019  -0.330  -0.161
   92    H    GLY  13           H        GLY  13  10.532  -2.682   0.414
   93    HA2  GLY  13           HA3      GLY  13  11.651  -4.725   1.698
   94    HA3  GLY  13           HA2      GLY  13  10.416  -4.320   2.887
   95    H    GLN  14           H        GLN  14   9.603  -6.534   2.424
   96    HA   GLN  14           HA       GLN  14   7.997  -6.643  -0.101
   97    HB2  GLN  14           HB3      GLN  14   9.706  -8.591   1.222
   98    HB3  GLN  14           HB2      GLN  14   8.059  -9.202   1.055
   99    HG2  GLN  14           HG3      GLN  14   8.081  -8.733  -1.337
  100    HG3  GLN  14           HG2      GLN  14   9.675  -7.989  -1.205
  101   HE21  GLN  14          HE22      GLN  14  11.435  -9.369  -1.526
  102   HE22  GLN  14          HE21      GLN  14  11.358 -11.064  -1.473
  103    H    TRP  15           H        TRP  15   5.779  -7.192   0.142
  104    HA   TRP  15           HA       TRP  15   4.774  -7.625   2.894
  105    HB2  TRP  15           HB3      TRP  15   3.818  -5.373   1.110
  106    HB3  TRP  15           HB2      TRP  15   3.065  -5.846   2.623
  107    HD1  TRP  15           HD1      TRP  15   6.530  -4.609   1.362
  108    HE1  TRP  15           HE1      TRP  15   7.588  -3.201   3.239
  109    HE3  TRP  15           HE3      TRP  15   2.974  -5.154   4.998
  110    HZ2  TRP  15           HZ2      TRP  15   7.010  -2.400   5.920
  111    HZ3  TRP  15           HZ3      TRP  15   3.257  -4.049   7.199
  112    HH2  TRP  15           HH2      TRP  15   5.266  -2.674   7.664
  113    H    THR  16           H        THR  16   2.308  -7.986   2.764
  114    HA   THR  16           HA       THR  16   1.479  -9.161   0.152
  115    HB   THR  16           HB       THR  16   0.578 -11.031   1.956
  116    HG1  THR  16           HG1      THR  16   1.845 -10.974   3.606
  117   HG21  THR  16          HG21      THR  16   1.476 -11.625  -0.188
  118   HG22  THR  16          HG22      THR  16   2.462 -12.447   1.021
  119   HG23  THR  16          HG23      THR  16   3.064 -10.987   0.237
  120    H    LEU  17           H        LEU  17  -0.882  -9.638   0.163
  121    HA   LEU  17           HA       LEU  17  -2.352  -7.865   2.084
  122    HB2  LEU  17           HB3      LEU  17  -2.351  -7.968  -0.766
  123    HB3  LEU  17           HB2      LEU  17  -3.925  -8.535  -0.218
  124    HG   LEU  17           HG       LEU  17  -4.132  -6.515   1.214
  125   HD11  LEU  17          HD11      LEU  17  -2.247  -5.389   1.718
  126   HD12  LEU  17          HD12      LEU  17  -2.218  -4.805   0.055
  127   HD13  LEU  17          HD13      LEU  17  -1.338  -6.270   0.489
  128   HD21  LEU  17          HD21      LEU  17  -4.532  -4.935  -0.614
  129   HD22  LEU  17          HD22      LEU  17  -5.020  -6.553  -1.118
  130   HD23  LEU  17          HD23      LEU  17  -3.494  -5.877  -1.684
  131    H    GLN  18           H        GLN  18  -4.355  -8.692   2.929
  132    HA   GLN  18           HA       GLN  18  -4.931 -11.560   2.377
  133    HB2  GLN  18           HB3      GLN  18  -3.609 -10.701   4.681
  134    HB3  GLN  18           HB2      GLN  18  -5.290 -10.863   5.188
  135    HG2  GLN  18           HG3      GLN  18  -5.314 -13.150   4.138
  136    HG3  GLN  18           HG2      GLN  18  -3.580 -12.982   3.859
  137   HE21  GLN  18          HE22      GLN  18  -2.266 -12.445   5.935
  138   HE22  GLN  18          HE21      GLN  18  -2.768 -13.190   7.375
  139    H    GLN  19           H        GLN  19  -7.005 -11.547   1.695
  140    HA   GLN  19           HA       GLN  19  -8.858  -9.468   2.738
  141    HB2  GLN  19           HB3      GLN  19  -9.056  -9.512   0.412
  142    HB3  GLN  19           HB2      GLN  19  -8.820 -11.258   0.324
  143    HG2  GLN  19           HG3      GLN  19 -11.022 -11.715   1.030
  144    HG3  GLN  19           HG2      GLN  19 -11.239 -10.098   1.702
  145   HE21  GLN  19          HE22      GLN  19 -12.505  -8.776   0.404
  146   HE22  GLN  19          HE21      GLN  19 -12.637  -8.897  -1.284
  147    H    ASP  20           H        ASP  20 -10.691 -10.034   3.927
  148    HA   ASP  20           HA       ASP  20 -10.800 -12.850   4.884
  149    HB2  ASP  20           HB3      ASP  20 -10.779 -10.683   6.398
  150    HB3  ASP  20           HB2      ASP  20 -12.504 -10.672   6.031
  151    H    GLU  21           H        GLU  21 -13.172 -13.614   5.319
  152    HA   GLU  21           HA       GLU  21 -15.239 -14.220   4.399
  153    HB2  GLU  21           HB3      GLU  21 -15.180 -11.436   4.504
  154    HB3  GLU  21           HB2      GLU  21 -15.681 -11.786   2.851
  155    HG2  GLU  21           HG3      GLU  21 -16.958 -12.903   5.365
  156    HG3  GLU  21           HG2      GLU  21 -17.646 -11.658   4.321
  157    H    ALA  22           H        ALA  22 -12.534 -13.680   2.564
  158    HA   ALA  22           HA       ALA  22 -13.609 -15.219   0.335
  159    HB1  ALA  22           HB1      ALA  22 -14.245 -13.455  -0.917
  160    HB2  ALA  22           HB2      ALA  22 -12.529 -13.087  -1.089
  161    HB3  ALA  22           HB3      ALA  22 -13.475 -12.309   0.180
  162    HA   PRO  23           HA       PRO  23  -9.168 -16.085   1.420
  163    HB2  PRO  23           HB2      PRO  23  -9.869 -18.308  -0.458
  164    HB3  PRO  23           HB3      PRO  23  -8.966 -18.365   1.069
  165    HG2  PRO  23           HG3      PRO  23 -11.489 -19.175   0.938
  166    HG3  PRO  23           HG2      PRO  23 -10.874 -18.306   2.354
  167    HD2  PRO  23           HD3      PRO  23 -12.684 -17.338   0.194
  168    HD3  PRO  23           HD2      PRO  23 -12.598 -16.843   1.899
  169    H    ALA  24           H        ALA  24  -7.757 -14.817   0.319
  170    HA   ALA  24           HA       ALA  24  -6.933 -15.377  -2.358
  171    HB1  ALA  24           HB1      ALA  24  -8.869 -14.376  -3.244
  172    HB2  ALA  24           HB2      ALA  24  -7.713 -13.043  -3.243
  173    HB3  ALA  24           HB3      ALA  24  -8.932 -13.156  -1.974
  174    H    ILE  25           H        ILE  25  -4.798 -14.878  -2.125
  175    HA   ILE  25           HA       ILE  25  -4.068 -12.460  -0.517
  176    HB   ILE  25           HB       ILE  25  -3.227 -14.456   0.533
  177   HG12  ILE  25          HG13      ILE  25  -0.915 -13.425  -1.130
  178   HG13  ILE  25          HG12      ILE  25  -1.628 -12.488   0.185
  179   HG21  ILE  25          HG21      ILE  25  -3.500 -15.986  -1.360
  180   HG22  ILE  25          HG22      ILE  25  -1.851 -16.089  -0.742
  181   HG23  ILE  25          HG23      ILE  25  -2.184 -15.188  -2.220
  182   HD11  ILE  25          HD11      ILE  25   0.420 -14.069   0.673
  183   HD12  ILE  25          HD12      ILE  25  -0.807 -15.335   0.677
  184   HD13  ILE  25          HD13      ILE  25  -0.918 -13.997   1.820
  185    H    CYS  26           H        CYS  26  -2.109 -11.308  -1.314
  186    HA   CYS  26           HA       CYS  26  -1.398 -11.820  -4.142
  187    HB2  CYS  26           HB3      CYS  26  -2.650  -9.237  -3.158
  188    HB3  CYS  26           HB2      CYS  26  -1.748  -9.360  -4.665
  189    H    HIS  27           H        HIS  27   0.763 -11.692  -4.262
  190    HA   HIS  27           HA       HIS  27   2.405 -10.687  -2.123
  191    HB2  HIS  27           HB3      HIS  27   2.799 -12.038  -4.654
  192    HB3  HIS  27           HB2      HIS  27   3.951 -10.713  -4.489
  193    HD1  HIS  27           HD1      HIS  27   6.062 -11.574  -3.494
  194    HD2  HIS  27           HD2      HIS  27   2.722 -13.409  -1.800
  195    HE1  HIS  27           HE1      HIS  27   6.936 -13.145  -1.707
  196    HE2  HIS  27           HE2      HIS  27   4.911 -14.266  -0.670
  197    H    LEU  28           H        LEU  28   3.184  -8.623  -1.809
  198    HA   LEU  28           HA       LEU  28   2.666  -6.625  -3.979
  199    HB2  LEU  28           HB3      LEU  28   1.879  -6.687  -1.165
  200    HB3  LEU  28           HB2      LEU  28   2.750  -5.219  -1.579
  201    HG   LEU  28           HG       LEU  28   0.287  -5.001  -1.912
  202   HD11  LEU  28          HD11      LEU  28   0.594  -3.630  -3.695
  203   HD12  LEU  28          HD12      LEU  28   1.233  -4.925  -4.704
  204   HD13  LEU  28          HD13      LEU  28   2.289  -4.099  -3.559
  205   HD21  LEU  28          HD21      LEU  28   0.349  -6.666  -4.351
  206   HD22  LEU  28          HD22      LEU  28  -0.922  -6.473  -3.146
  207   HD23  LEU  28          HD23      LEU  28   0.425  -7.559  -2.833
  208    H    GLU  29           H        GLU  29   4.128  -4.670  -3.775
  209    HA   GLU  29           HA       GLU  29   6.702  -5.199  -2.419
  210    HB2  GLU  29           HB3      GLU  29   6.341  -5.830  -5.139
  211    HB3  GLU  29           HB2      GLU  29   7.205  -4.293  -5.129
  212    HG2  GLU  29           HG3      GLU  29   8.810  -5.301  -3.463
  213    HG3  GLU  29           HG2      GLU  29   8.019  -6.854  -3.733
  214    H    LEU  30           H        LEU  30   7.005  -3.354  -1.328
  215    HA   LEU  30           HA       LEU  30   5.917  -0.815  -2.361
  216    HB2  LEU  30           HB3      LEU  30   6.977  -1.829   0.231
  217    HB3  LEU  30           HB2      LEU  30   7.181  -0.110  -0.091
  218    HG   LEU  30           HG       LEU  30   4.793   0.163  -0.446
  219   HD11  LEU  30          HD11      LEU  30   4.876  -2.819  -0.457
  220   HD12  LEU  30          HD12      LEU  30   3.949  -1.719  -1.477
  221   HD13  LEU  30          HD13      LEU  30   3.429  -2.037   0.178
  222   HD21  LEU  30          HD21      LEU  30   4.929  -1.606   1.982
  223   HD22  LEU  30          HD22      LEU  30   4.096  -0.064   1.778
  224   HD23  LEU  30          HD23      LEU  30   5.852  -0.105   1.945
  225    H    ARG  31           H        ARG  31   7.226  -0.080  -4.035
  226    HA   ARG  31           HA       ARG  31  10.111  -0.353  -4.006
  227    HB2  ARG  31           HB3      ARG  31   8.068   0.715  -5.785
  228    HB3  ARG  31           HB2      ARG  31   9.473   1.777  -5.715
  229    HG2  ARG  31           HG3      ARG  31   9.697   0.053  -7.492
  230    HG3  ARG  31           HG2      ARG  31  10.955  -0.095  -6.266
  231    HD2  ARG  31           HD3      ARG  31  10.266  -2.162  -5.689
  232    HD3  ARG  31           HD2      ARG  31   8.591  -1.633  -5.548
  233    HE   ARG  31           HE       ARG  31   8.230  -2.631  -7.639
  234   HH11  ARG  31          HH22      ARG  31  11.498  -1.591  -7.286
  235   HH12  ARG  31          HH21      ARG  31  11.993  -2.176  -8.840
  236   HH21  ARG  31          HH11      ARG  31   8.856  -3.403  -9.668
  237   HH22  ARG  31          HH12      ARG  31  10.496  -3.203 -10.188
  238    H    ASP  32           H        ASP  32  11.643   1.480  -3.827
  239    HA   ASP  32           HA       ASP  32  10.681   3.515  -1.863
  240    HB2  ASP  32           HB3      ASP  32  13.330   3.733  -1.657
  241    HB3  ASP  32           HB2      ASP  32  12.444   2.481  -0.784
  242    H    SER  33           H        SER  33  10.819   3.394  -5.010
  243    HA   SER  33           HA       SER  33  12.607   5.607  -5.659
  244    HB2  SER  33           HB3      SER  33  10.345   4.399  -7.278
  245    HB3  SER  33           HB2      SER  33  11.595   5.477  -7.893
  246    HG   SER  33           HG       SER  33  13.115   3.912  -7.498
  247    H    GLU  34           H        GLU  34  11.889   7.737  -6.322
  248    HA   GLU  34           HA       GLU  34   9.534   8.636  -4.787
  249    HB2  GLU  34           HB3      GLU  34  10.334  10.924  -5.621
  250    HB3  GLU  34           HB2      GLU  34  11.442  10.054  -4.559
  251    HG2  GLU  34           HG3      GLU  34  11.779   9.384  -7.400
  252    HG3  GLU  34           HG2      GLU  34  12.105  11.080  -7.032
  253    H    VAL  35           H        VAL  35   7.705   9.601  -5.732
  254    HA   VAL  35           HA       VAL  35   7.536   9.555  -8.715
  255    HB   VAL  35           HB       VAL  35   5.567   8.345  -6.755
  256   HG11  VAL  35          HG11      VAL  35   4.522   7.828  -9.202
  257   HG12  VAL  35          HG12      VAL  35   5.224   9.418  -9.501
  258   HG13  VAL  35          HG13      VAL  35   4.032   9.207  -8.218
  259   HG21  VAL  35          HG21      VAL  35   5.929   6.326  -8.148
  260   HG22  VAL  35          HG22      VAL  35   7.439   6.893  -7.434
  261   HG23  VAL  35          HG23      VAL  35   7.089   7.222  -9.130
  262    H    ALA  36           H        ALA  36   7.301  11.710  -9.127
  263    HA   ALA  36           HA       ALA  36   5.887  13.479  -7.291
  264    HB1  ALA  36           HB1      ALA  36   7.283  13.781  -9.924
  265    HB2  ALA  36           HB2      ALA  36   7.562  14.636  -8.408
  266    HB3  ALA  36           HB3      ALA  36   6.169  15.047  -9.410
  267    H    GLU  37           H        GLU  37   5.121  11.768 -10.276
  268    HA   GLU  37           HA       GLU  37   2.826  13.143 -11.115
  269    HB2  GLU  37           HB3      GLU  37   3.865  11.128 -12.237
  270    HB3  GLU  37           HB2      GLU  37   3.074  10.123 -11.022
  271    HG2  GLU  37           HG3      GLU  37   1.641  10.177 -12.966
  272    HG3  GLU  37           HG2      GLU  37   0.877  11.159 -11.715
  273    H    ALA  38           H        ALA  38   3.255  10.978  -8.381
  274    HA   ALA  38           HA       ALA  38   0.459  11.606  -7.518
  275    HB1  ALA  38           HB1      ALA  38   0.019   9.418  -7.058
  276    HB2  ALA  38           HB2      ALA  38   1.663   9.106  -6.501
  277    HB3  ALA  38           HB3      ALA  38   1.300   9.107  -8.228
  278    H    SER  39           H        SER  39   3.616  12.170  -6.906
  279    HA   SER  39           HA       SER  39   4.774  12.914  -5.016
  280    HB2  SER  39           HB3      SER  39   2.451  14.197  -4.930
  281    HB3  SER  39           HB2      SER  39   2.200  13.184  -3.512
  282    HG   SER  39           HG       SER  39   4.688  14.366  -3.704
  283    H    GLY  40           H        GLY  40   4.638  10.167  -5.240
  284    HA2  GLY  40           HA3      GLY  40   4.804   9.368  -2.415
  285    HA3  GLY  40           HA2      GLY  40   3.578   8.518  -3.355
  286    H    TYR  41           H        TYR  41   4.694   6.510  -3.197
  287    HA   TYR  41           HA       TYR  41   7.215   6.353  -4.800
  288    HB2  TYR  41           HB3      TYR  41   6.362   4.571  -2.504
  289    HB3  TYR  41           HB2      TYR  41   7.891   4.488  -3.381
  290    HD1  TYR  41           HD1      TYR  41   5.780   6.823  -1.345
  291    HD2  TYR  41           HD2      TYR  41   9.720   5.776  -2.685
  292    HE1  TYR  41           HE1      TYR  41   6.748   8.547   0.150
  293    HE2  TYR  41           HE2      TYR  41  10.692   7.495  -1.185
  294    HH   TYR  41           HH       TYR  41  10.275   9.055   0.331
  295    H    ASP  42           H        ASP  42   7.418   4.482  -6.152
  296    HA   ASP  42           HA       ASP  42   5.061   3.722  -7.520
  297    HB2  ASP  42           HB3      ASP  42   7.061   3.484  -8.730
  298    HB3  ASP  42           HB2      ASP  42   7.844   2.577  -7.435
  299    H    LEU  43           H        LEU  43   4.127   1.616  -7.737
  300    HA   LEU  43           HA       LEU  43   4.217  -0.036  -5.236
  301    HB2  LEU  43           HB3      LEU  43   2.080   1.254  -5.371
  302    HB3  LEU  43           HB2      LEU  43   1.765   0.522  -6.942
  303    HG   LEU  43           HG       LEU  43   1.716  -1.715  -5.923
  304   HD11  LEU  43          HD11      LEU  43   2.636  -0.174  -3.531
  305   HD12  LEU  43          HD12      LEU  43   3.127  -1.774  -4.094
  306   HD13  LEU  43          HD13      LEU  43   1.584  -1.563  -3.267
  307   HD21  LEU  43          HD21      LEU  43  -0.237  -1.220  -4.255
  308   HD22  LEU  43          HD22      LEU  43  -0.432  -0.795  -5.954
  309   HD23  LEU  43          HD23      LEU  43  -0.026   0.451  -4.776
  310    H    GLY  44           H        GLY  44   5.789  -1.371  -6.407
  311    HA2  GLY  44           HA3      GLY  44   4.897  -2.756  -8.826
  312    HA3  GLY  44           HA2      GLY  44   6.415  -3.030  -7.975
  313    H    GLY  45           H        GLY  45   5.467  -5.337  -8.596
  314    HA2  GLY  45           HA3      GLY  45   5.160  -7.316  -7.212
  315    HA3  GLY  45           HA2      GLY  45   4.146  -6.369  -6.135
  316    H    ASP  46           H        ASP  46   2.404  -7.865  -6.335
  317    HA   ASP  46           HA       ASP  46   1.217  -8.266  -8.999
  318    HB2  ASP  46           HB3      ASP  46   1.391 -10.135  -7.285
  319    HB3  ASP  46           HB2      ASP  46   0.202  -9.258  -6.321
  320    H    THR  47           H        THR  47   0.682  -6.020  -9.264
  321    HA   THR  47           HA       THR  47  -1.355  -4.885  -7.436
  322    HB   THR  47           HB       THR  47  -1.200  -2.966  -9.203
  323    HG1  THR  47           HG1      THR  47   1.302  -4.083  -9.740
  324   HG21  THR  47          HG21      THR  47  -0.202  -2.911  -6.929
  325   HG22  THR  47          HG22      THR  47   0.800  -2.077  -8.117
  326   HG23  THR  47          HG23      THR  47   1.243  -3.694  -7.567
  327    H    ALA  48           H        ALA  48  -1.019  -6.645 -10.314
  328    HA   ALA  48           HA       ALA  48  -3.512  -5.868 -11.596
  329    HB1  ALA  48           HB1      ALA  48  -3.125  -7.754 -13.073
  330    HB2  ALA  48           HB2      ALA  48  -1.968  -8.454 -11.943
  331    HB3  ALA  48           HB3      ALA  48  -1.581  -6.954 -12.783
  332    H    CYS  49           H        CYS  49  -3.517  -6.822  -8.694
  333    HA   CYS  49           HA       CYS  49  -5.709  -8.836  -9.010
  334    HB2  CYS  49           HB3      CYS  49  -4.579 -10.296  -7.720
  335    HB3  CYS  49           HB2      CYS  49  -3.211  -9.185  -7.682
  336    H    LEU  50           H        LEU  50  -4.488  -5.982  -7.396
  337    HA   LEU  50           HA       LEU  50  -6.542  -5.898  -5.356
  338    HB2  LEU  50           HB3      LEU  50  -5.499  -3.284  -6.176
  339    HB3  LEU  50           HB2      LEU  50  -5.462  -4.062  -4.595
  340    HG   LEU  50           HG       LEU  50  -3.595  -4.599  -6.897
  341   HD11  LEU  50          HD11      LEU  50  -2.382  -2.927  -6.014
  342   HD12  LEU  50          HD12      LEU  50  -2.232  -3.872  -4.533
  343   HD13  LEU  50          HD13      LEU  50  -3.557  -2.721  -4.716
  344   HD21  LEU  50          HD21      LEU  50  -3.289  -6.613  -5.928
  345   HD22  LEU  50          HD22      LEU  50  -4.312  -6.174  -4.561
  346   HD23  LEU  50          HD23      LEU  50  -2.603  -5.751  -4.556
  347    H    THR  51           H        THR  51  -6.729  -5.549  -8.664
  348    HA   THR  51           HA       THR  51  -8.538  -3.346  -8.937
  349    HB   THR  51           HB       THR  51  -8.808  -5.743 -10.707
  350    HG1  THR  51           HG1      THR  51  -6.462  -4.643  -9.996
  351   HG21  THR  51          HG21      THR  51 -10.010  -3.645 -11.183
  352   HG22  THR  51          HG22      THR  51  -8.817  -3.989 -12.436
  353   HG23  THR  51          HG23      THR  51  -8.478  -2.773 -11.204
  354    H    ARG  52           H        ARG  52  -8.998  -5.704  -6.904
  355    HA   ARG  52           HA       ARG  52 -11.916  -6.026  -7.475
  356    HB2  ARG  52           HB3      ARG  52 -11.839  -8.130  -6.257
  357    HB3  ARG  52           HB2      ARG  52 -10.604  -8.166  -7.516
  358    HG2  ARG  52           HG3      ARG  52  -9.073  -7.171  -5.607
  359    HG3  ARG  52           HG2      ARG  52 -10.278  -7.908  -4.549
  360    HD2  ARG  52           HD3      ARG  52  -8.706  -9.330  -6.719
  361    HD3  ARG  52           HD2      ARG  52  -8.460  -9.498  -4.980
  362    HE   ARG  52           HE       ARG  52 -11.152 -10.134  -5.416
  363   HH11  ARG  52          HH22      ARG  52  -8.043 -11.185  -6.471
  364   HH12  ARG  52          HH21      ARG  52  -8.532 -12.830  -6.706
  365   HH21  ARG  52          HH11      ARG  52 -11.809 -12.275  -5.718
  366   HH22  ARG  52          HH12      ARG  52 -10.665 -13.447  -6.279
  367    H    TRP  53           H        TRP  53  -9.485  -4.823  -5.374
  368    HA   TRP  53           HA       TRP  53 -11.517  -4.371  -3.214
  369    HB2  TRP  53           HB3      TRP  53  -8.492  -4.309  -3.003
  370    HB3  TRP  53           HB2      TRP  53  -9.635  -4.132  -1.673
  371    HD1  TRP  53           HD1      TRP  53 -11.619  -6.399  -2.062
  372    HE1  TRP  53           HE1      TRP  53 -10.916  -8.873  -1.949
  373    HE3  TRP  53           HE3      TRP  53  -6.621  -5.946  -3.011
  374    HZ2  TRP  53           HZ2      TRP  53  -8.551 -10.456  -2.220
  375    HZ3  TRP  53           HZ3      TRP  53  -5.168  -7.952  -3.077
  376    HH2  TRP  53           HH2      TRP  53  -6.126 -10.205  -2.684
  377    H    LEU  54           H        LEU  54  -9.862  -2.907  -5.730
  378    HA   LEU  54           HA       LEU  54 -10.382  -0.205  -4.577
  379    HB2  LEU  54           HB3      LEU  54  -7.936  -1.075  -6.150
  380    HB3  LEU  54           HB2      LEU  54  -8.287   0.576  -5.687
  381    HG   LEU  54           HG       LEU  54  -8.559  -0.881  -3.309
  382   HD11  LEU  54          HD11      LEU  54  -7.348  -2.711  -4.618
  383   HD12  LEU  54          HD12      LEU  54  -6.612  -2.225  -3.092
  384   HD13  LEU  54          HD13      LEU  54  -5.948  -1.636  -4.615
  385   HD21  LEU  54          HD21      LEU  54  -6.357   0.866  -4.427
  386   HD22  LEU  54          HD22      LEU  54  -6.344   0.273  -2.769
  387   HD23  LEU  54          HD23      LEU  54  -7.647   1.323  -3.315
  388    HA   PRO  55           HA       PRO  55 -12.389   0.275  -8.505
  389    HB2  PRO  55           HB2      PRO  55 -12.402   2.966  -8.871
  390    HB3  PRO  55           HB3      PRO  55 -13.389   2.156  -7.639
  391    HG2  PRO  55           HG3      PRO  55 -10.893   3.708  -7.342
  392    HG3  PRO  55           HG2      PRO  55 -12.259   3.538  -6.233
  393    HD2  PRO  55           HD3      PRO  55  -9.813   2.198  -6.023
  394    HD3  PRO  55           HD2      PRO  55 -11.304   1.764  -5.173
  395    H    SER  56           H        SER  56  -9.102   1.249  -8.233
  396    HA   SER  56           HA       SER  56  -8.729   0.850 -11.114
  397    HB2  SER  56           HB3      SER  56  -7.725   3.464 -10.013
  398    HB3  SER  56           HB2      SER  56  -7.972   2.994 -11.693
  399    HG   SER  56           HG       SER  56  -9.734   4.158 -11.306
  400    H    GLU  57           H        GLU  57  -7.302  -0.791 -10.610
  401    HA   GLU  57           HA       GLU  57  -5.501  -1.476  -8.874
  402    HB2  GLU  57           HB3      GLU  57  -5.422  -2.402 -11.124
  403    HB3  GLU  57           HB2      GLU  57  -4.650  -0.936 -11.725
  404    HG2  GLU  57           HG3      GLU  57  -2.664  -1.343 -10.491
  405    HG3  GLU  57           HG2      GLU  57  -3.457  -2.548  -9.476
  406    HA   PRO  58           HA       PRO  58  -3.339   2.414  -7.898
  407    HB2  PRO  58           HB2      PRO  58  -1.918   1.422  -5.740
  408    HB3  PRO  58           HB3      PRO  58  -3.531   2.134  -5.656
  409    HG2  PRO  58           HG3      PRO  58  -2.709  -0.662  -5.466
  410    HG3  PRO  58           HG2      PRO  58  -4.184   0.127  -4.903
  411    HD2  PRO  58           HD3      PRO  58  -3.950  -1.532  -7.163
  412    HD3  PRO  58           HD2      PRO  58  -5.332  -0.491  -6.765
  413    H    ARG  59           H        ARG  59  -1.522   3.098  -8.880
  414    HA   ARG  59           HA       ARG  59   0.666   1.133  -9.380
  415    HB2  ARG  59           HB3      ARG  59  -0.574   3.196 -10.959
  416    HB3  ARG  59           HB2      ARG  59   1.136   3.574 -10.748
  417    HG2  ARG  59           HG3      ARG  59   1.729   1.291 -11.497
  418    HG3  ARG  59           HG2      ARG  59   0.019   0.936 -11.738
  419    HD2  ARG  59           HD3      ARG  59   0.339   3.299 -13.131
  420    HD3  ARG  59           HD2      ARG  59   1.863   2.465 -13.434
  421    HE   ARG  59           HE       ARG  59  -0.179   0.564 -13.832
  422   HH11  ARG  59          HH22      ARG  59   0.875   3.601 -15.082
  423   HH12  ARG  59          HH21      ARG  59   0.289   3.295 -16.683
  424   HH21  ARG  59          HH11      ARG  59  -0.949   0.148 -15.916
  425   HH22  ARG  59          HH12      ARG  59  -0.744   1.341 -17.155
  426    H    ALA  60           H        ALA  60  -0.159   3.497  -7.204
  427    HA   ALA  60           HA       ALA  60   2.651   3.815  -6.387
  428    HB1  ALA  60           HB1      ALA  60   2.598   6.244  -6.358
  429    HB2  ALA  60           HB2      ALA  60   0.927   6.252  -6.922
  430    HB3  ALA  60           HB3      ALA  60   2.215   5.695  -7.990
  431    H    TRP  61           H        TRP  61   2.770   4.910  -4.227
  432    HA   TRP  61           HA       TRP  61   0.230   4.980  -2.709
  433    HB2  TRP  61           HB3      TRP  61   1.209   3.522  -0.922
  434    HB3  TRP  61           HB2      TRP  61   0.938   2.661  -2.433
  435    HD1  TRP  61           HD1      TRP  61   3.284   2.834  -4.130
  436    HE1  TRP  61           HE1      TRP  61   5.695   2.284  -3.416
  437    HE3  TRP  61           HE3      TRP  61   2.821   3.258   0.937
  438    HZ2  TRP  61           HZ2      TRP  61   7.226   2.041  -1.016
  439    HZ3  TRP  61           HZ3      TRP  61   4.769   2.844   2.414
  440    HH2  TRP  61           HH2      TRP  61   6.971   2.239   1.445
  441    H    ARG  62           H        ARG  62   0.499   6.148  -0.676
  442    HA   ARG  62           HA       ARG  62   3.065   7.672  -0.471
  443    HB2  ARG  62           HB3      ARG  62   1.570   9.198  -1.499
  444    HB3  ARG  62           HB2      ARG  62   0.237   8.711  -0.451
  445    HG2  ARG  62           HG3      ARG  62   1.094   9.854   1.398
  446    HG3  ARG  62           HG2      ARG  62   2.741   9.841   0.765
  447    HD2  ARG  62           HD3      ARG  62   2.395  11.682  -0.560
  448    HD3  ARG  62           HD2      ARG  62   0.704  11.281  -0.857
  449    HE   ARG  62           HE       ARG  62   0.907  11.972   1.872
  450   HH11  ARG  62          HH22      ARG  62   1.404  13.347  -1.250
  451   HH12  ARG  62          HH21      ARG  62   1.004  14.957  -0.750
  452   HH21  ARG  62          HH11      ARG  62   0.382  14.064   2.542
  453   HH22  ARG  62          HH12      ARG  62   0.425  15.362   1.398
  454    HA   PRO  63           HA       PRO  63   2.330   5.870   3.697
  455    HB2  PRO  63           HB2      PRO  63   4.859   7.148   4.426
  456    HB3  PRO  63           HB3      PRO  63   4.434   5.430   4.431
  457    HG2  PRO  63           HG3      PRO  63   6.134   6.654   2.646
  458    HG3  PRO  63           HG2      PRO  63   5.337   5.097   2.406
  459    HD2  PRO  63           HD3      PRO  63   4.786   7.678   1.115
  460    HD3  PRO  63           HD2      PRO  63   4.308   6.042   0.616
  461    H    THR  64           H        THR  64   1.036   6.992   5.143
  462    HA   THR  64           HA       THR  64   1.385   9.932   5.335
  463    HB   THR  64           HB       THR  64  -0.817   9.360   6.840
  464    HG1  THR  64           HG1      THR  64  -0.843   7.203   6.461
  465   HG21  THR  64          HG21      THR  64  -0.708   9.617   3.821
  466   HG22  THR  64          HG22      THR  64  -0.695  10.958   4.967
  467   HG23  THR  64          HG23      THR  64  -2.123   9.933   4.825
  468    HA   PRO  65           HA       PRO  65   3.230   9.685   9.344
  469    HB2  PRO  65           HB2      PRO  65   1.987  11.757  10.678
  470    HB3  PRO  65           HB3      PRO  65   3.295  11.972   9.499
  471    HG2  PRO  65           HG3      PRO  65   0.365  12.315   9.159
  472    HG3  PRO  65           HG2      PRO  65   1.704  13.249   8.469
  473    HD2  PRO  65           HD3      PRO  65   0.313  11.387   7.037
  474    HD3  PRO  65           HD2      PRO  65   2.021  11.763   6.724
  475    H    ALA  66           H        ALA  66   0.578   8.207   8.871
  476    HA   ALA  66           HA       ALA  66   0.213   7.314  11.590
  477    HB1  ALA  66           HB1      ALA  66  -2.277   7.996  11.620
  478    HB2  ALA  66           HB2      ALA  66  -1.836   9.174  10.384
  479    HB3  ALA  66           HB3      ALA  66  -1.093   9.252  11.981
  480    H    GLY  67           H        GLY  67   0.607   6.332   8.770
  481    HA2  GLY  67           HA3      GLY  67  -0.549   3.876   8.781
  482    HA3  GLY  67           HA2      GLY  67  -1.886   4.870   8.204
  483    H    ILE  68           H        ILE  68  -1.855   3.874   6.126
  484    HA   ILE  68           HA       ILE  68   0.302   4.898   4.354
  485    HB   ILE  68           HB       ILE  68  -0.719   2.052   4.154
  486   HG12  ILE  68          HG13      ILE  68   1.631   3.202   5.657
  487   HG13  ILE  68          HG12      ILE  68   0.457   2.005   6.199
  488   HG21  ILE  68          HG21      ILE  68   0.345   3.380   2.183
  489   HG22  ILE  68          HG22      ILE  68   0.959   1.765   2.528
  490   HG23  ILE  68          HG23      ILE  68   1.855   3.184   3.071
  491   HD11  ILE  68          HD11      ILE  68   2.788   1.651   4.334
  492   HD12  ILE  68          HD12      ILE  68   1.406   0.560   4.235
  493   HD13  ILE  68          HD13      ILE  68   2.329   0.679   5.733
  494    H    ALA  69           H        ALA  69  -0.436   5.308   2.221
  495    HA   ALA  69           HA       ALA  69  -3.362   4.883   1.743
  496    HB1  ALA  69           HB1      ALA  69  -2.887   7.244   2.367
  497    HB2  ALA  69           HB2      ALA  69  -3.467   7.098   0.707
  498    HB3  ALA  69           HB3      ALA  69  -1.750   7.348   1.022
  499    H    LEU  70           H        LEU  70  -3.935   4.432  -0.403
  500    HA   LEU  70           HA       LEU  70  -1.651   3.778  -2.220
  501    HB2  LEU  70           HB3      LEU  70  -4.431   2.648  -1.981
  502    HB3  LEU  70           HB2      LEU  70  -3.363   2.274  -3.327
  503    HG   LEU  70           HG       LEU  70  -2.118   1.980  -0.671
  504   HD11  LEU  70          HD11      LEU  70  -4.350   0.120  -1.545
  505   HD12  LEU  70          HD12      LEU  70  -4.390   1.188  -0.142
  506   HD13  LEU  70          HD13      LEU  70  -3.257  -0.163  -0.192
  507   HD21  LEU  70          HD21      LEU  70  -2.396   0.030  -2.973
  508   HD22  LEU  70          HD22      LEU  70  -1.163   0.031  -1.713
  509   HD23  LEU  70          HD23      LEU  70  -1.179   1.306  -2.931
  510    H    LEU  71           H        LEU  71  -1.528   4.891  -4.139
  511    HA   LEU  71           HA       LEU  71  -3.827   6.675  -4.845
  512    HB2  LEU  71           HB3      LEU  71  -0.880   6.893  -5.533
  513    HB3  LEU  71           HB2      LEU  71  -2.127   8.035  -6.029
  514    HG   LEU  71           HG       LEU  71  -1.877   7.378  -3.116
  515   HD11  LEU  71          HD11      LEU  71   0.378   7.869  -3.384
  516   HD12  LEU  71          HD12      LEU  71  -0.281   9.487  -3.144
  517   HD13  LEU  71          HD13      LEU  71   0.092   8.919  -4.770
  518   HD21  LEU  71          HD21      LEU  71  -2.977   9.396  -2.835
  519   HD22  LEU  71          HD22      LEU  71  -3.572   8.967  -4.439
  520   HD23  LEU  71          HD23      LEU  71  -2.245  10.115  -4.269
  521    H    GLU  72           H        GLU  72  -3.807   7.156  -7.329
  522    HA   GLU  72           HA       GLU  72  -3.457   4.561  -8.787
  523    HB2  GLU  72           HB3      GLU  72  -5.266   5.763 -10.319
  524    HB3  GLU  72           HB2      GLU  72  -5.745   4.865  -8.880
  525    HG2  GLU  72           HG3      GLU  72  -6.010   6.835  -7.598
  526    HG3  GLU  72           HG2      GLU  72  -5.102   7.808  -8.750
  527    H    ARG  73           H        ARG  73  -1.655   7.086  -8.456
  528    HA   ARG  73           HA       ARG  73  -0.016   7.996  -9.872
  529    HB2  ARG  73           HB3      ARG  73  -0.760   5.823 -11.320
  530    HB3  ARG  73           HB2      ARG  73  -1.309   7.111 -12.393
  531    HG2  ARG  73           HG3      ARG  73   1.041   8.152 -11.958
  532    HG3  ARG  73           HG2      ARG  73   1.480   6.532 -11.418
  533    HD2  ARG  73           HD3      ARG  73   0.213   5.920 -13.734
  534    HD3  ARG  73           HD2      ARG  73   0.854   7.511 -14.147
  535    HE   ARG  73           HE       ARG  73   2.962   6.057 -12.948
  536   HH11  ARG  73          HH22      ARG  73   0.884   5.951 -15.698
  537   HH12  ARG  73          HH21      ARG  73   2.043   5.155 -16.708
  538   HH21  ARG  73          HH11      ARG  73   4.488   5.018 -14.253
  539   HH22  ARG  73          HH12      ARG  73   4.083   4.627 -15.891
  540    H    GLY  74           H        GLY  74  -2.525   9.262  -9.080
  541    HA2  GLY  74           HA3      GLY  74  -2.484  11.460 -11.038
  542    HA3  GLY  74           HA2      GLY  74  -4.039  10.651 -10.841
  543    H    GLY  75           H        GLY  75  -2.800  10.247  -7.914
  544    HA2  GLY  75           HA3      GLY  75  -2.604  11.686  -5.974
  545    HA3  GLY  75           HA2      GLY  75  -3.390  12.974  -6.883
  546    H    LEU  76           H        LEU  76  -5.169  10.346  -7.636
  547    HA   LEU  76           HA       LEU  76  -7.284  11.100  -5.752
  548    HB2  LEU  76           HB3      LEU  76  -7.114   9.766  -8.307
  549    HB3  LEU  76           HB2      LEU  76  -8.048   8.783  -7.180
  550    HG   LEU  76           HG       LEU  76  -8.527  11.740  -7.643
  551   HD11  LEU  76          HD11      LEU  76 -10.695  10.656  -8.704
  552   HD12  LEU  76          HD12      LEU  76  -9.624   9.279  -8.958
  553   HD13  LEU  76          HD13      LEU  76  -9.231  10.844  -9.670
  554   HD21  LEU  76          HD21      LEU  76  -9.342   9.948  -5.607
  555   HD22  LEU  76          HD22      LEU  76 -10.752  10.198  -6.637
  556   HD23  LEU  76          HD23      LEU  76  -9.944  11.581  -5.898
  557    H    THR  77           H        THR  77  -6.788  10.361  -3.688
  558    HA   THR  77           HA       THR  77  -5.472   7.940  -3.042
  559    HB   THR  77           HB       THR  77  -7.514   8.573  -1.091
  560    HG1  THR  77           HG1      THR  77  -6.665  10.741  -0.757
  561   HG21  THR  77          HG21      THR  77  -5.259   7.516  -0.737
  562   HG22  THR  77          HG22      THR  77  -5.591   8.876   0.335
  563   HG23  THR  77          HG23      THR  77  -4.532   9.090  -1.059
  564    H    LEU  78           H        LEU  78  -6.113   5.875  -3.311
  565    HA   LEU  78           HA       LEU  78  -8.927   5.315  -4.018
  566    HB2  LEU  78           HB3      LEU  78  -6.603   3.387  -3.863
  567    HB3  LEU  78           HB2      LEU  78  -8.135   3.131  -4.686
  568    HG   LEU  78           HG       LEU  78  -6.173   5.329  -5.410
  569   HD11  LEU  78          HD11      LEU  78  -5.112   3.923  -6.826
  570   HD12  LEU  78          HD12      LEU  78  -6.626   3.200  -7.363
  571   HD13  LEU  78          HD13      LEU  78  -5.844   2.617  -5.897
  572   HD21  LEU  78          HD21      LEU  78  -8.814   4.372  -6.504
  573   HD22  LEU  78          HD22      LEU  78  -7.651   5.168  -7.560
  574   HD23  LEU  78          HD23      LEU  78  -8.292   6.021  -6.158
  575    H    MET  79           H        MET  79  -6.553   4.363  -1.533
  576    HA   MET  79           HA       MET  79  -8.801   3.809   0.299
  577    HB2  MET  79           HB3      MET  79  -8.108   1.684  -1.053
  578    HB3  MET  79           HB2      MET  79  -6.692   1.687  -0.007
  579    HG2  MET  79           HG3      MET  79  -8.199   0.353   1.195
  580    HG3  MET  79           HG2      MET  79  -8.432   1.939   1.929
  581    HE1  MET  79           HE1      MET  79 -10.429   3.154   2.088
  582    HE2  MET  79           HE2      MET  79 -10.803   1.609   2.865
  583    HE3  MET  79           HE3      MET  79 -11.999   2.395   1.838
  584    H    LEU  80           H        LEU  80  -8.240   4.238   2.408
  585    HA   LEU  80           HA       LEU  80  -5.422   5.100   2.891
  586    HB2  LEU  80           HB3      LEU  80  -6.993   6.866   3.340
  587    HB3  LEU  80           HB2      LEU  80  -8.043   5.785   4.252
  588    HG   LEU  80           HG       LEU  80  -6.442   5.602   6.040
  589   HD11  LEU  80          HD11      LEU  80  -4.344   5.453   4.957
  590   HD12  LEU  80          HD12      LEU  80  -4.272   6.999   5.803
  591   HD13  LEU  80          HD13      LEU  80  -4.599   6.956   4.070
  592   HD21  LEU  80          HD21      LEU  80  -5.983   8.460   5.665
  593   HD22  LEU  80          HD22      LEU  80  -6.965   7.635   6.876
  594   HD23  LEU  80          HD23      LEU  80  -7.644   8.004   5.291
  595    H    LEU  81           H        LEU  81  -4.378   3.243   3.573
  596    HA   LEU  81           HA       LEU  81  -5.679   1.365   5.412
  597    HB2  LEU  81           HB3      LEU  81  -3.074   1.513   3.957
  598    HB3  LEU  81           HB2      LEU  81  -3.131   0.533   5.421
  599    HG   LEU  81           HG       LEU  81  -5.061  -0.712   4.524
  600   HD11  LEU  81          HD11      LEU  81  -5.535  -0.324   2.025
  601   HD12  LEU  81          HD12      LEU  81  -4.698   1.217   2.225
  602   HD13  LEU  81          HD13      LEU  81  -6.164   0.881   3.148
  603   HD21  LEU  81          HD21      LEU  81  -3.861  -1.979   2.865
  604   HD22  LEU  81          HD22      LEU  81  -2.664  -1.378   4.014
  605   HD23  LEU  81          HD23      LEU  81  -2.857  -0.589   2.449
  606    H    GLY  82           H        GLY  82  -5.546   1.468   7.605
  607    HA2  GLY  82           HA3      GLY  82  -3.685   3.489   8.795
  608    HA3  GLY  82           HA2      GLY  82  -5.217   3.002   9.514
  609    H    ARG  83           H        ARG  83  -2.339   2.866  10.491
  610    HA   ARG  83           HA       ARG  83  -1.681   0.044  10.677
  611    HB2  ARG  83           HB3      ARG  83   0.008   1.859  10.930
  612    HB3  ARG  83           HB2      ARG  83  -0.780   2.360  12.422
  613    HG2  ARG  83           HG3      ARG  83  -0.156  -0.515  12.334
  614    HG3  ARG  83           HG2      ARG  83   1.269   0.521  12.262
  615    HD2  ARG  83           HD3      ARG  83  -0.920   0.932  14.305
  616    HD3  ARG  83           HD2      ARG  83   0.463  -0.118  14.604
  617    HE   ARG  83           HE       ARG  83   1.280   2.519  13.705
  618   HH11  ARG  83          HH22      ARG  83   0.195   0.605  16.359
  619   HH12  ARG  83          HH21      ARG  83   0.957   1.598  17.558
  620   HH21  ARG  83          HH11      ARG  83   2.279   3.826  15.256
  621   HH22  ARG  83          HH12      ARG  83   2.135   3.421  16.934
  622    H    GLN  84           H        GLN  84  -2.755  -1.399  11.980
  623    HA   GLN  84           HA       GLN  84  -4.518  -0.335  14.107
  624    HB2  GLN  84           HB3      GLN  84  -4.284  -2.922  12.623
  625    HB3  GLN  84           HB2      GLN  84  -5.027  -2.932  14.224
  626    HG2  GLN  84           HG3      GLN  84  -5.870  -0.885  12.190
  627    HG3  GLN  84           HG2      GLN  84  -6.543  -2.511  12.132
  628   HE21  GLN  84          HE22      GLN  84  -6.963   0.541  13.554
  629   HE22  GLN  84          HE21      GLN  84  -7.975   0.078  14.836
  630    H    GLY  85           H        GLY  85  -1.549  -2.139  13.688
  631    HA2  GLY  85           HA3      GLY  85  -0.594  -1.657  16.301
  632    HA3  GLY  85           HA2      GLY  85  -1.371  -3.242  16.328
  633    H    GLU  86           H        GLU  86   1.535  -1.689  15.756
  634    HA   GLU  86           HA       GLU  86   3.604  -2.580  15.065
  635    HB2  GLU  86           HB3      GLU  86   2.246  -4.797  15.839
  636    HB3  GLU  86           HB2      GLU  86   2.442  -5.143  14.120
  637    HG2  GLU  86           HG3      GLU  86   4.400  -6.039  15.079
  638    HG3  GLU  86           HG2      GLU  86   4.921  -4.462  14.486
  639    H    GLY  87           H        GLY  87   4.004  -4.366  12.828
  640    HA2  GLY  87           HA3      GLY  87   3.573  -2.471  10.665
  641    HA3  GLY  87           HA2      GLY  87   4.316  -4.062  10.508
  642    H    ASP  88           H        ASP  88   1.159  -3.595  11.967
  643    HA   ASP  88           HA       ASP  88  -0.044  -5.089   9.671
  644    HB2  ASP  88           HB3      ASP  88  -0.171  -6.271  11.819
  645    HB3  ASP  88           HB2      ASP  88  -0.952  -4.872  12.555
  646    H    TYR  89           H        TYR  89  -1.639  -4.114   8.526
  647    HA   TYR  89           HA       TYR  89  -2.915  -1.649   9.640
  648    HB2  TYR  89           HB3      TYR  89  -2.081  -2.045   6.767
  649    HB3  TYR  89           HB2      TYR  89  -2.799  -0.606   7.437
  650    HD1  TYR  89           HD1      TYR  89   0.162  -2.861   7.901
  651    HD2  TYR  89           HD2      TYR  89  -1.413   1.127   8.181
  652    HE1  TYR  89           HE1      TYR  89   2.411  -2.012   8.496
  653    HE2  TYR  89           HE2      TYR  89   0.844   1.975   8.762
  654    HH   TYR  89           HH       TYR  89   3.630  -0.240   9.014
  655    H    ARG  90           H        ARG  90  -5.124  -1.490   9.186
  656    HA   ARG  90           HA       ARG  90  -6.305  -3.501   7.346
  657    HB2  ARG  90           HB3      ARG  90  -7.576  -3.013  10.032
  658    HB3  ARG  90           HB2      ARG  90  -7.774  -4.389   8.945
  659    HG2  ARG  90           HG3      ARG  90  -5.405  -5.034   9.391
  660    HG3  ARG  90           HG2      ARG  90  -5.298  -3.719  10.557
  661    HD2  ARG  90           HD3      ARG  90  -5.787  -5.825  11.712
  662    HD3  ARG  90           HD2      ARG  90  -7.159  -4.727  11.849
  663    HE   ARG  90           HE       ARG  90  -7.772  -6.208   9.608
  664   HH11  ARG  90          HH22      ARG  90  -6.786  -6.913  12.836
  665   HH12  ARG  90          HH21      ARG  90  -7.629  -8.425  12.905
  666   HH21  ARG  90          HH11      ARG  90  -8.875  -8.181   9.679
  667   HH22  ARG  90          HH12      ARG  90  -8.812  -9.143  11.119
  668    H    VAL  91           H        VAL  91  -8.413  -2.862   6.592
  669    HA   VAL  91           HA       VAL  91  -9.324  -0.140   7.342
  670    HB   VAL  91           HB       VAL  91  -7.669  -0.198   5.289
  671   HG11  VAL  91          HG11      VAL  91  -9.140  -2.087   4.276
  672   HG12  VAL  91          HG12      VAL  91  -8.599  -0.792   3.209
  673   HG13  VAL  91          HG13      VAL  91 -10.247  -0.785   3.837
  674   HG21  VAL  91          HG21      VAL  91 -10.376   1.172   5.153
  675   HG22  VAL  91          HG22      VAL  91  -8.929   1.667   4.274
  676   HG23  VAL  91          HG23      VAL  91  -8.970   1.771   6.034
  677    H    GLN  92           H        GLN  92 -11.550   0.173   6.977
  678    HA   GLN  92           HA       GLN  92 -13.103  -2.292   6.662
  679    HB2  GLN  92           HB3      GLN  92 -13.899   0.596   7.131
  680    HB3  GLN  92           HB2      GLN  92 -15.056  -0.732   7.020
  681    HG2  GLN  92           HG3      GLN  92 -14.548  -1.501   9.094
  682    HG3  GLN  92           HG2      GLN  92 -12.816  -1.258   8.855
  683   HE21  GLN  92          HE22      GLN  92 -15.711   0.909   9.048
  684   HE22  GLN  92          HE21      GLN  92 -14.991   2.008  10.123
  685    H    LYS  93           H        LYS  93 -13.533  -3.032   4.645
  686    HA   LYS  93           HA       LYS  93 -13.717  -1.094   2.398
  687    HB2  LYS  93           HB3      LYS  93 -12.297  -3.266   2.363
  688    HB3  LYS  93           HB2      LYS  93 -13.838  -4.094   2.142
  689    HG2  LYS  93           HG3      LYS  93 -14.279  -2.485   0.213
  690    HG3  LYS  93           HG2      LYS  93 -12.585  -2.008   0.347
  691    HD2  LYS  93           HD3      LYS  93 -12.170  -3.737  -1.055
  692    HD3  LYS  93           HD2      LYS  93 -12.426  -4.762   0.357
  693    HE2  LYS  93           HE3      LYS  93 -14.442  -4.006  -1.767
  694    HE3  LYS  93           HE2      LYS  93 -13.868  -5.621  -1.350
  695    HZ1  LYS  93           HZ1      LYS  93 -15.144  -3.993   0.730
  696    HZ2  LYS  93           HZ2      LYS  93 -15.113  -5.678   0.548
  697    HZ3  LYS  93           HZ3      LYS  93 -16.129  -4.737  -0.436
  698    H    GLY  94           H        GLY  94 -15.879  -0.481   3.544
  699    HA2  GLY  94           HA3      GLY  94 -18.192  -0.366   2.949
  700    HA3  GLY  94           HA2      GLY  94 -18.026  -1.906   2.102
  701    H    ASP  95           H        ASP  95 -17.803  -3.867   3.486
  702    HA   ASP  95           HA       ASP  95 -18.341  -3.771   6.308
  703    HB2  ASP  95           HB3      ASP  95 -20.554  -3.047   5.744
  704    HB3  ASP  95           HB2      ASP  95 -20.683  -4.240   4.450
  705    H    GLY  96           H        GLY  96 -16.467  -5.258   5.690
  706    HA2  GLY  96           HA3      GLY  96 -16.630  -7.818   6.328
  707    HA3  GLY  96           HA2      GLY  96 -17.363  -7.924   4.728
  708    H    GLY  97           H        GLY  97 -15.940  -6.606   3.024
  709    HA2  GLY  97           HA3      GLY  97 -13.577  -8.024   2.578
  710    HA3  GLY  97           HA2      GLY  97 -13.881  -6.426   1.897
  711    H    GLN  98           H        GLN  98 -12.293  -8.215   4.408
  712    HA   GLN  98           HA       GLN  98 -11.140  -5.716   5.546
  713    HB2  GLN  98           HB3      GLN  98 -12.140  -7.817   6.890
  714    HB3  GLN  98           HB2      GLN  98 -10.486  -8.390   6.678
  715    HG2  GLN  98           HG3      GLN  98  -9.626  -6.278   7.628
  716    HG3  GLN  98           HG2      GLN  98 -11.287  -5.726   7.873
  717   HE21  GLN  98          HE22      GLN  98 -10.995  -9.112   8.327
  718   HE22  GLN  98          HE21      GLN  98 -10.925  -9.112  10.022
  719    H    LEU  99           H        LEU  99  -9.341  -5.093   4.554
  720    HA   LEU  99           HA       LEU  99  -7.560  -7.106   3.319
  721    HB2  LEU  99           HB3      LEU  99  -7.328  -4.090   3.363
  722    HB3  LEU  99           HB2      LEU  99  -6.458  -5.198   2.312
  723    HG   LEU  99           HG       LEU  99  -9.457  -4.806   2.353
  724   HD11  LEU  99          HD11      LEU  99  -7.591  -3.138   1.240
  725   HD12  LEU  99          HD12      LEU  99  -9.232  -3.339   0.627
  726   HD13  LEU  99          HD13      LEU  99  -7.904  -4.248  -0.094
  727   HD21  LEU  99          HD21      LEU  99  -9.007  -6.138   0.082
  728   HD22  LEU  99          HD22      LEU  99  -9.264  -6.985   1.606
  729   HD23  LEU  99          HD23      LEU  99  -7.628  -6.742   0.998
  730    H    VAL 100           H        VAL 100  -5.381  -7.350   3.993
  731    HA   VAL 100           HA       VAL 100  -4.605  -5.952   6.513
  732    HB   VAL 100           HB       VAL 100  -4.287  -8.931   6.062
  733   HG11  VAL 100          HG11      VAL 100  -3.057  -7.102   7.844
  734   HG12  VAL 100          HG12      VAL 100  -2.961  -8.863   7.878
  735   HG13  VAL 100          HG13      VAL 100  -4.215  -8.030   8.797
  736   HG21  VAL 100          HG21      VAL 100  -6.458  -7.299   7.321
  737   HG22  VAL 100          HG22      VAL 100  -6.013  -8.822   8.088
  738   HG23  VAL 100          HG23      VAL 100  -6.574  -8.809   6.417
  739    H    LEU 101           H        LEU 101  -2.829  -4.816   5.741
  740    HA   LEU 101           HA       LEU 101  -0.927  -6.180   3.906
  741    HB2  LEU 101           HB3      LEU 101  -1.683  -3.787   3.514
  742    HB3  LEU 101           HB2      LEU 101  -0.839  -3.360   4.983
  743    HG   LEU 101           HG       LEU 101   0.902  -4.901   3.283
  744   HD11  LEU 101          HD11      LEU 101  -0.367  -4.020   1.415
  745   HD12  LEU 101          HD12      LEU 101   1.127  -3.091   1.537
  746   HD13  LEU 101          HD13      LEU 101  -0.387  -2.410   2.134
  747   HD21  LEU 101          HD21      LEU 101   1.496  -3.357   5.185
  748   HD22  LEU 101          HD22      LEU 101   1.016  -2.002   4.163
  749   HD23  LEU 101          HD23      LEU 101   2.378  -3.019   3.696
  750    H    ARG 102           H        ARG 102   0.754  -7.314   4.882
  751    HA   ARG 102           HA       ARG 102   2.071  -6.071   7.218
  752    HB2  ARG 102           HB3      ARG 102   0.245  -7.696   7.994
  753    HB3  ARG 102           HB2      ARG 102   1.242  -8.976   7.301
  754    HG2  ARG 102           HG3      ARG 102   3.104  -7.590   8.744
  755    HG3  ARG 102           HG2      ARG 102   1.668  -7.374   9.747
  756    HD2  ARG 102           HD3      ARG 102   1.299  -9.822   9.729
  757    HD3  ARG 102           HD2      ARG 102   2.754 -10.027   8.754
  758    HE   ARG 102           HE       ARG 102   3.329  -8.565  11.180
  759   HH11  ARG 102          HH22      ARG 102   2.682 -11.670   9.831
  760   HH12  ARG 102          HH21      ARG 102   3.569 -12.531  11.046
  761   HH21  ARG 102          HH11      ARG 102   4.492  -9.671  12.774
  762   HH22  ARG 102          HH12      ARG 102   4.592 -11.398  12.712
  763    H    ARG 103           H        ARG 103   4.249  -6.520   7.264
  764    HA   ARG 103           HA       ARG 103   5.677  -7.262   5.005
  765    HB2  ARG 103           HB3      ARG 103   7.056  -8.256   7.352
  766    HB3  ARG 103           HB2      ARG 103   7.443  -6.856   6.352
  767    HG2  ARG 103           HG3      ARG 103   5.720  -5.542   7.576
  768    HG3  ARG 103           HG2      ARG 103   5.429  -6.934   8.620
  769    HD2  ARG 103           HD3      ARG 103   8.166  -5.688   8.286
  770    HD3  ARG 103           HD2      ARG 103   7.033  -5.176   9.539
  771    HE   ARG 103           HE       ARG 103   8.596  -7.615   9.569
  772   HH11  ARG 103          HH22      ARG 103   5.604  -6.137  10.432
  773   HH12  ARG 103          HH21      ARG 103   5.307  -7.206  11.761
  774   HH21  ARG 103          HH11      ARG 103   8.227  -9.020  11.299
  775   HH22  ARG 103          HH12      ARG 103   6.793  -8.838  12.252
  776    H    ALA 104           H        ALA 104   5.736  -9.160   3.879
  777    HA   ALA 104           HA       ALA 104   4.454 -11.521   4.634
  778    HB1  ALA 104           HB1      ALA 104   6.283 -10.727   2.544
  779    HB2  ALA 104           HB2      ALA 104   5.050 -11.987   2.511
  780    HB3  ALA 104           HB3      ALA 104   6.669 -12.357   3.104
  781    H    THR 105           H        THR 105   7.532 -10.327   5.581
  782    HA   THR 105           HA       THR 105   8.725 -12.730   6.530
  783    HB   THR 105           HB       THR 105   9.684 -10.854   8.265
  784    HG1  THR 105           HG1      THR 105   9.399  -9.273   6.040
  785   HG21  THR 105          HG21      THR 105  10.391 -11.253   5.347
  786   HG22  THR 105          HG22      THR 105  11.062 -12.127   6.723
  787   HG23  THR 105          HG23      THR 105  11.417 -10.413   6.511
  788    HA   PRO 106           HA       PRO 106   6.339 -13.668  10.136
  789    HB2  PRO 106           HB2      PRO 106   8.258 -14.572  11.878
  790    HB3  PRO 106           HB3      PRO 106   7.656 -15.516  10.504
  791    HG2  PRO 106           HG3      PRO 106  10.166 -13.949  10.770
  792    HG3  PRO 106           HG2      PRO 106   9.878 -15.496   9.958
  793    HD2  PRO 106           HD3      PRO 106  10.097 -13.124   8.610
  794    HD3  PRO 106           HD2      PRO 106   9.135 -14.493   8.015
  Start of MODEL   12
    1    H1   SER   1           H        SER   1  12.429  28.436   0.091
    2    H2   SER   1           H2       SER   1  13.375  27.479  -0.946
    3    H3   SER   1           1HT      SER   1  12.322  28.647  -1.589
    4    HA   SER   1           HA       SER   1  10.441  27.380  -0.548
    5    HB2  SER   1           HB3      SER   1  12.095  26.663  -2.885
    6    HB3  SER   1           HB2      SER   1  11.031  25.377  -2.323
    7    HG   SER   1           HG       SER   1  10.384  27.449  -3.778
    8    H    SER   2           H        SER   2   9.813  25.277   0.277
    9    HA   SER   2           HA       SER   2  11.880  24.101   2.004
   10    HB2  SER   2           HB3      SER   2   9.050  24.350   2.087
   11    HB3  SER   2           HB2      SER   2   9.412  22.626   2.046
   12    HG   SER   2           HG       SER   2   9.994  22.826   4.045
   13    H    LEU   3           H        LEU   3  13.232  22.650   1.045
   14    HA   LEU   3           HA       LEU   3  12.271  20.976  -1.184
   15    HB2  LEU   3           HB3      LEU   3  14.918  21.613   0.047
   16    HB3  LEU   3           HB2      LEU   3  14.759  20.069  -0.791
   17    HG   LEU   3           HG       LEU   3  13.999  21.199  -2.814
   18   HD11  LEU   3          HD11      LEU   3  13.922  23.542  -0.955
   19   HD12  LEU   3          HD12      LEU   3  12.780  23.074  -2.216
   20   HD13  LEU   3          HD13      LEU   3  14.309  23.837  -2.650
   21   HD21  LEU   3          HD21      LEU   3  16.568  21.365  -1.721
   22   HD22  LEU   3          HD22      LEU   3  16.242  22.993  -2.313
   23   HD23  LEU   3          HD23      LEU   3  16.138  21.619  -3.413
   24    H    ILE   4           H        ILE   4  10.853  19.462  -0.280
   25    HA   ILE   4           HA       ILE   4  11.276  18.089   2.190
   26    HB   ILE   4           HB       ILE   4   9.714  16.342   1.062
   27   HG12  ILE   4          HG13      ILE   4   9.401  18.593  -0.936
   28   HG13  ILE   4          HG12      ILE   4  10.418  17.189  -1.257
   29   HG21  ILE   4          HG21      ILE   4   9.037  19.254   1.515
   30   HG22  ILE   4          HG22      ILE   4   8.770  17.891   2.602
   31   HG23  ILE   4          HG23      ILE   4   7.798  18.056   1.139
   32   HD11  ILE   4          HD11      ILE   4   7.723  16.543  -0.242
   33   HD12  ILE   4          HD12      ILE   4   8.636  15.810  -1.561
   34   HD13  ILE   4          HD13      ILE   4   7.745  17.307  -1.831
   35    H    LEU   5           H        LEU   5  11.841  15.768   2.428
   36    HA   LEU   5           HA       LEU   5  13.129  14.278   0.350
   37    HB2  LEU   5           HB3      LEU   5  14.723  16.360   1.442
   38    HB3  LEU   5           HB2      LEU   5  15.351  14.842   2.085
   39    HG   LEU   5           HG       LEU   5  14.819  15.394  -0.849
   40   HD11  LEU   5          HD11      LEU   5  16.733  16.686   0.106
   41   HD12  LEU   5          HD12      LEU   5  17.248  15.484  -1.077
   42   HD13  LEU   5          HD13      LEU   5  17.449  15.168   0.647
   43   HD21  LEU   5          HD21      LEU   5  15.202  12.978   0.663
   44   HD22  LEU   5          HD22      LEU   5  16.595  13.220  -0.392
   45   HD23  LEU   5          HD23      LEU   5  14.971  13.158  -1.076
   46    H    LEU   6           H        LEU   6  13.009  12.197   1.047
   47    HA   LEU   6           HA       LEU   6  13.597  11.543   3.860
   48    HB2  LEU   6           HB3      LEU   6  11.063  12.148   3.511
   49    HB3  LEU   6           HB2      LEU   6  10.981  10.552   2.761
   50    HG   LEU   6           HG       LEU   6  12.342   9.883   4.973
   51   HD11  LEU   6          HD11      LEU   6  11.862  11.195   6.848
   52   HD12  LEU   6          HD12      LEU   6  10.480  11.969   6.075
   53   HD13  LEU   6          HD13      LEU   6  12.118  12.423   5.607
   54   HD21  LEU   6          HD21      LEU   6  10.042   9.431   6.015
   55   HD22  LEU   6          HD22      LEU   6  10.307   8.776   4.400
   56   HD23  LEU   6          HD23      LEU   6   9.362  10.250   4.608
   57    H    SER   7           H        SER   7  14.472   9.499   4.005
   58    HA   SER   7           HA       SER   7  14.744   7.993   1.470
   59    HB2  SER   7           HB3      SER   7  16.816   8.280   2.630
   60    HB3  SER   7           HB2      SER   7  16.101   7.801   4.167
   61    HG   SER   7           HG       SER   7  16.211   6.103   1.901
   62    H    ALA   8           H        ALA   8  13.160   6.523   1.075
   63    HA   ALA   8           HA       ALA   8  11.753   5.253   3.354
   64    HB1  ALA   8           HB1      ALA   8  11.233   4.941   0.383
   65    HB2  ALA   8           HB2      ALA   8  10.486   6.183   1.387
   66    HB3  ALA   8           HB3      ALA   8  10.156   4.481   1.702
   67    H    SER   9           H        SER   9  14.570   4.572   2.654
   68    HA   SER   9           HA       SER   9  14.540   1.968   1.373
   69    HB2  SER   9           HB3      SER   9  16.525   3.636   1.668
   70    HB3  SER   9           HB2      SER   9  16.700   2.894   3.256
   71    HG   SER   9           HG       SER   9  17.217   1.888   0.739
   72    H    ASP  10           H        ASP  10  13.351   2.957   4.303
   73    HA   ASP  10           HA       ASP  10  14.162   0.526   5.789
   74    HB2  ASP  10           HB3      ASP  10  13.211   3.177   6.486
   75    HB3  ASP  10           HB2      ASP  10  12.230   1.937   7.270
   76    H    LEU  11           H        LEU  11  11.412   1.875   4.081
   77    HA   LEU  11           HA       LEU  11   9.556  -0.159   5.093
   78    HB2  LEU  11           HB3      LEU  11   9.303   1.870   2.850
   79    HB3  LEU  11           HB2      LEU  11   7.995   0.828   3.412
   80    HG   LEU  11           HG       LEU  11   9.382   2.315   5.551
   81   HD11  LEU  11          HD11      LEU  11   9.445   4.087   3.927
   82   HD12  LEU  11          HD12      LEU  11   8.072   4.411   4.984
   83   HD13  LEU  11          HD13      LEU  11   7.806   3.723   3.382
   84   HD21  LEU  11          HD21      LEU  11   7.156   2.496   6.412
   85   HD22  LEU  11          HD22      LEU  11   7.264   0.888   5.696
   86   HD23  LEU  11          HD23      LEU  11   6.445   2.186   4.829
   87    H    ALA  12           H        ALA  12  11.844   0.132   2.528
   88    HA   ALA  12           HA       ALA  12  10.804  -1.493   0.504
   89    HB1  ALA  12           HB1      ALA  12  13.490  -2.325   0.868
   90    HB2  ALA  12           HB2      ALA  12  13.419  -0.629   1.349
   91    HB3  ALA  12           HB3      ALA  12  12.887  -1.112  -0.262
   92    H    GLY  13           H        GLY  13  10.886  -3.788   0.124
   93    HA2  GLY  13           HA3      GLY  13  11.836  -5.915   1.410
   94    HA3  GLY  13           HA2      GLY  13  10.690  -5.367   2.629
   95    H    GLN  14           H        GLN  14   9.645  -7.493   2.233
   96    HA   GLN  14           HA       GLN  14   7.969  -7.497  -0.247
   97    HB2  GLN  14           HB3      GLN  14   8.424  -9.894   1.526
   98    HB3  GLN  14           HB2      GLN  14   7.940  -9.853  -0.170
   99    HG2  GLN  14           HG3      GLN  14  10.311  -8.603  -0.386
  100    HG3  GLN  14           HG2      GLN  14  10.651  -9.597   1.033
  101   HE21  GLN  14          HE22      GLN  14  10.329 -11.993   0.775
  102   HE22  GLN  14          HE21      GLN  14  10.467 -12.688  -0.767
  103    H    TRP  15           H        TRP  15   5.716  -7.791   0.045
  104    HA   TRP  15           HA       TRP  15   4.716  -8.024   2.824
  105    HB2  TRP  15           HB3      TRP  15   3.954  -5.760   0.960
  106    HB3  TRP  15           HB2      TRP  15   3.198  -6.095   2.510
  107    HD1  TRP  15           HD1      TRP  15   6.739  -5.275   1.127
  108    HE1  TRP  15           HE1      TRP  15   7.988  -3.924   2.929
  109    HE3  TRP  15           HE3      TRP  15   3.242  -5.313   4.852
  110    HZ2  TRP  15           HZ2      TRP  15   7.566  -2.977   5.594
  111    HZ3  TRP  15           HZ3      TRP  15   3.692  -4.178   7.010
  112    HH2  TRP  15           HH2      TRP  15   5.846  -3.010   7.384
  113    H    THR  16           H        THR  16   2.259  -8.214   2.780
  114    HA   THR  16           HA       THR  16   1.231  -9.347   0.222
  115    HB   THR  16           HB       THR  16   0.231 -11.201   1.853
  116    HG1  THR  16           HG1      THR  16   1.709  -9.981   3.493
  117   HG21  THR  16          HG21      THR  16   1.451 -11.919  -0.024
  118   HG22  THR  16          HG22      THR  16   2.375 -12.564   1.332
  119   HG23  THR  16          HG23      THR  16   2.921 -11.106   0.508
  120    H    LEU  17           H        LEU  17  -1.163  -9.646   0.351
  121    HA   LEU  17           HA       LEU  17  -2.402  -7.763   2.332
  122    HB2  LEU  17           HB3      LEU  17  -2.411  -7.590  -0.452
  123    HB3  LEU  17           HB2      LEU  17  -3.978  -8.301  -0.069
  124    HG   LEU  17           HG       LEU  17  -4.257  -6.472   1.673
  125   HD11  LEU  17          HD11      LEU  17  -2.447  -4.655   0.302
  126   HD12  LEU  17          HD12      LEU  17  -1.570  -5.998   1.036
  127   HD13  LEU  17          HD13      LEU  17  -2.608  -4.975   2.029
  128   HD21  LEU  17          HD21      LEU  17  -4.124  -5.997  -1.293
  129   HD22  LEU  17          HD22      LEU  17  -4.568  -4.675  -0.215
  130   HD23  LEU  17          HD23      LEU  17  -5.542  -6.144  -0.256
  131    H    GLN  18           H        GLN  18  -4.466  -8.435   3.200
  132    HA   GLN  18           HA       GLN  18  -5.300 -11.223   2.568
  133    HB2  GLN  18           HB3      GLN  18  -3.796 -10.700   4.787
  134    HB3  GLN  18           HB2      GLN  18  -5.422 -10.462   5.425
  135    HG2  GLN  18           HG3      GLN  18  -6.065 -12.687   4.461
  136    HG3  GLN  18           HG2      GLN  18  -4.378 -12.928   4.006
  137   HE21  GLN  18          HE22      GLN  18  -6.460 -12.332   6.874
  138   HE22  GLN  18          HE21      GLN  18  -5.417 -13.090   7.978
  139    H    GLN  19           H        GLN  19  -7.406 -11.093   2.027
  140    HA   GLN  19           HA       GLN  19  -9.046  -8.869   3.138
  141    HB2  GLN  19           HB3      GLN  19  -9.324  -8.863   0.821
  142    HB3  GLN  19           HB2      GLN  19  -9.234 -10.621   0.705
  143    HG2  GLN  19           HG3      GLN  19 -11.438 -10.911   1.478
  144    HG3  GLN  19           HG2      GLN  19 -11.501  -9.296   2.185
  145   HE21  GLN  19          HE22      GLN  19 -12.118  -7.540   0.820
  146   HE22  GLN  19          HE21      GLN  19 -12.563  -7.743  -0.805
  147    H    ASP  20           H        ASP  20 -10.512  -9.333   4.722
  148    HA   ASP  20           HA       ASP  20 -10.915 -12.130   5.522
  149    HB2  ASP  20           HB3      ASP  20 -10.758  -9.872   6.981
  150    HB3  ASP  20           HB2      ASP  20 -12.509  -9.960   6.783
  151    H    GLU  21           H        GLU  21 -13.380 -12.619   6.155
  152    HA   GLU  21           HA       GLU  21 -15.526 -13.075   5.333
  153    HB2  GLU  21           HB3      GLU  21 -15.236 -10.339   5.293
  154    HB3  GLU  21           HB2      GLU  21 -15.685 -10.687   3.624
  155    HG2  GLU  21           HG3      GLU  21 -17.195 -11.578   6.098
  156    HG3  GLU  21           HG2      GLU  21 -17.702 -10.323   4.967
  157    H    ALA  22           H        ALA  22 -12.840 -13.025   3.440
  158    HA   ALA  22           HA       ALA  22 -14.056 -14.639   1.377
  159    HB1  ALA  22           HB1      ALA  22 -13.909 -11.768   0.951
  160    HB2  ALA  22           HB2      ALA  22 -14.697 -13.004  -0.027
  161    HB3  ALA  22           HB3      ALA  22 -12.988 -12.649  -0.268
  162    HA   PRO  23           HA       PRO  23  -9.594 -15.539   2.326
  163    HB2  PRO  23           HB2      PRO  23 -10.415 -17.849   0.605
  164    HB3  PRO  23           HB3      PRO  23  -9.451 -17.839   2.096
  165    HG2  PRO  23           HG3      PRO  23 -11.994 -18.597   2.116
  166    HG3  PRO  23           HG2      PRO  23 -11.302 -17.659   3.451
  167    HD2  PRO  23           HD3      PRO  23 -13.181 -16.780   1.311
  168    HD3  PRO  23           HD2      PRO  23 -13.013 -16.185   2.978
  169    H    ALA  24           H        ALA  24  -8.159 -14.420   1.107
  170    HA   ALA  24           HA       ALA  24  -7.485 -15.136  -1.575
  171    HB1  ALA  24           HB1      ALA  24  -8.202 -12.812  -2.534
  172    HB2  ALA  24           HB2      ALA  24  -9.365 -12.809  -1.207
  173    HB3  ALA  24           HB3      ALA  24  -9.414 -14.089  -2.422
  174    H    ILE  25           H        ILE  25  -5.327 -14.683  -1.526
  175    HA   ILE  25           HA       ILE  25  -4.422 -12.235  -0.054
  176    HB   ILE  25           HB       ILE  25  -3.114 -14.933  -0.462
  177   HG12  ILE  25          HG13      ILE  25  -3.108 -13.720   2.194
  178   HG13  ILE  25          HG12      ILE  25  -4.742 -13.908   1.559
  179   HG21  ILE  25          HG21      ILE  25  -1.230 -13.820   0.903
  180   HG22  ILE  25          HG22      ILE  25  -1.942 -12.288   0.402
  181   HG23  ILE  25          HG23      ILE  25  -1.328 -13.411  -0.810
  182   HD11  ILE  25          HD11      ILE  25  -3.843 -15.915   2.833
  183   HD12  ILE  25          HD12      ILE  25  -2.697 -16.139   1.512
  184   HD13  ILE  25          HD13      ILE  25  -4.430 -16.261   1.208
  185    H    CYS  26           H        CYS  26  -2.422 -11.245  -0.987
  186    HA   CYS  26           HA       CYS  26  -1.933 -11.868  -3.844
  187    HB2  CYS  26           HB3      CYS  26  -3.333  -9.461  -2.835
  188    HB3  CYS  26           HB2      CYS  26  -2.034  -9.149  -3.982
  189    H    HIS  27           H        HIS  27   0.235 -11.893  -4.090
  190    HA   HIS  27           HA       HIS  27   2.057 -10.957  -2.074
  191    HB2  HIS  27           HB3      HIS  27   2.229 -12.273  -4.678
  192    HB3  HIS  27           HB2      HIS  27   3.520 -11.096  -4.446
  193    HD1  HIS  27           HD1      HIS  27   5.505 -12.422  -3.685
  194    HD2  HIS  27           HD2      HIS  27   2.013 -13.605  -1.732
  195    HE1  HIS  27           HE1      HIS  27   6.199 -14.129  -1.944
  196    HE2  HIS  27           HE2      HIS  27   4.082 -14.855  -0.751
  197    H    LEU  28           H        LEU  28   2.878  -8.926  -1.785
  198    HA   LEU  28           HA       LEU  28   2.485  -6.928  -3.982
  199    HB2  LEU  28           HB3      LEU  28   1.623  -6.912  -1.182
  200    HB3  LEU  28           HB2      LEU  28   2.568  -5.490  -1.603
  201    HG   LEU  28           HG       LEU  28   0.122  -5.175  -1.986
  202   HD11  LEU  28          HD11      LEU  28   0.896  -5.038  -4.750
  203   HD12  LEU  28          HD12      LEU  28   2.274  -4.596  -3.743
  204   HD13  LEU  28          HD13      LEU  28   0.750  -3.728  -3.581
  205   HD21  LEU  28          HD21      LEU  28   0.127  -7.734  -2.875
  206   HD22  LEU  28          HD22      LEU  28   0.197  -6.876  -4.414
  207   HD23  LEU  28          HD23      LEU  28  -1.126  -6.567  -3.290
  208    H    GLU  29           H        GLU  29   4.133  -5.253  -4.073
  209    HA   GLU  29           HA       GLU  29   6.607  -5.823  -2.507
  210    HB2  GLU  29           HB3      GLU  29   6.221  -6.280  -5.328
  211    HB3  GLU  29           HB2      GLU  29   7.407  -4.995  -5.096
  212    HG2  GLU  29           HG3      GLU  29   7.499  -7.672  -3.676
  213    HG3  GLU  29           HG2      GLU  29   8.428  -7.285  -5.124
  214    H    LEU  30           H        LEU  30   7.039  -3.989  -1.443
  215    HA   LEU  30           HA       LEU  30   6.108  -1.401  -2.509
  216    HB2  LEU  30           HB3      LEU  30   7.036  -2.461   0.101
  217    HB3  LEU  30           HB2      LEU  30   7.456  -0.783  -0.232
  218    HG   LEU  30           HG       LEU  30   5.127  -0.222  -0.636
  219   HD11  LEU  30          HD11      LEU  30   4.863  -3.181  -0.682
  220   HD12  LEU  30          HD12      LEU  30   4.010  -1.960  -1.626
  221   HD13  LEU  30          HD13      LEU  30   3.528  -2.285   0.039
  222   HD21  LEU  30          HD21      LEU  30   6.096  -0.556   1.773
  223   HD22  LEU  30          HD22      LEU  30   5.032  -1.961   1.819
  224   HD23  LEU  30          HD23      LEU  30   4.355  -0.350   1.579
  225    H    ARG  31           H        ARG  31   7.459  -0.761  -4.176
  226    HA   ARG  31           HA       ARG  31  10.313  -1.240  -4.155
  227    HB2  ARG  31           HB3      ARG  31   8.347   0.043  -5.912
  228    HB3  ARG  31           HB2      ARG  31   9.920   0.844  -5.925
  229    HG2  ARG  31           HG3      ARG  31  11.035  -1.258  -6.451
  230    HG3  ARG  31           HG2      ARG  31   9.511  -2.136  -6.310
  231    HD2  ARG  31           HD3      ARG  31   9.990  -1.723  -8.669
  232    HD3  ARG  31           HD2      ARG  31   8.592  -0.767  -8.180
  233    HE   ARG  31           HE       ARG  31  10.941   0.814  -7.836
  234   HH11  ARG  31          HH22      ARG  31   8.967  -0.654 -10.250
  235   HH12  ARG  31          HH21      ARG  31   9.322   0.539 -11.455
  236   HH21  ARG  31          HH11      ARG  31  11.416   2.382  -9.396
  237   HH22  ARG  31          HH12      ARG  31  10.708   2.257 -10.971
  238    H    ASP  32           H        ASP  32  11.940   0.562  -4.183
  239    HA   ASP  32           HA       ASP  32  11.209   2.667  -2.182
  240    HB2  ASP  32           HB3      ASP  32  13.744   2.720  -1.818
  241    HB3  ASP  32           HB2      ASP  32  12.906   1.274  -1.250
  242    H    SER  33           H        SER  33  11.306   2.449  -5.349
  243    HA   SER  33           HA       SER  33  13.205   4.562  -6.035
  244    HB2  SER  33           HB3      SER  33  12.682   2.890  -7.719
  245    HB3  SER  33           HB2      SER  33  10.964   3.252  -7.602
  246    HG   SER  33           HG       SER  33  12.724   4.369  -9.183
  247    H    GLU  34           H        GLU  34  12.531   6.686  -6.859
  248    HA   GLU  34           HA       GLU  34  10.186   7.707  -5.364
  249    HB2  GLU  34           HB3      GLU  34  11.139   9.946  -6.297
  250    HB3  GLU  34           HB2      GLU  34  12.049   9.105  -5.041
  251    HG2  GLU  34           HG3      GLU  34  12.656   8.311  -7.836
  252    HG3  GLU  34           HG2      GLU  34  13.167   9.932  -7.363
  253    H    VAL  35           H        VAL  35   8.457   8.796  -6.393
  254    HA   VAL  35           HA       VAL  35   8.398   8.732  -9.376
  255    HB   VAL  35           HB       VAL  35   6.233   7.638  -7.552
  256   HG11  VAL  35          HG11      VAL  35   4.874   8.296  -9.244
  257   HG12  VAL  35          HG12      VAL  35   5.603   6.975 -10.156
  258   HG13  VAL  35          HG13      VAL  35   6.232   8.614 -10.323
  259   HG21  VAL  35          HG21      VAL  35   6.733   5.570  -9.037
  260   HG22  VAL  35          HG22      VAL  35   7.884   5.956  -7.758
  261   HG23  VAL  35          HG23      VAL  35   8.243   6.391  -9.428
  262    H    ALA  36           H        ALA  36   8.092  10.844  -9.900
  263    HA   ALA  36           HA       ALA  36   6.717  12.664  -8.062
  264    HB1  ALA  36           HB1      ALA  36   8.345  13.884  -9.116
  265    HB2  ALA  36           HB2      ALA  36   7.062  14.146 -10.297
  266    HB3  ALA  36           HB3      ALA  36   8.278  12.900 -10.579
  267    H    GLU  37           H        GLU  37   5.918  10.849 -10.953
  268    HA   GLU  37           HA       GLU  37   3.679  12.330 -11.858
  269    HB2  GLU  37           HB3      GLU  37   4.704  10.325 -13.004
  270    HB3  GLU  37           HB2      GLU  37   3.896   9.306 -11.813
  271    HG2  GLU  37           HG3      GLU  37   2.479   9.402 -13.766
  272    HG3  GLU  37           HG2      GLU  37   1.711  10.370 -12.507
  273    H    ALA  38           H        ALA  38   3.990   9.978  -9.238
  274    HA   ALA  38           HA       ALA  38   1.171  10.584  -8.430
  275    HB1  ALA  38           HB1      ALA  38   2.453   8.098  -8.837
  276    HB2  ALA  38           HB2      ALA  38   0.863   8.372  -8.121
  277    HB3  ALA  38           HB3      ALA  38   2.292   8.286  -7.090
  278    H    SER  39           H        SER  39   4.301  11.319  -7.750
  279    HA   SER  39           HA       SER  39   5.341  12.263  -5.882
  280    HB2  SER  39           HB3      SER  39   3.033  13.496  -5.965
  281    HB3  SER  39           HB2      SER  39   2.645  12.496  -4.569
  282    HG   SER  39           HG       SER  39   4.231  13.454  -3.431
  283    H    GLY  40           H        GLY  40   5.348   9.505  -5.916
  284    HA2  GLY  40           HA3      GLY  40   5.529   8.906  -3.060
  285    HA3  GLY  40           HA2      GLY  40   4.271   7.991  -3.892
  286    H    TYR  41           H        TYR  41   5.343   5.983  -3.667
  287    HA   TYR  41           HA       TYR  41   7.881   5.699  -5.219
  288    HB2  TYR  41           HB3      TYR  41   6.866   4.044  -2.889
  289    HB3  TYR  41           HB2      TYR  41   8.387   3.790  -3.749
  290    HD1  TYR  41           HD1      TYR  41   6.483   6.410  -1.851
  291    HD2  TYR  41           HD2      TYR  41  10.321   4.918  -3.067
  292    HE1  TYR  41           HE1      TYR  41   7.596   8.101  -0.423
  293    HE2  TYR  41           HE2      TYR  41  11.436   6.604  -1.631
  294    HH   TYR  41           HH       TYR  41  10.955   8.756  -0.620
  295    H    ASP  42           H        ASP  42   8.047   3.811  -6.552
  296    HA   ASP  42           HA       ASP  42   5.674   3.101  -7.934
  297    HB2  ASP  42           HB3      ASP  42   7.936   2.911  -8.909
  298    HB3  ASP  42           HB2      ASP  42   8.289   1.573  -7.818
  299    H    LEU  43           H        LEU  43   4.709   0.995  -8.124
  300    HA   LEU  43           HA       LEU  43   4.803  -0.648  -5.617
  301    HB2  LEU  43           HB3      LEU  43   2.736   0.782  -5.652
  302    HB3  LEU  43           HB2      LEU  43   2.289   0.026  -7.176
  303    HG   LEU  43           HG       LEU  43   2.231  -2.184  -6.080
  304   HD11  LEU  43          HD11      LEU  43   2.190  -1.887  -3.421
  305   HD12  LEU  43          HD12      LEU  43   3.312  -0.582  -3.806
  306   HD13  LEU  43          HD13      LEU  43   3.683  -2.237  -4.294
  307   HD21  LEU  43          HD21      LEU  43   0.325  -1.605  -4.447
  308   HD22  LEU  43          HD22      LEU  43   0.152  -1.100  -6.125
  309   HD23  LEU  43          HD23      LEU  43   0.625   0.073  -4.897
  310    H    GLY  44           H        GLY  44   6.149  -2.189  -6.788
  311    HA2  GLY  44           HA3      GLY  44   5.065  -3.404  -9.220
  312    HA3  GLY  44           HA2      GLY  44   6.530  -3.904  -8.375
  313    H    GLY  45           H        GLY  45   5.541  -6.092  -8.830
  314    HA2  GLY  45           HA3      GLY  45   4.861  -7.996  -7.513
  315    HA3  GLY  45           HA2      GLY  45   3.946  -6.920  -6.470
  316    H    ASP  46           H        ASP  46   1.970  -8.003  -6.658
  317    HA   ASP  46           HA       ASP  46   0.797  -8.255  -9.374
  318    HB2  ASP  46           HB3      ASP  46   0.899 -10.218  -7.663
  319    HB3  ASP  46           HB2      ASP  46  -0.408  -9.365  -6.843
  320    H    THR  47           H        THR  47   0.242  -6.047  -9.586
  321    HA   THR  47           HA       THR  47  -1.647  -4.904  -7.588
  322    HB   THR  47           HB       THR  47  -1.306  -2.808  -8.647
  323    HG1  THR  47           HG1      THR  47   0.003  -4.008 -10.824
  324   HG21  THR  47          HG21      THR  47   1.337  -4.152  -9.197
  325   HG22  THR  47          HG22      THR  47   0.759  -3.886  -7.552
  326   HG23  THR  47          HG23      THR  47   1.041  -2.511  -8.622
  327    H    ALA  48           H        ALA  48  -1.514  -6.656 -10.442
  328    HA   ALA  48           HA       ALA  48  -4.066  -5.739 -11.574
  329    HB1  ALA  48           HB1      ALA  48  -1.891  -7.103 -12.591
  330    HB2  ALA  48           HB2      ALA  48  -3.452  -6.944 -13.394
  331    HB3  ALA  48           HB3      ALA  48  -3.097  -8.378 -12.430
  332    H    CYS  49           H        CYS  49  -3.713  -7.035  -8.771
  333    HA   CYS  49           HA       CYS  49  -6.008  -8.932  -9.059
  334    HB2  CYS  49           HB3      CYS  49  -5.048 -10.454  -7.513
  335    HB3  CYS  49           HB2      CYS  49  -3.720 -10.031  -8.594
  336    H    LEU  50           H        LEU  50  -5.561  -5.999  -8.213
  337    HA   LEU  50           HA       LEU  50  -6.843  -6.196  -5.513
  338    HB2  LEU  50           HB3      LEU  50  -5.339  -3.860  -6.719
  339    HB3  LEU  50           HB2      LEU  50  -6.010  -3.926  -5.102
  340    HG   LEU  50           HG       LEU  50  -3.999  -5.962  -6.052
  341   HD11  LEU  50          HD11      LEU  50  -3.073  -3.631  -6.274
  342   HD12  LEU  50          HD12      LEU  50  -2.223  -4.622  -5.094
  343   HD13  LEU  50          HD13      LEU  50  -3.376  -3.402  -4.554
  344   HD21  LEU  50          HD21      LEU  50  -4.944  -4.988  -3.342
  345   HD22  LEU  50          HD22      LEU  50  -3.539  -6.029  -3.561
  346   HD23  LEU  50          HD23      LEU  50  -5.136  -6.600  -4.030
  347    H    THR  51           H        THR  51  -7.523  -5.720  -8.709
  348    HA   THR  51           HA       THR  51  -9.273  -3.452  -8.667
  349    HB   THR  51           HB       THR  51 -10.311  -4.543 -10.683
  350    HG1  THR  51           HG1      THR  51 -10.072  -6.685 -10.099
  351   HG21  THR  51          HG21      THR  51  -8.275  -4.428 -12.058
  352   HG22  THR  51          HG22      THR  51  -7.282  -4.534 -10.605
  353   HG23  THR  51          HG23      THR  51  -8.302  -3.120 -10.873
  354    H    ARG  52           H        ARG  52  -9.455  -6.100  -6.799
  355    HA   ARG  52           HA       ARG  52 -12.420  -6.370  -6.927
  356    HB2  ARG  52           HB3      ARG  52 -11.996  -8.264  -5.289
  357    HB3  ARG  52           HB2      ARG  52 -11.300  -8.500  -6.891
  358    HG2  ARG  52           HG3      ARG  52  -9.117  -7.720  -6.080
  359    HG3  ARG  52           HG2      ARG  52  -9.801  -7.436  -4.480
  360    HD2  ARG  52           HD3      ARG  52  -9.699 -10.126  -5.876
  361    HD3  ARG  52           HD2      ARG  52  -8.609  -9.607  -4.590
  362    HE   ARG  52           HE       ARG  52 -11.087  -9.276  -3.448
  363   HH11  ARG  52          HH22      ARG  52  -9.514 -11.813  -5.176
  364   HH12  ARG  52          HH21      ARG  52 -10.349 -13.080  -4.342
  365   HH21  ARG  52          HH11      ARG  52 -12.186 -10.919  -2.348
  366   HH22  ARG  52          HH12      ARG  52 -11.862 -12.574  -2.741
  367    H    TRP  53           H        TRP  53  -9.847  -4.978  -5.089
  368    HA   TRP  53           HA       TRP  53 -11.766  -4.301  -2.885
  369    HB2  TRP  53           HB3      TRP  53  -8.744  -4.315  -2.723
  370    HB3  TRP  53           HB2      TRP  53  -9.884  -4.167  -1.388
  371    HD1  TRP  53           HD1      TRP  53 -11.883  -6.492  -2.167
  372    HE1  TRP  53           HE1      TRP  53 -11.137  -8.944  -1.952
  373    HE3  TRP  53           HE3      TRP  53  -6.807  -5.889  -2.266
  374    HZ2  TRP  53           HZ2      TRP  53  -8.719 -10.457  -1.828
  375    HZ3  TRP  53           HZ3      TRP  53  -5.310  -7.861  -2.087
  376    HH2  TRP  53           HH2      TRP  53  -6.260 -10.140  -1.873
  377    H    LEU  54           H        LEU  54  -9.285  -3.097  -5.080
  378    HA   LEU  54           HA       LEU  54  -9.865  -0.313  -4.198
  379    HB2  LEU  54           HB3      LEU  54  -7.629  -1.530  -5.834
  380    HB3  LEU  54           HB2      LEU  54  -7.805   0.203  -5.610
  381    HG   LEU  54           HG       LEU  54  -7.640  -1.762  -3.306
  382   HD11  LEU  54          HD11      LEU  54  -5.420   0.024  -4.300
  383   HD12  LEU  54          HD12      LEU  54  -5.566  -1.665  -4.783
  384   HD13  LEU  54          HD13      LEU  54  -5.324  -1.251  -3.088
  385   HD21  LEU  54          HD21      LEU  54  -8.240   0.051  -2.112
  386   HD22  LEU  54          HD22      LEU  54  -8.148   1.096  -3.529
  387   HD23  LEU  54          HD23      LEU  54  -6.702   0.777  -2.576
  388    HA   PRO  55           HA       PRO  55 -12.122   0.266  -7.985
  389    HB2  PRO  55           HB2      PRO  55 -11.916   2.942  -8.397
  390    HB3  PRO  55           HB3      PRO  55 -12.882   2.247  -7.081
  391    HG2  PRO  55           HG3      PRO  55 -10.215   3.537  -6.995
  392    HG3  PRO  55           HG2      PRO  55 -11.524   3.557  -5.804
  393    HD2  PRO  55           HD3      PRO  55  -9.247   1.961  -5.656
  394    HD3  PRO  55           HD2      PRO  55 -10.744   1.686  -4.755
  395    H    SER  56           H        SER  56  -8.762   0.954  -7.894
  396    HA   SER  56           HA       SER  56  -8.596   0.578 -10.816
  397    HB2  SER  56           HB3      SER  56  -8.168   2.737 -11.289
  398    HB3  SER  56           HB2      SER  56  -8.344   3.162  -9.588
  399    HG   SER  56           HG       SER  56  -6.111   2.283  -9.415
  400    H    GLU  57           H        GLU  57  -6.399  -0.006 -11.478
  401    HA   GLU  57           HA       GLU  57  -5.059  -1.624  -9.512
  402    HB2  GLU  57           HB3      GLU  57  -5.047  -2.228 -11.883
  403    HB3  GLU  57           HB2      GLU  57  -4.170  -0.749 -12.274
  404    HG2  GLU  57           HG3      GLU  57  -3.013  -2.587 -10.217
  405    HG3  GLU  57           HG2      GLU  57  -2.874  -3.037 -11.917
  406    HA   PRO  58           HA       PRO  58  -2.647   1.966  -8.065
  407    HB2  PRO  58           HB2      PRO  58  -1.327   0.685  -6.031
  408    HB3  PRO  58           HB3      PRO  58  -2.948   1.361  -5.885
  409    HG2  PRO  58           HG3      PRO  58  -2.100  -1.442  -6.163
  410    HG3  PRO  58           HG2      PRO  58  -3.527  -0.757  -5.396
  411    HD2  PRO  58           HD3      PRO  58  -3.475  -2.010  -7.887
  412    HD3  PRO  58           HD2      PRO  58  -4.782  -0.968  -7.286
  413    H    ARG  59           H        ARG  59  -0.919   2.542  -9.245
  414    HA   ARG  59           HA       ARG  59   1.242   0.554  -9.747
  415    HB2  ARG  59           HB3      ARG  59   0.090   2.796 -11.241
  416    HB3  ARG  59           HB2      ARG  59   1.852   2.839 -11.190
  417    HG2  ARG  59           HG3      ARG  59   2.035   0.660 -12.144
  418    HG3  ARG  59           HG2      ARG  59   0.320   0.328 -11.889
  419    HD2  ARG  59           HD3      ARG  59   0.838   2.738 -13.498
  420    HD3  ARG  59           HD2      ARG  59   1.399   1.242 -14.248
  421    HE   ARG  59           HE       ARG  59  -1.237   0.810 -13.260
  422   HH11  ARG  59          HH22      ARG  59   0.517   2.611 -15.621
  423   HH12  ARG  59          HH21      ARG  59  -0.800   2.669 -16.745
  424   HH21  ARG  59          HH11      ARG  59  -2.963   0.876 -14.714
  425   HH22  ARG  59          HH12      ARG  59  -2.770   1.688 -16.231
  426    H    ALA  60           H        ALA  60   0.474   3.010  -7.625
  427    HA   ALA  60           HA       ALA  60   3.277   3.215  -6.763
  428    HB1  ALA  60           HB1      ALA  60   3.528   5.537  -7.009
  429    HB2  ALA  60           HB2      ALA  60   1.796   5.798  -7.212
  430    HB3  ALA  60           HB3      ALA  60   2.736   5.069  -8.515
  431    H    TRP  61           H        TRP  61   3.406   4.431  -4.666
  432    HA   TRP  61           HA       TRP  61   0.847   4.685  -3.195
  433    HB2  TRP  61           HB3      TRP  61   1.713   3.272  -1.328
  434    HB3  TRP  61           HB2      TRP  61   1.460   2.350  -2.806
  435    HD1  TRP  61           HD1      TRP  61   3.879   2.376  -4.425
  436    HE1  TRP  61           HE1      TRP  61   6.234   1.756  -3.595
  437    HE3  TRP  61           HE3      TRP  61   3.235   3.024   0.591
  438    HZ2  TRP  61           HZ2      TRP  61   7.657   1.550  -1.126
  439    HZ3  TRP  61           HZ3      TRP  61   5.104   2.601   2.162
  440    HH2  TRP  61           HH2      TRP  61   7.314   1.865   1.311
  441    H    ARG  62           H        ARG  62   1.156   5.928  -1.190
  442    HA   ARG  62           HA       ARG  62   3.771   7.385  -1.072
  443    HB2  ARG  62           HB3      ARG  62   2.300   8.917  -2.108
  444    HB3  ARG  62           HB2      ARG  62   0.962   8.468  -1.052
  445    HG2  ARG  62           HG3      ARG  62   1.889   9.596   0.804
  446    HG3  ARG  62           HG2      ARG  62   3.493   9.660   0.073
  447    HD2  ARG  62           HD3      ARG  62   1.357  10.975  -1.492
  448    HD3  ARG  62           HD2      ARG  62   1.729  11.742   0.051
  449    HE   ARG  62           HE       ARG  62   3.504  11.607  -2.276
  450   HH11  ARG  62          HH22      ARG  62   3.158  12.002   1.132
  451   HH12  ARG  62          HH21      ARG  62   4.643  12.873   1.315
  452   HH21  ARG  62          HH11      ARG  62   5.445  12.741  -2.055
  453   HH22  ARG  62          HH12      ARG  62   5.937  13.292  -0.488
  454    HA   PRO  63           HA       PRO  63   3.104   5.725   3.171
  455    HB2  PRO  63           HB2      PRO  63   5.681   6.991   3.770
  456    HB3  PRO  63           HB3      PRO  63   5.218   5.287   3.884
  457    HG2  PRO  63           HG3      PRO  63   6.892   6.345   1.989
  458    HG3  PRO  63           HG2      PRO  63   6.020   4.819   1.842
  459    HD2  PRO  63           HD3      PRO  63   5.531   7.375   0.468
  460    HD3  PRO  63           HD2      PRO  63   4.989   5.740   0.035
  461    H    THR  64           H        THR  64   1.860   6.920   4.603
  462    HA   THR  64           HA       THR  64   2.256   9.859   4.683
  463    HB   THR  64           HB       THR  64   0.105   9.363   6.289
  464    HG1  THR  64           HG1      THR  64   0.385   7.260   4.430
  465   HG21  THR  64          HG21      THR  64   0.170  10.901   4.369
  466   HG22  THR  64          HG22      THR  64  -1.268   9.882   4.300
  467   HG23  THR  64          HG23      THR  64   0.114   9.530   3.263
  468    HA   PRO  65           HA       PRO  65   4.232   9.720   8.635
  469    HB2  PRO  65           HB2      PRO  65   3.137  11.902   9.909
  470    HB3  PRO  65           HB3      PRO  65   4.376  12.013   8.645
  471    HG2  PRO  65           HG3      PRO  65   1.439  12.423   8.457
  472    HG3  PRO  65           HG2      PRO  65   2.759  13.288   7.651
  473    HD2  PRO  65           HD3      PRO  65   1.245  11.391   6.393
  474    HD3  PRO  65           HD2      PRO  65   2.935  11.722   5.959
  475    H    ALA  66           H        ALA  66   1.614   8.220   8.366
  476    HA   ALA  66           HA       ALA  66   1.250   7.682  11.204
  477    HB1  ALA  66           HB1      ALA  66  -0.358   9.699  10.121
  478    HB2  ALA  66           HB2      ALA  66  -0.645   8.829  11.628
  479    HB3  ALA  66           HB3      ALA  66  -1.390   8.269  10.132
  480    H    GLY  67           H        GLY  67   0.860   6.958   7.894
  481    HA2  GLY  67           HA3      GLY  67   0.386   4.166   8.440
  482    HA3  GLY  67           HA2      GLY  67  -1.072   4.939   7.820
  483    H    ILE  68           H        ILE  68  -1.142   4.079   5.754
  484    HA   ILE  68           HA       ILE  68   1.029   4.935   3.914
  485    HB   ILE  68           HB       ILE  68  -0.102   2.141   3.748
  486   HG12  ILE  68          HG13      ILE  68   2.293   3.134   5.314
  487   HG13  ILE  68          HG12      ILE  68   0.935   2.181   5.912
  488   HG21  ILE  68          HG21      ILE  68   2.596   3.119   2.840
  489   HG22  ILE  68          HG22      ILE  68   1.163   3.413   1.853
  490   HG23  ILE  68          HG23      ILE  68   1.651   1.760   2.233
  491   HD11  ILE  68          HD11      ILE  68   2.657   0.589   5.622
  492   HD12  ILE  68          HD12      ILE  68   3.184   1.311   4.102
  493   HD13  ILE  68          HD13      ILE  68   1.668   0.412   4.174
  494    H    ALA  69           H        ALA  69   0.292   5.234   1.750
  495    HA   ALA  69           HA       ALA  69  -2.660   4.939   1.336
  496    HB1  ALA  69           HB1      ALA  69  -1.237   7.218   0.049
  497    HB2  ALA  69           HB2      ALA  69  -1.553   7.345   1.780
  498    HB3  ALA  69           HB3      ALA  69  -2.891   7.122   0.653
  499    H    LEU  70           H        LEU  70  -3.280   4.394  -0.779
  500    HA   LEU  70           HA       LEU  70  -1.046   3.523  -2.568
  501    HB2  LEU  70           HB3      LEU  70  -3.895   2.592  -2.269
  502    HB3  LEU  70           HB2      LEU  70  -2.856   2.069  -3.587
  503    HG   LEU  70           HG       LEU  70  -1.684   1.851  -0.876
  504   HD11  LEU  70          HD11      LEU  70  -3.835   1.080  -0.231
  505   HD12  LEU  70          HD12      LEU  70  -2.931  -0.387  -0.610
  506   HD13  LEU  70          HD13      LEU  70  -4.091   0.260  -1.771
  507   HD21  LEU  70          HD21      LEU  70  -0.829  -0.237  -1.818
  508   HD22  LEU  70          HD22      LEU  70  -0.593   1.065  -2.985
  509   HD23  LEU  70          HD23      LEU  70  -1.911  -0.087  -3.202
  510    H    LEU  71           H        LEU  71  -0.867   4.497  -4.558
  511    HA   LEU  71           HA       LEU  71  -3.085   6.328  -5.408
  512    HB2  LEU  71           HB3      LEU  71  -0.109   6.487  -5.976
  513    HB3  LEU  71           HB2      LEU  71  -1.324   7.612  -6.585
  514    HG   LEU  71           HG       LEU  71  -1.219   7.107  -3.638
  515   HD11  LEU  71          HD11      LEU  71   0.841   8.572  -5.264
  516   HD12  LEU  71          HD12      LEU  71   1.069   7.526  -3.862
  517   HD13  LEU  71          HD13      LEU  71   0.424   9.154  -3.651
  518   HD21  LEU  71          HD21      LEU  71  -2.273   9.172  -3.519
  519   HD22  LEU  71          HD22      LEU  71  -2.825   8.639  -5.107
  520   HD23  LEU  71          HD23      LEU  71  -1.483   9.775  -4.976
  521    H    GLU  72           H        GLU  72  -3.007   6.663  -7.898
  522    HA   GLU  72           HA       GLU  72  -2.562   4.006  -9.212
  523    HB2  GLU  72           HB3      GLU  72  -4.386   4.998 -10.827
  524    HB3  GLU  72           HB2      GLU  72  -4.876   4.270  -9.298
  525    HG2  GLU  72           HG3      GLU  72  -5.024   6.442  -8.239
  526    HG3  GLU  72           HG2      GLU  72  -4.344   7.231  -9.663
  527    H    ARG  73           H        ARG  73  -0.794   6.517  -8.974
  528    HA   ARG  73           HA       ARG  73   0.843   7.400 -10.411
  529    HB2  ARG  73           HB3      ARG  73   0.109   5.185 -11.792
  530    HB3  ARG  73           HB2      ARG  73  -0.440   6.437 -12.907
  531    HG2  ARG  73           HG3      ARG  73   1.897   7.504 -12.508
  532    HG3  ARG  73           HG2      ARG  73   2.347   5.914 -11.894
  533    HD2  ARG  73           HD3      ARG  73   1.606   4.891 -14.023
  534    HD3  ARG  73           HD2      ARG  73   1.195   6.491 -14.639
  535    HE   ARG  73           HE       ARG  73   3.949   6.361 -13.738
  536   HH11  ARG  73          HH22      ARG  73   1.731   5.598 -16.267
  537   HH12  ARG  73          HH21      ARG  73   2.933   5.642 -17.513
  538   HH21  ARG  73          HH11      ARG  73   5.529   6.424 -15.352
  539   HH22  ARG  73          HH12      ARG  73   5.083   6.110 -16.995
  540    H    GLY  74           H        GLY  74  -1.687   8.692  -9.682
  541    HA2  GLY  74           HA3      GLY  74  -1.630  10.793 -11.761
  542    HA3  GLY  74           HA2      GLY  74  -3.195  10.038 -11.456
  543    H    GLY  75           H        GLY  75  -1.797   9.805  -8.561
  544    HA2  GLY  75           HA3      GLY  75  -1.517  11.347  -6.723
  545    HA3  GLY  75           HA2      GLY  75  -2.306  12.595  -7.686
  546    H    LEU  76           H        LEU  76  -4.193  10.037  -8.264
  547    HA   LEU  76           HA       LEU  76  -6.208  10.910  -6.324
  548    HB2  LEU  76           HB3      LEU  76  -6.208   8.822  -8.519
  549    HB3  LEU  76           HB2      LEU  76  -7.596   9.116  -7.472
  550    HG   LEU  76           HG       LEU  76  -6.383  11.521  -8.717
  551   HD11  LEU  76          HD11      LEU  76  -7.854   9.393 -10.291
  552   HD12  LEU  76          HD12      LEU  76  -6.268  10.082 -10.639
  553   HD13  LEU  76          HD13      LEU  76  -7.719  11.067 -10.826
  554   HD21  LEU  76          HD21      LEU  76  -8.471  11.364  -7.232
  555   HD22  LEU  76          HD22      LEU  76  -9.265  10.608  -8.615
  556   HD23  LEU  76          HD23      LEU  76  -8.651  12.257  -8.742
  557    H    THR  77           H        THR  77  -5.682  10.211  -4.261
  558    HA   THR  77           HA       THR  77  -4.427   7.753  -3.595
  559    HB   THR  77           HB       THR  77  -6.413   8.705  -1.643
  560    HG1  THR  77           HG1      THR  77  -5.580  10.712  -1.425
  561   HG21  THR  77          HG21      THR  77  -3.400   8.688  -1.468
  562   HG22  THR  77          HG22      THR  77  -4.355   7.215  -1.294
  563   HG23  THR  77          HG23      THR  77  -4.569   8.545  -0.155
  564    H    LEU  78           H        LEU  78  -5.192   5.697  -3.615
  565    HA   LEU  78           HA       LEU  78  -8.034   5.262  -4.292
  566    HB2  LEU  78           HB3      LEU  78  -5.857   3.195  -3.915
  567    HB3  LEU  78           HB2      LEU  78  -7.400   2.967  -4.716
  568    HG   LEU  78           HG       LEU  78  -5.335   4.967  -5.673
  569   HD11  LEU  78          HD11      LEU  78  -5.295   2.093  -5.872
  570   HD12  LEU  78          HD12      LEU  78  -4.149   3.262  -6.528
  571   HD13  LEU  78          HD13      LEU  78  -5.561   2.786  -7.471
  572   HD21  LEU  78          HD21      LEU  78  -7.490   5.512  -6.538
  573   HD22  LEU  78          HD22      LEU  78  -7.895   3.816  -6.808
  574   HD23  LEU  78          HD23      LEU  78  -6.693   4.610  -7.823
  575    H    MET  79           H        MET  79  -5.760   4.499  -1.657
  576    HA   MET  79           HA       MET  79  -8.040   4.271   0.181
  577    HB2  MET  79           HB3      MET  79  -7.751   1.998  -0.906
  578    HB3  MET  79           HB2      MET  79  -6.179   1.902  -0.123
  579    HG2  MET  79           HG3      MET  79  -7.701   0.804   1.354
  580    HG3  MET  79           HG2      MET  79  -7.398   2.384   2.072
  581    HE1  MET  79           HE1      MET  79 -11.235   0.594   0.527
  582    HE2  MET  79           HE2      MET  79  -9.961  -0.103   1.539
  583    HE3  MET  79           HE3      MET  79  -9.653   0.240  -0.161
  584    H    LEU  80           H        LEU  80  -7.433   4.647   2.306
  585    HA   LEU  80           HA       LEU  80  -4.567   5.359   2.727
  586    HB2  LEU  80           HB3      LEU  80  -6.030   7.219   3.158
  587    HB3  LEU  80           HB2      LEU  80  -7.122   6.216   4.110
  588    HG   LEU  80           HG       LEU  80  -5.503   5.988   5.878
  589   HD11  LEU  80          HD11      LEU  80  -3.624   7.190   3.845
  590   HD12  LEU  80          HD12      LEU  80  -3.435   5.698   4.765
  591   HD13  LEU  80          HD13      LEU  80  -3.264   7.256   5.570
  592   HD21  LEU  80          HD21      LEU  80  -6.709   8.319   5.305
  593   HD22  LEU  80          HD22      LEU  80  -5.032   8.850   5.197
  594   HD23  LEU  80          HD23      LEU  80  -5.636   8.134   6.692
  595    H    LEU  81           H        LEU  81  -3.588   3.497   3.467
  596    HA   LEU  81           HA       LEU  81  -4.961   1.692   5.322
  597    HB2  LEU  81           HB3      LEU  81  -2.421   1.721   3.804
  598    HB3  LEU  81           HB2      LEU  81  -2.339   0.912   5.368
  599    HG   LEU  81           HG       LEU  81  -4.290  -0.474   4.754
  600   HD11  LEU  81          HD11      LEU  81  -5.662   0.393   3.178
  601   HD12  LEU  81          HD12      LEU  81  -4.488  -0.179   1.993
  602   HD13  LEU  81          HD13      LEU  81  -4.409   1.481   2.582
  603   HD21  LEU  81          HD21      LEU  81  -2.348  -0.635   2.456
  604   HD22  LEU  81          HD22      LEU  81  -3.106  -1.949   3.356
  605   HD23  LEU  81          HD23      LEU  81  -1.819  -0.998   4.098
  606    H    GLY  82           H        GLY  82  -4.936   1.928   7.515
  607    HA2  GLY  82           HA3      GLY  82  -3.030   3.911   8.684
  608    HA3  GLY  82           HA2      GLY  82  -4.549   3.411   9.421
  609    H    ARG  83           H        ARG  83  -1.586   3.270  10.274
  610    HA   ARG  83           HA       ARG  83  -0.944   0.455  10.483
  611    HB2  ARG  83           HB3      ARG  83   0.735   2.298  10.679
  612    HB3  ARG  83           HB2      ARG  83   0.006   2.756  12.215
  613    HG2  ARG  83           HG3      ARG  83   0.600  -0.102  12.113
  614    HG3  ARG  83           HG2      ARG  83   2.042   0.879  11.856
  615    HD2  ARG  83           HD3      ARG  83   0.092   1.292  14.138
  616    HD3  ARG  83           HD2      ARG  83   1.604   0.393  14.272
  617    HE   ARG  83           HE       ARG  83   1.919   3.112  13.226
  618   HH11  ARG  83          HH22      ARG  83   1.764   1.020  15.963
  619   HH12  ARG  83          HH21      ARG  83   2.672   2.079  16.991
  620   HH21  ARG  83          HH11      ARG  83   3.104   4.506  14.552
  621   HH22  ARG  83          HH12      ARG  83   3.430   4.052  16.193
  622    H    GLN  84           H        GLN  84  -1.776  -1.023  11.938
  623    HA   GLN  84           HA       GLN  84  -3.129   0.030  14.376
  624    HB2  GLN  84           HB3      GLN  84  -4.046  -2.285  12.640
  625    HB3  GLN  84           HB2      GLN  84  -4.834  -1.714  14.112
  626    HG2  GLN  84           HG3      GLN  84  -4.439  -0.066  11.597
  627    HG3  GLN  84           HG2      GLN  84  -5.949  -0.844  12.073
  628   HE21  GLN  84          HE22      GLN  84  -5.989  -0.307  14.843
  629   HE22  GLN  84          HE21      GLN  84  -6.081   1.371  15.089
  630    H    GLY  85           H        GLY  85  -0.766  -0.506  14.980
  631    HA2  GLY  85           HA3      GLY  85   0.163  -1.938  16.719
  632    HA3  GLY  85           HA2      GLY  85  -0.731  -3.294  16.036
  633    H    GLU  86           H        GLU  86   2.254  -1.643  16.062
  634    HA   GLU  86           HA       GLU  86   4.256  -1.982  14.880
  635    HB2  GLU  86           HB3      GLU  86   3.403  -4.379  15.788
  636    HB3  GLU  86           HB2      GLU  86   3.403  -4.708  14.055
  637    HG2  GLU  86           HG3      GLU  86   5.752  -3.820  13.952
  638    HG3  GLU  86           HG2      GLU  86   5.734  -3.707  15.712
  639    H    GLY  87           H        GLY  87   4.511  -3.857  12.601
  640    HA2  GLY  87           HA3      GLY  87   3.729  -2.008  10.502
  641    HA3  GLY  87           HA2      GLY  87   4.515  -3.568  10.263
  642    H    ASP  88           H        ASP  88   1.522  -3.197  12.080
  643    HA   ASP  88           HA       ASP  88   0.161  -4.868  10.013
  644    HB2  ASP  88           HB3      ASP  88  -0.884  -4.265  12.780
  645    HB3  ASP  88           HB2      ASP  88  -1.292  -5.618  11.726
  646    H    TYR  89           H        TYR  89  -0.924  -3.596   8.572
  647    HA   TYR  89           HA       TYR  89  -2.347  -1.188   9.616
  648    HB2  TYR  89           HB3      TYR  89  -1.627  -1.767   6.749
  649    HB3  TYR  89           HB2      TYR  89  -2.227  -0.259   7.388
  650    HD1  TYR  89           HD1      TYR  89   0.608  -2.669   7.777
  651    HD2  TYR  89           HD2      TYR  89  -0.715   1.407   8.054
  652    HE1  TYR  89           HE1      TYR  89   2.930  -1.945   8.256
  653    HE2  TYR  89           HE2      TYR  89   1.610   2.129   8.522
  654    HH   TYR  89           HH       TYR  89   3.901   0.353   9.605
  655    H    ARG  90           H        ARG  90  -4.538  -0.971   9.199
  656    HA   ARG  90           HA       ARG  90  -5.844  -3.098   7.587
  657    HB2  ARG  90           HB3      ARG  90  -6.962  -2.183  10.244
  658    HB3  ARG  90           HB2      ARG  90  -7.440  -3.585   9.287
  659    HG2  ARG  90           HG3      ARG  90  -5.287  -4.659   9.724
  660    HG3  ARG  90           HG2      ARG  90  -4.732  -3.239  10.605
  661    HD2  ARG  90           HD3      ARG  90  -5.468  -4.819  12.251
  662    HD3  ARG  90           HD2      ARG  90  -6.701  -3.561  12.166
  663    HE   ARG  90           HE       ARG  90  -7.606  -5.454  10.373
  664   HH11  ARG  90          HH22      ARG  90  -6.524  -5.464  13.647
  665   HH12  ARG  90          HH21      ARG  90  -7.533  -6.792  14.117
  666   HH21  ARG  90          HH11      ARG  90  -8.929  -7.189  10.968
  667   HH22  ARG  90          HH12      ARG  90  -8.894  -7.768  12.600
  668    H    VAL  91           H        VAL  91  -7.814  -2.424   6.640
  669    HA   VAL  91           HA       VAL  91  -8.597   0.424   7.048
  670    HB   VAL  91           HB       VAL  91  -7.038   0.198   5.063
  671   HG11  VAL  91          HG11      VAL  91  -9.348  -1.139   3.669
  672   HG12  VAL  91          HG12      VAL  91  -8.137  -2.108   4.510
  673   HG13  VAL  91          HG13      VAL  91  -7.655  -1.055   3.180
  674   HG21  VAL  91          HG21      VAL  91  -8.182   2.066   4.512
  675   HG22  VAL  91          HG22      VAL  91  -9.667   1.426   5.217
  676   HG23  VAL  91          HG23      VAL  91  -9.249   1.046   3.546
  677    H    GLN  92           H        GLN  92 -10.794   0.687   7.060
  678    HA   GLN  92           HA       GLN  92 -12.471  -1.696   6.894
  679    HB2  GLN  92           HB3      GLN  92 -13.214   1.225   7.249
  680    HB3  GLN  92           HB2      GLN  92 -14.309  -0.142   7.463
  681    HG2  GLN  92           HG3      GLN  92 -13.133  -0.935   9.361
  682    HG3  GLN  92           HG2      GLN  92 -11.717   0.055   8.998
  683   HE21  GLN  92          HE22      GLN  92 -12.426   0.546  11.485
  684   HE22  GLN  92          HE21      GLN  92 -13.387   1.934  11.662
  685    H    LYS  93           H        LYS  93 -13.167  -2.464   4.969
  686    HA   LYS  93           HA       LYS  93 -13.427  -0.590   2.671
  687    HB2  LYS  93           HB3      LYS  93 -12.171  -2.919   2.672
  688    HB3  LYS  93           HB2      LYS  93 -13.799  -3.555   2.433
  689    HG2  LYS  93           HG3      LYS  93 -14.075  -1.985   0.503
  690    HG3  LYS  93           HG2      LYS  93 -12.390  -1.504   0.702
  691    HD2  LYS  93           HD3      LYS  93 -12.068  -3.183  -0.833
  692    HD3  LYS  93           HD2      LYS  93 -12.052  -4.170   0.629
  693    HE2  LYS  93           HE3      LYS  93 -13.604  -5.295  -0.726
  694    HE3  LYS  93           HE2      LYS  93 -14.637  -4.286   0.287
  695    HZ1  LYS  93           HZ1      LYS  93 -15.295  -4.088  -2.003
  696    HZ2  LYS  93           HZ2      LYS  93 -13.720  -3.662  -2.466
  697    HZ3  LYS  93           HZ3      LYS  93 -14.628  -2.613  -1.486
  698    H    GLY  94           H        GLY  94 -15.450   0.359   2.890
  699    HA2  GLY  94           HA3      GLY  94 -17.790   0.496   2.814
  700    HA3  GLY  94           HA2      GLY  94 -17.769  -1.150   2.181
  701    H    ASP  95           H        ASP  95 -17.565  -2.917   3.801
  702    HA   ASP  95           HA       ASP  95 -17.857  -2.444   6.613
  703    HB2  ASP  95           HB3      ASP  95 -20.324  -2.464   4.964
  704    HB3  ASP  95           HB2      ASP  95 -20.366  -3.464   6.418
  705    H    GLY  96           H        GLY  96 -16.251  -4.174   6.340
  706    HA2  GLY  96           HA3      GLY  96 -16.606  -6.619   7.183
  707    HA3  GLY  96           HA2      GLY  96 -17.399  -6.834   5.623
  708    H    GLY  97           H        GLY  97 -15.889  -5.750   3.779
  709    HA2  GLY  97           HA3      GLY  97 -13.678  -7.458   3.443
  710    HA3  GLY  97           HA2      GLY  97 -13.882  -5.939   2.570
  711    H    GLN  98           H        GLN  98 -12.184  -7.561   5.065
  712    HA   GLN  98           HA       GLN  98 -10.908  -5.021   5.971
  713    HB2  GLN  98           HB3      GLN  98 -11.887  -6.997   7.520
  714    HB3  GLN  98           HB2      GLN  98 -10.256  -7.614   7.269
  715    HG2  GLN  98           HG3      GLN  98  -9.312  -5.462   8.018
  716    HG3  GLN  98           HG2      GLN  98 -10.949  -4.851   8.296
  717   HE21  GLN  98          HE22      GLN  98 -10.298  -4.634  10.634
  718   HE22  GLN  98          HE21      GLN  98 -10.320  -6.007  11.630
  719    H    LEU  99           H        LEU  99  -9.108  -4.535   4.900
  720    HA   LEU  99           HA       LEU  99  -7.504  -6.690   3.663
  721    HB2  LEU  99           HB3      LEU  99  -6.745  -3.793   3.556
  722    HB3  LEU  99           HB2      LEU  99  -6.556  -5.040   2.332
  723    HG   LEU  99           HG       LEU  99  -9.154  -3.746   3.174
  724   HD11  LEU  99          HD11      LEU  99  -7.234  -2.817   1.430
  725   HD12  LEU  99          HD12      LEU  99  -8.945  -2.393   1.369
  726   HD13  LEU  99          HD13      LEU  99  -8.325  -3.696   0.358
  727   HD21  LEU  99          HD21      LEU  99  -8.496  -6.174   1.569
  728   HD22  LEU  99          HD22      LEU  99  -9.796  -5.140   0.974
  729   HD23  LEU  99          HD23      LEU  99  -9.902  -5.849   2.586
  730    H    VAL 100           H        VAL 100  -5.306  -7.019   4.239
  731    HA   VAL 100           HA       VAL 100  -4.345  -5.598   6.681
  732    HB   VAL 100           HB       VAL 100  -4.283  -8.606   6.309
  733   HG11  VAL 100          HG11      VAL 100  -3.352  -6.726   8.486
  734   HG12  VAL 100          HG12      VAL 100  -2.418  -7.957   7.636
  735   HG13  VAL 100          HG13      VAL 100  -3.657  -8.434   8.795
  736   HG21  VAL 100          HG21      VAL 100  -6.512  -8.252   6.850
  737   HG22  VAL 100          HG22      VAL 100  -6.171  -6.746   7.705
  738   HG23  VAL 100          HG23      VAL 100  -5.808  -8.295   8.466
  739    H    LEU 101           H        LEU 101  -2.480  -4.645   5.934
  740    HA   LEU 101           HA       LEU 101  -0.760  -6.134   4.007
  741    HB2  LEU 101           HB3      LEU 101  -1.393  -3.684   3.656
  742    HB3  LEU 101           HB2      LEU 101  -0.408  -3.327   5.057
  743    HG   LEU 101           HG       LEU 101   1.097  -4.995   3.266
  744   HD11  LEU 101          HD11      LEU 101  -0.115  -2.461   2.121
  745   HD12  LEU 101          HD12      LEU 101  -0.281  -4.094   1.475
  746   HD13  LEU 101          HD13      LEU 101   1.284  -3.284   1.429
  747   HD21  LEU 101          HD21      LEU 101   2.712  -3.208   3.502
  748   HD22  LEU 101          HD22      LEU 101   1.916  -3.411   5.062
  749   HD23  LEU 101          HD23      LEU 101   1.457  -2.076   4.004
  750    H    ARG 102           H        ARG 102   0.848  -7.396   4.952
  751    HA   ARG 102           HA       ARG 102   2.297  -6.252   7.283
  752    HB2  ARG 102           HB3      ARG 102   0.467  -8.003   7.910
  753    HB3  ARG 102           HB2      ARG 102   1.575  -9.176   7.196
  754    HG2  ARG 102           HG3      ARG 102   3.349  -7.923   8.724
  755    HG3  ARG 102           HG2      ARG 102   1.911  -7.507   9.657
  756    HD2  ARG 102           HD3      ARG 102   2.870 -10.288   8.929
  757    HD3  ARG 102           HD2      ARG 102   2.791  -9.579  10.543
  758    HE   ARG 102           HE       ARG 102   0.181  -9.435   9.703
  759   HH11  ARG 102          HH22      ARG 102   2.589 -11.902   9.742
  760   HH12  ARG 102          HH21      ARG 102   1.453 -13.195   9.931
  761   HH21  ARG 102          HH11      ARG 102  -1.318 -11.109   9.949
  762   HH22  ARG 102          HH12      ARG 102  -0.760 -12.746  10.049
  763    H    ARG 103           H        ARG 103   4.447  -6.546   7.134
  764    HA   ARG 103           HA       ARG 103   5.730  -7.225   4.755
  765    HB2  ARG 103           HB3      ARG 103   7.746  -7.649   6.269
  766    HB3  ARG 103           HB2      ARG 103   6.988  -6.068   6.402
  767    HG2  ARG 103           HG3      ARG 103   5.765  -8.040   8.182
  768    HG3  ARG 103           HG2      ARG 103   7.484  -7.821   8.505
  769    HD2  ARG 103           HD3      ARG 103   7.151  -5.377   8.636
  770    HD3  ARG 103           HD2      ARG 103   5.429  -5.597   8.328
  771    HE   ARG 103           HE       ARG 103   5.171  -6.280  10.573
  772   HH11  ARG 103          HH22      ARG 103   8.463  -6.353   9.552
  773   HH12  ARG 103          HH21      ARG 103   9.087  -6.687  11.133
  774   HH21  ARG 103          HH11      ARG 103   5.965  -6.716  12.645
  775   HH22  ARG 103          HH12      ARG 103   7.672  -6.891  12.884
  776    H    ALA 104           H        ALA 104   6.212  -9.138   3.767
  777    HA   ALA 104           HA       ALA 104   5.067 -11.591   4.495
  778    HB1  ALA 104           HB1      ALA 104   6.392 -10.802   2.324
  779    HB2  ALA 104           HB2      ALA 104   6.253 -12.512   2.732
  780    HB3  ALA 104           HB3      ALA 104   7.727 -11.628   3.125
  781    H    THR 105           H        THR 105   5.682 -13.267   5.839
  782    HA   THR 105           HA       THR 105   7.864 -12.687   7.732
  783    HB   THR 105           HB       THR 105   6.671 -15.258   8.176
  784    HG1  THR 105           HG1      THR 105   4.881 -13.108   7.706
  785   HG21  THR 105          HG21      THR 105   5.944 -14.168  10.263
  786   HG22  THR 105          HG22      THR 105   6.332 -12.591   9.577
  787   HG23  THR 105          HG23      THR 105   7.617 -13.757   9.890
  788    HA   PRO 106           HA       PRO 106   9.539 -16.656   5.736
  789    HB2  PRO 106           HB2      PRO 106   8.222 -17.800   3.655
  790    HB3  PRO 106           HB3      PRO 106   7.779 -18.099   5.346
  791    HG2  PRO 106           HG3      PRO 106   6.401 -16.503   3.301
  792    HG3  PRO 106           HG2      PRO 106   5.760 -17.279   4.754
  793    HD2  PRO 106           HD3      PRO 106   6.426 -14.514   4.407
  794    HD3  PRO 106           HD2      PRO 106   5.857 -15.310   5.890
  Start of MODEL   13
    1    H1   SER   1           H        SER   1   9.170  24.256  -2.322
    2    H2   SER   1           H2       SER   1  10.129  23.167  -1.440
    3    H3   SER   1           1HT      SER   1  10.840  24.178  -2.605
    4    HA   SER   1           HA       SER   1   9.291  21.723  -2.957
    5    HB2  SER   1           HB3      SER   1   9.417  23.184  -5.434
    6    HB3  SER   1           HB2      SER   1   8.006  22.509  -4.627
    7    HG   SER   1           HG       SER   1   7.766  24.728  -4.755
    8    H    SER   2           H        SER   2  12.125  22.983  -2.509
    9    HA   SER   2           HA       SER   2  13.482  22.044  -4.963
   10    HB2  SER   2           HB3      SER   2  15.334  22.713  -2.893
   11    HB3  SER   2           HB2      SER   2  14.997  23.597  -4.378
   12    HG   SER   2           HG       SER   2  14.308  24.181  -1.845
   13    H    LEU   3           H        LEU   3  14.709  20.165  -5.046
   14    HA   LEU   3           HA       LEU   3  15.338  17.986  -4.436
   15    HB2  LEU   3           HB3      LEU   3  16.798  19.472  -2.934
   16    HB3  LEU   3           HB2      LEU   3  15.649  19.106  -1.646
   17    HG   LEU   3           HG       LEU   3  16.069  16.608  -2.515
   18   HD11  LEU   3          HD11      LEU   3  17.726  17.745  -4.226
   19   HD12  LEU   3          HD12      LEU   3  18.173  16.227  -3.445
   20   HD13  LEU   3          HD13      LEU   3  18.825  17.754  -2.848
   21   HD21  LEU   3          HD21      LEU   3  17.586  18.324  -0.570
   22   HD22  LEU   3          HD22      LEU   3  18.089  16.653  -0.820
   23   HD23  LEU   3          HD23      LEU   3  16.459  17.007  -0.247
   24    H    ILE   4           H        ILE   4  12.717  17.968  -4.647
   25    HA   ILE   4           HA       ILE   4  11.408  17.270  -2.110
   26    HB   ILE   4           HB       ILE   4  10.400  17.094  -4.969
   27   HG12  ILE   4          HG13      ILE   4   9.689  19.167  -2.886
   28   HG13  ILE   4          HG12      ILE   4  11.053  19.392  -3.980
   29   HG21  ILE   4          HG21      ILE   4   8.252  17.414  -3.236
   30   HG22  ILE   4          HG22      ILE   4   9.298  16.282  -2.380
   31   HG23  ILE   4          HG23      ILE   4   8.735  15.903  -4.007
   32   HD11  ILE   4          HD11      ILE   4   8.476  18.558  -5.213
   33   HD12  ILE   4          HD12      ILE   4   9.710  19.661  -5.823
   34   HD13  ILE   4          HD13      ILE   4   8.565  20.209  -4.600
   35    H    LEU   5           H        LEU   5  13.694  15.634  -3.088
   36    HA   LEU   5           HA       LEU   5  12.410  13.078  -3.842
   37    HB2  LEU   5           HB3      LEU   5  15.323  13.802  -3.399
   38    HB3  LEU   5           HB2      LEU   5  14.744  12.239  -3.973
   39    HG   LEU   5           HG       LEU   5  13.825  14.681  -5.426
   40   HD11  LEU   5          HD11      LEU   5  16.617  13.529  -5.508
   41   HD12  LEU   5          HD12      LEU   5  16.142  15.217  -5.328
   42   HD13  LEU   5          HD13      LEU   5  15.929  14.401  -6.877
   43   HD21  LEU   5          HD21      LEU   5  14.692  11.905  -6.297
   44   HD22  LEU   5          HD22      LEU   5  13.945  13.124  -7.329
   45   HD23  LEU   5          HD23      LEU   5  13.025  12.406  -6.007
   46    H    LEU   6           H        LEU   6  11.846  11.596  -2.327
   47    HA   LEU   6           HA       LEU   6  12.710  12.040   0.473
   48    HB2  LEU   6           HB3      LEU   6  10.793   9.915  -0.487
   49    HB3  LEU   6           HB2      LEU   6  10.891  10.663   1.108
   50    HG   LEU   6           HG       LEU   6  10.482  12.844  -0.511
   51   HD11  LEU   6          HD11      LEU   6   8.607  10.712  -1.541
   52   HD12  LEU   6          HD12      LEU   6  10.103  11.111  -2.383
   53   HD13  LEU   6          HD13      LEU   6   8.859  12.341  -2.167
   54   HD21  LEU   6          HD21      LEU   6   8.105  12.678   0.313
   55   HD22  LEU   6          HD22      LEU   6   9.314  12.452   1.576
   56   HD23  LEU   6          HD23      LEU   6   8.477  11.056   0.897
   57    H    SER   7           H        SER   7  13.516  10.193   1.736
   58    HA   SER   7           HA       SER   7  14.777   8.040   0.088
   59    HB2  SER   7           HB3      SER   7  16.081   9.845   2.127
   60    HB3  SER   7           HB2      SER   7  16.755   8.269   1.724
   61    HG   SER   7           HG       SER   7  16.090   9.596  -0.514
   62    H    ALA   8           H        ALA   8  12.546   7.293   1.215
   63    HA   ALA   8           HA       ALA   8  13.057   6.362   3.986
   64    HB1  ALA   8           HB1      ALA   8  10.830   7.371   3.257
   65    HB2  ALA   8           HB2      ALA   8  10.728   5.810   4.070
   66    HB3  ALA   8           HB3      ALA   8  10.575   5.902   2.316
   67    H    SER   9           H        SER   9  14.670   4.761   3.512
   68    HA   SER   9           HA       SER   9  13.860   2.518   1.744
   69    HB2  SER   9           HB3      SER   9  16.469   3.058   3.190
   70    HB3  SER   9           HB2      SER   9  16.181   1.733   2.067
   71    HG   SER   9           HG       SER   9  15.613   3.417   0.519
   72    H    ASP  10           H        ASP  10  13.608   3.377   4.981
   73    HA   ASP  10           HA       ASP  10  14.009   0.671   6.065
   74    HB2  ASP  10           HB3      ASP  10  13.973   3.284   7.139
   75    HB3  ASP  10           HB2      ASP  10  12.591   2.448   7.849
   76    H    LEU  11           H        LEU  11  11.351   2.732   5.034
   77    HA   LEU  11           HA       LEU  11   9.311   0.941   6.143
   78    HB2  LEU  11           HB3      LEU  11   9.334   3.484   4.577
   79    HB3  LEU  11           HB2      LEU  11   7.891   2.475   4.476
   80    HG   LEU  11           HG       LEU  11   9.081   3.046   7.169
   81   HD11  LEU  11          HD11      LEU  11   7.230   4.977   7.063
   82   HD12  LEU  11          HD12      LEU  11   7.695   4.976   5.362
   83   HD13  LEU  11          HD13      LEU  11   8.907   5.276   6.608
   84   HD21  LEU  11          HD21      LEU  11   6.979   2.435   7.940
   85   HD22  LEU  11          HD22      LEU  11   7.049   1.480   6.459
   86   HD23  LEU  11          HD23      LEU  11   6.166   3.006   6.483
   87    H    ALA  12           H        ALA  12  11.406   0.232   3.914
   88    HA   ALA  12           HA       ALA  12   9.533  -0.653   1.789
   89    HB1  ALA  12           HB1      ALA  12  12.125   0.288   1.686
   90    HB2  ALA  12           HB2      ALA  12  11.326  -0.617   0.399
   91    HB3  ALA  12           HB3      ALA  12  12.350  -1.457   1.562
   92    H    GLY  13           H        GLY  13  10.105  -2.996   0.962
   93    HA2  GLY  13           HA3      GLY  13  11.167  -5.120   2.150
   94    HA3  GLY  13           HA2      GLY  13   9.914  -4.771   3.336
   95    H    GLN  14           H        GLN  14   8.911  -6.816   2.847
   96    HA   GLN  14           HA       GLN  14   7.427  -6.830   0.248
   97    HB2  GLN  14           HB3      GLN  14   9.027  -8.891   1.570
   98    HB3  GLN  14           HB2      GLN  14   7.376  -9.432   1.263
   99    HG2  GLN  14           HG3      GLN  14   7.563  -8.974  -1.081
  100    HG3  GLN  14           HG2      GLN  14   9.072  -8.089  -0.854
  101   HE21  GLN  14          HE22      GLN  14  10.389  -9.495  -2.160
  102   HE22  GLN  14          HE21      GLN  14  10.716 -11.103  -1.720
  103    H    TRP  15           H        TRP  15   5.186  -7.376   0.442
  104    HA   TRP  15           HA       TRP  15   4.141  -7.824   3.172
  105    HB2  TRP  15           HB3      TRP  15   3.251  -5.511   1.425
  106    HB3  TRP  15           HB2      TRP  15   2.499  -5.988   2.938
  107    HD1  TRP  15           HD1      TRP  15   5.996  -4.816   1.677
  108    HE1  TRP  15           HE1      TRP  15   7.096  -3.469   3.571
  109    HE3  TRP  15           HE3      TRP  15   2.442  -5.323   5.324
  110    HZ2  TRP  15           HZ2      TRP  15   6.555  -2.697   6.266
  111    HZ3  TRP  15           HZ3      TRP  15   2.767  -4.261   7.543
  112    HH2  TRP  15           HH2      TRP  15   4.815  -2.951   8.017
  113    H    THR  16           H        THR  16   1.620  -8.000   2.955
  114    HA   THR  16           HA       THR  16   0.819  -9.158   0.329
  115    HB   THR  16           HB       THR  16  -0.233 -11.013   2.023
  116    HG1  THR  16           HG1      THR  16   1.007 -11.314   3.698
  117   HG21  THR  16          HG21      THR  16   1.678 -12.477   1.274
  118   HG22  THR  16          HG22      THR  16   2.435 -11.034   0.603
  119   HG23  THR  16          HG23      THR  16   0.883 -11.590  -0.025
  120    H    LEU  17           H        LEU  17  -1.588  -9.582   0.337
  121    HA   LEU  17           HA       LEU  17  -2.993  -7.717   2.224
  122    HB2  LEU  17           HB3      LEU  17  -2.942  -7.671  -0.582
  123    HB3  LEU  17           HB2      LEU  17  -4.501  -8.388  -0.170
  124    HG   LEU  17           HG       LEU  17  -4.827  -6.479   1.474
  125   HD11  LEU  17          HD11      LEU  17  -3.193  -4.959   1.792
  126   HD12  LEU  17          HD12      LEU  17  -3.012  -4.706   0.056
  127   HD13  LEU  17          HD13      LEU  17  -2.134  -6.011   0.853
  128   HD21  LEU  17          HD21      LEU  17  -5.078  -4.765  -0.527
  129   HD22  LEU  17          HD22      LEU  17  -6.096  -6.202  -0.456
  130   HD23  LEU  17          HD23      LEU  17  -4.681  -6.177  -1.504
  131    H    GLN  18           H        GLN  18  -5.060  -8.440   3.010
  132    HA   GLN  18           HA       GLN  18  -5.798 -11.239   2.417
  133    HB2  GLN  18           HB3      GLN  18  -4.839 -10.232   5.090
  134    HB3  GLN  18           HB2      GLN  18  -5.926 -11.612   4.975
  135    HG2  GLN  18           HG3      GLN  18  -4.301 -12.719   3.436
  136    HG3  GLN  18           HG2      GLN  18  -3.197 -11.365   3.684
  137   HE21  GLN  18          HE22      GLN  18  -2.775 -10.901   6.163
  138   HE22  GLN  18          HE21      GLN  18  -2.551 -12.270   7.141
  139    H    GLN  19           H        GLN  19  -7.959 -11.310   2.205
  140    HA   GLN  19           HA       GLN  19  -9.597  -9.154   3.456
  141    HB2  GLN  19           HB3      GLN  19 -10.932 -11.105   1.687
  142    HB3  GLN  19           HB2      GLN  19 -10.998  -9.342   1.669
  143    HG2  GLN  19           HG3      GLN  19  -8.793 -11.090   0.545
  144    HG3  GLN  19           HG2      GLN  19  -9.909 -10.073  -0.362
  145   HE21  GLN  19          HE22      GLN  19  -7.111  -9.657  -0.622
  146   HE22  GLN  19          HE21      GLN  19  -6.703  -8.178   0.104
  147    H    ASP  20           H        ASP  20 -10.584  -9.699   5.362
  148    HA   ASP  20           HA       ASP  20 -11.315 -11.059   7.139
  149    HB2  ASP  20           HB3      ASP  20 -12.706 -12.082   4.674
  150    HB3  ASP  20           HB2      ASP  20 -13.005 -12.829   6.245
  151    H    GLU  21           H        GLU  21 -11.791 -13.967   5.424
  152    HA   GLU  21           HA       GLU  21  -9.651 -15.265   6.919
  153    HB2  GLU  21           HB3      GLU  21 -11.923 -16.114   5.279
  154    HB3  GLU  21           HB2      GLU  21 -10.474 -17.063   4.938
  155    HG2  GLU  21           HG3      GLU  21 -11.459 -16.521   7.747
  156    HG3  GLU  21           HG2      GLU  21 -11.926 -17.949   6.823
  157    H    ALA  22           H        ALA  22 -10.210 -14.214   3.607
  158    HA   ALA  22           HA       ALA  22  -8.584 -13.498   2.042
  159    HB1  ALA  22           HB1      ALA  22  -6.985 -13.533   4.146
  160    HB2  ALA  22           HB2      ALA  22  -6.321 -13.496   2.514
  161    HB3  ALA  22           HB3      ALA  22  -6.384 -15.014   3.402
  162    HA   PRO  23           HA       PRO  23  -9.289 -17.918   0.618
  163    HB2  PRO  23           HB2      PRO  23 -10.661 -16.472  -1.573
  164    HB3  PRO  23           HB3      PRO  23 -11.223 -17.851  -0.613
  165    HG2  PRO  23           HG3      PRO  23 -12.230 -15.383  -0.309
  166    HG3  PRO  23           HG2      PRO  23 -12.084 -16.527   1.036
  167    HD2  PRO  23           HD3      PRO  23 -10.404 -14.131   0.409
  168    HD3  PRO  23           HD2      PRO  23 -10.863 -14.813   1.985
  169    H    ALA  24           H        ALA  24  -7.688 -15.129  -0.289
  170    HA   ALA  24           HA       ALA  24  -5.984 -16.590  -2.192
  171    HB1  ALA  24           HB1      ALA  24  -6.196 -14.661  -3.856
  172    HB2  ALA  24           HB2      ALA  24  -7.641 -14.179  -2.968
  173    HB3  ALA  24           HB3      ALA  24  -7.580 -15.751  -3.768
  174    H    ILE  25           H        ILE  25  -3.882 -15.784  -2.113
  175    HA   ILE  25           HA       ILE  25  -3.440 -13.445  -0.300
  176    HB   ILE  25           HB       ILE  25  -1.817 -15.892  -0.964
  177   HG12  ILE  25          HG13      ILE  25  -2.078 -14.625   1.737
  178   HG13  ILE  25          HG12      ILE  25  -3.489 -15.444   1.065
  179   HG21  ILE  25          HG21      ILE  25  -0.136 -14.281  -1.247
  180   HG22  ILE  25          HG22      ILE  25  -0.020 -14.651   0.474
  181   HG23  ILE  25          HG23      ILE  25  -0.848 -13.188  -0.060
  182   HD11  ILE  25          HD11      ILE  25  -1.952 -16.906   2.472
  183   HD12  ILE  25          HD12      ILE  25  -0.754 -16.731   1.190
  184   HD13  ILE  25          HD13      ILE  25  -2.299 -17.513   0.853
  185    H    CYS  26           H        CYS  26  -2.943 -11.588  -1.350
  186    HA   CYS  26           HA       CYS  26  -1.783 -11.747  -4.082
  187    HB2  CYS  26           HB3      CYS  26  -2.969  -9.438  -2.512
  188    HB3  CYS  26           HB2      CYS  26  -2.283  -9.285  -4.129
  189    H    HIS  27           H        HIS  27   0.395 -11.835  -4.075
  190    HA   HIS  27           HA       HIS  27   2.053 -10.881  -1.919
  191    HB2  HIS  27           HB3      HIS  27   2.417 -12.281  -4.442
  192    HB3  HIS  27           HB2      HIS  27   3.669 -11.063  -4.201
  193    HD1  HIS  27           HD1      HIS  27   5.641 -12.263  -3.237
  194    HD2  HIS  27           HD2      HIS  27   2.068 -13.514  -1.485
  195    HE1  HIS  27           HE1      HIS  27   6.274 -13.879  -1.391
  196    HE2  HIS  27           HE2      HIS  27   4.107 -14.646  -0.319
  197    H    LEU  28           H        LEU  28   2.826  -8.862  -1.591
  198    HA   LEU  28           HA       LEU  28   2.632  -6.887  -3.831
  199    HB2  LEU  28           HB3      LEU  28   1.582  -6.845  -1.105
  200    HB3  LEU  28           HB2      LEU  28   2.598  -5.449  -1.438
  201    HG   LEU  28           HG       LEU  28   0.205  -5.051  -2.010
  202   HD11  LEU  28          HD11      LEU  28   2.493  -4.527  -3.588
  203   HD12  LEU  28          HD12      LEU  28   0.970  -3.639  -3.579
  204   HD13  LEU  28          HD13      LEU  28   1.208  -4.968  -4.711
  205   HD21  LEU  28          HD21      LEU  28   0.376  -6.740  -4.433
  206   HD22  LEU  28          HD22      LEU  28  -0.993  -6.440  -3.362
  207   HD23  LEU  28          HD23      LEU  28   0.232  -7.627  -2.915
  208    H    GLU  29           H        GLU  29   4.282  -5.136  -3.690
  209    HA   GLU  29           HA       GLU  29   6.658  -5.820  -2.033
  210    HB2  GLU  29           HB3      GLU  29   6.430  -6.207  -4.890
  211    HB3  GLU  29           HB2      GLU  29   7.663  -4.997  -4.537
  212    HG2  GLU  29           HG3      GLU  29   8.775  -6.523  -2.991
  213    HG3  GLU  29           HG2      GLU  29   7.505  -7.725  -3.224
  214    H    LEU  30           H        LEU  30   7.003  -4.007  -0.900
  215    HA   LEU  30           HA       LEU  30   6.247  -1.383  -2.007
  216    HB2  LEU  30           HB3      LEU  30   6.977  -2.489   0.655
  217    HB3  LEU  30           HB2      LEU  30   7.423  -0.809   0.361
  218    HG   LEU  30           HG       LEU  30   5.122  -0.255  -0.220
  219   HD11  LEU  30          HD11      LEU  30   4.074  -2.014  -1.242
  220   HD12  LEU  30          HD12      LEU  30   3.487  -2.304   0.396
  221   HD13  LEU  30          HD13      LEU  30   4.867  -3.213  -0.220
  222   HD21  LEU  30          HD21      LEU  30   4.305  -0.234   1.947
  223   HD22  LEU  30          HD22      LEU  30   5.986  -0.658   2.272
  224   HD23  LEU  30          HD23      LEU  30   4.749  -1.915   2.238
  225    H    ARG  31           H        ARG  31   7.739  -0.754  -3.555
  226    HA   ARG  31           HA       ARG  31  10.569  -1.333  -3.309
  227    HB2  ARG  31           HB3      ARG  31   8.796   0.008  -5.227
  228    HB3  ARG  31           HB2      ARG  31  10.392   0.753  -5.111
  229    HG2  ARG  31           HG3      ARG  31  11.499  -1.278  -5.671
  230    HG3  ARG  31           HG2      ARG  31  10.043  -2.236  -5.400
  231    HD2  ARG  31           HD3      ARG  31   9.282  -1.856  -7.495
  232    HD3  ARG  31           HD2      ARG  31   9.645  -0.134  -7.399
  233    HE   ARG  31           HE       ARG  31  11.295  -2.115  -8.680
  234   HH11  ARG  31          HH22      ARG  31  11.332   0.711  -6.704
  235   HH12  ARG  31          HH21      ARG  31  12.897   1.225  -7.238
  236   HH21  ARG  31          HH11      ARG  31  13.338  -1.461  -9.386
  237   HH22  ARG  31          HH12      ARG  31  14.034  -0.006  -8.757
  238    H    ASP  32           H        ASP  32  12.250   0.405  -3.176
  239    HA   ASP  32           HA       ASP  32  11.451   2.428  -1.135
  240    HB2  ASP  32           HB3      ASP  32  13.880   2.529  -0.630
  241    HB3  ASP  32           HB2      ASP  32  13.242   0.892  -0.462
  242    H    SER  33           H        SER  33  11.461   2.446  -4.300
  243    HA   SER  33           HA       SER  33  13.264   4.705  -4.834
  244    HB2  SER  33           HB3      SER  33  11.776   2.796  -6.405
  245    HB3  SER  33           HB2      SER  33  11.401   4.425  -6.948
  246    HG   SER  33           HG       SER  33  13.666   4.792  -7.082
  247    H    GLU  34           H        GLU  34  12.146   6.637  -6.052
  248    HA   GLU  34           HA       GLU  34   9.800   7.500  -4.401
  249    HB2  GLU  34           HB3      GLU  34  10.641   9.832  -5.138
  250    HB3  GLU  34           HB2      GLU  34  11.592   8.969  -3.926
  251    HG2  GLU  34           HG3      GLU  34  12.335   8.334  -6.708
  252    HG3  GLU  34           HG2      GLU  34  12.616  10.016  -6.254
  253    H    VAL  35           H        VAL  35   8.120   8.690  -5.490
  254    HA   VAL  35           HA       VAL  35   8.155   8.473  -8.483
  255    HB   VAL  35           HB       VAL  35   5.787   7.923  -6.667
  256   HG11  VAL  35          HG11      VAL  35   4.943   8.842  -8.689
  257   HG12  VAL  35          HG12      VAL  35   4.847   7.097  -8.928
  258   HG13  VAL  35          HG13      VAL  35   6.158   8.017  -9.667
  259   HG21  VAL  35          HG21      VAL  35   6.048   5.607  -7.768
  260   HG22  VAL  35          HG22      VAL  35   7.222   6.033  -6.522
  261   HG23  VAL  35          HG23      VAL  35   7.666   6.140  -8.226
  262    H    ALA  36           H        ALA  36   8.769  10.746  -8.451
  263    HA   ALA  36           HA       ALA  36   7.426  12.822  -7.119
  264    HB1  ALA  36           HB1      ALA  36   9.316  12.605  -9.225
  265    HB2  ALA  36           HB2      ALA  36   8.883  14.052  -8.314
  266    HB3  ALA  36           HB3      ALA  36   8.027  13.661  -9.805
  267    H    GLU  37           H        GLU  37   6.561  11.186 -10.155
  268    HA   GLU  37           HA       GLU  37   4.477  12.800 -11.057
  269    HB2  GLU  37           HB3      GLU  37   5.355  10.558 -12.012
  270    HB3  GLU  37           HB2      GLU  37   4.170   9.801 -10.946
  271    HG2  GLU  37           HG3      GLU  37   3.057  10.096 -13.038
  272    HG3  GLU  37           HG2      GLU  37   2.442  11.373 -11.987
  273    H    ALA  38           H        ALA  38   4.537  10.668  -8.272
  274    HA   ALA  38           HA       ALA  38   1.800  11.638  -7.539
  275    HB1  ALA  38           HB1      ALA  38   2.244   9.179  -6.228
  276    HB2  ALA  38           HB2      ALA  38   2.728   8.924  -7.904
  277    HB3  ALA  38           HB3      ALA  38   1.101   9.495  -7.532
  278    H    SER  39           H        SER  39   4.929  11.950  -6.838
  279    HA   SER  39           HA       SER  39   6.134  12.500  -4.909
  280    HB2  SER  39           HB3      SER  39   3.333  13.397  -4.247
  281    HB3  SER  39           HB2      SER  39   4.658  13.623  -3.111
  282    HG   SER  39           HG       SER  39   5.468  15.123  -4.359
  283    H    GLY  40           H        GLY  40   5.768   9.830  -5.010
  284    HA2  GLY  40           HA3      GLY  40   5.511   9.129  -2.158
  285    HA3  GLY  40           HA2      GLY  40   4.380   8.319  -3.241
  286    H    TYR  41           H        TYR  41   5.392   6.269  -2.746
  287    HA   TYR  41           HA       TYR  41   8.101   5.912  -3.951
  288    HB2  TYR  41           HB3      TYR  41   6.691   4.365  -1.760
  289    HB3  TYR  41           HB2      TYR  41   8.249   3.915  -2.454
  290    HD1  TYR  41           HD1      TYR  41   6.494   6.835  -0.876
  291    HD2  TYR  41           HD2      TYR  41  10.208   4.795  -1.545
  292    HE1  TYR  41           HE1      TYR  41   7.640   8.441   0.610
  293    HE2  TYR  41           HE2      TYR  41  11.360   6.393  -0.039
  294    HH   TYR  41           HH       TYR  41  11.097   8.080   1.394
  295    H    ASP  42           H        ASP  42   8.405   4.091  -5.315
  296    HA   ASP  42           HA       ASP  42   6.201   3.405  -6.973
  297    HB2  ASP  42           HB3      ASP  42   8.447   3.252  -7.836
  298    HB3  ASP  42           HB2      ASP  42   8.889   2.066  -6.609
  299    H    LEU  43           H        LEU  43   5.243   1.348  -7.301
  300    HA   LEU  43           HA       LEU  43   5.156  -0.428  -4.890
  301    HB2  LEU  43           HB3      LEU  43   3.129   1.017  -4.946
  302    HB3  LEU  43           HB2      LEU  43   2.769   0.416  -6.562
  303    HG   LEU  43           HG       LEU  43   2.578  -1.882  -5.673
  304   HD11  LEU  43          HD11      LEU  43   3.509  -0.504  -3.190
  305   HD12  LEU  43          HD12      LEU  43   3.922  -2.103  -3.809
  306   HD13  LEU  43          HD13      LEU  43   2.368  -1.837  -3.020
  307   HD21  LEU  43          HD21      LEU  43   0.948   0.302  -4.379
  308   HD22  LEU  43          HD22      LEU  43   0.571  -1.406  -4.146
  309   HD23  LEU  43          HD23      LEU  43   0.531  -0.707  -5.763
  310    H    GLY  44           H        GLY  44   6.552  -1.937  -6.029
  311    HA2  GLY  44           HA3      GLY  44   5.671  -3.002  -8.611
  312    HA3  GLY  44           HA2      GLY  44   7.047  -3.573  -7.667
  313    H    GLY  45           H        GLY  45   5.915  -5.718  -8.435
  314    HA2  GLY  45           HA3      GLY  45   5.087  -7.672  -7.326
  315    HA3  GLY  45           HA2      GLY  45   4.265  -6.643  -6.162
  316    H    ASP  46           H        ASP  46   2.530  -8.343  -6.860
  317    HA   ASP  46           HA       ASP  46   1.224  -7.767  -9.407
  318    HB2  ASP  46           HB3      ASP  46   1.231  -9.931  -7.596
  319    HB3  ASP  46           HB2      ASP  46  -0.401  -9.268  -7.528
  320    H    THR  47           H        THR  47   0.467  -5.710  -9.356
  321    HA   THR  47           HA       THR  47  -1.132  -4.807  -7.017
  322    HB   THR  47           HB       THR  47  -1.037  -2.595  -8.028
  323    HG1  THR  47           HG1      THR  47  -0.759  -4.016 -10.240
  324   HG21  THR  47          HG21      THR  47   1.666  -3.921  -8.358
  325   HG22  THR  47          HG22      THR  47   0.984  -3.425  -6.809
  326   HG23  THR  47          HG23      THR  47   1.360  -2.215  -8.034
  327    H    ALA  48           H        ALA  48  -1.383  -6.312  -9.961
  328    HA   ALA  48           HA       ALA  48  -3.835  -5.267 -11.006
  329    HB1  ALA  48           HB1      ALA  48  -4.036  -7.459 -12.161
  330    HB2  ALA  48           HB2      ALA  48  -2.730  -8.092 -11.160
  331    HB3  ALA  48           HB3      ALA  48  -2.411  -6.789 -12.306
  332    H    CYS  49           H        CYS  49  -3.250  -8.001  -8.760
  333    HA   CYS  49           HA       CYS  49  -5.908  -8.830  -8.427
  334    HB2  CYS  49           HB3      CYS  49  -4.704 -10.261  -7.163
  335    HB3  CYS  49           HB2      CYS  49  -3.397  -9.095  -6.967
  336    H    LEU  50           H        LEU  50  -4.470  -5.866  -7.457
  337    HA   LEU  50           HA       LEU  50  -6.420  -5.343  -5.324
  338    HB2  LEU  50           HB3      LEU  50  -4.596  -3.342  -6.666
  339    HB3  LEU  50           HB2      LEU  50  -5.336  -3.224  -5.072
  340    HG   LEU  50           HG       LEU  50  -3.325  -5.332  -5.883
  341   HD11  LEU  50          HD11      LEU  50  -3.022  -2.813  -4.227
  342   HD12  LEU  50          HD12      LEU  50  -2.262  -3.141  -5.785
  343   HD13  LEU  50          HD13      LEU  50  -1.796  -4.074  -4.362
  344   HD21  LEU  50          HD21      LEU  50  -3.256  -5.514  -3.290
  345   HD22  LEU  50          HD22      LEU  50  -4.611  -6.254  -4.141
  346   HD23  LEU  50          HD23      LEU  50  -4.816  -4.694  -3.342
  347    H    THR  51           H        THR  51  -6.400  -5.173  -8.710
  348    HA   THR  51           HA       THR  51  -8.032  -2.850  -9.130
  349    HB   THR  51           HB       THR  51  -8.297  -5.259 -10.893
  350    HG1  THR  51           HG1      THR  51  -6.009  -3.591 -10.763
  351   HG21  THR  51          HG21      THR  51  -8.264  -3.569 -12.635
  352   HG22  THR  51          HG22      THR  51  -7.798  -2.328 -11.472
  353   HG23  THR  51          HG23      THR  51  -9.398  -3.063 -11.383
  354    H    ARG  52           H        ARG  52  -8.780  -5.202  -7.135
  355    HA   ARG  52           HA       ARG  52 -11.668  -5.298  -7.912
  356    HB2  ARG  52           HB3      ARG  52 -11.836  -7.438  -6.776
  357    HB3  ARG  52           HB2      ARG  52 -10.521  -7.525  -7.947
  358    HG2  ARG  52           HG3      ARG  52  -9.077  -6.707  -5.874
  359    HG3  ARG  52           HG2      ARG  52 -10.398  -7.430  -4.962
  360    HD2  ARG  52           HD3      ARG  52  -8.782  -8.839  -7.105
  361    HD3  ARG  52           HD2      ARG  52  -8.602  -9.076  -5.367
  362    HE   ARG  52           HE       ARG  52 -11.303  -9.567  -5.884
  363   HH11  ARG  52          HH22      ARG  52  -8.236 -10.720  -6.956
  364   HH12  ARG  52          HH21      ARG  52  -8.804 -12.324  -7.282
  365   HH21  ARG  52          HH11      ARG  52 -12.062 -11.655  -6.301
  366   HH22  ARG  52          HH12      ARG  52 -10.968 -12.854  -6.910
  367    H    TRP  53           H        TRP  53  -9.318  -4.410  -5.535
  368    HA   TRP  53           HA       TRP  53 -11.513  -3.821  -3.570
  369    HB2  TRP  53           HB3      TRP  53  -8.535  -4.058  -3.050
  370    HB3  TRP  53           HB2      TRP  53  -9.795  -3.836  -1.838
  371    HD1  TRP  53           HD1      TRP  53 -11.913  -5.911  -2.633
  372    HE1  TRP  53           HE1      TRP  53 -11.426  -8.441  -2.539
  373    HE3  TRP  53           HE3      TRP  53  -6.805  -5.839  -2.825
  374    HZ2  TRP  53           HZ2      TRP  53  -9.171 -10.201  -2.541
  375    HZ3  TRP  53           HZ3      TRP  53  -5.520  -7.958  -2.760
  376    HH2  TRP  53           HH2      TRP  53  -6.696 -10.136  -2.615
  377    H    LEU  54           H        LEU  54  -9.380  -2.497  -5.794
  378    HA   LEU  54           HA       LEU  54  -9.669   0.224  -4.580
  379    HB2  LEU  54           HB3      LEU  54  -7.360  -1.017  -6.079
  380    HB3  LEU  54           HB2      LEU  54  -7.485   0.717  -5.848
  381    HG   LEU  54           HG       LEU  54  -7.536  -1.294  -3.575
  382   HD11  LEU  54          HD11      LEU  54  -5.260  -1.042  -3.279
  383   HD12  LEU  54          HD12      LEU  54  -5.228   0.544  -4.050
  384   HD13  LEU  54          HD13      LEU  54  -5.338  -0.912  -5.033
  385   HD21  LEU  54          HD21      LEU  54  -7.984   1.588  -3.775
  386   HD22  LEU  54          HD22      LEU  54  -6.673   1.195  -2.666
  387   HD23  LEU  54          HD23      LEU  54  -8.276   0.502  -2.418
  388    HA   PRO  55           HA       PRO  55 -11.583   1.169  -8.478
  389    HB2  PRO  55           HB2      PRO  55 -11.073   3.845  -8.759
  390    HB3  PRO  55           HB3      PRO  55 -12.268   3.189  -7.627
  391    HG2  PRO  55           HG3      PRO  55  -9.578   4.275  -7.110
  392    HG3  PRO  55           HG2      PRO  55 -11.013   4.261  -6.076
  393    HD2  PRO  55           HD3      PRO  55  -8.817   2.547  -5.837
  394    HD3  PRO  55           HD2      PRO  55 -10.399   2.307  -5.086
  395    H    SER  56           H        SER  56  -8.195   1.674  -8.086
  396    HA   SER  56           HA       SER  56  -7.781   1.239 -10.969
  397    HB2  SER  56           HB3      SER  56  -7.538   3.851  -9.763
  398    HB3  SER  56           HB2      SER  56  -5.956   3.303 -10.310
  399    HG   SER  56           HG       SER  56  -7.831   4.313 -11.781
  400    H    GLU  57           H        GLU  57  -5.519   0.618 -11.407
  401    HA   GLU  57           HA       GLU  57  -4.425  -0.975  -9.273
  402    HB2  GLU  57           HB3      GLU  57  -4.026  -1.870 -11.393
  403    HB3  GLU  57           HB2      GLU  57  -3.569  -0.310 -12.071
  404    HG2  GLU  57           HG3      GLU  57  -1.897  -1.454  -9.866
  405    HG3  GLU  57           HG2      GLU  57  -1.725  -2.119 -11.488
  406    HA   PRO  58           HA       PRO  58  -2.155   2.596  -7.608
  407    HB2  PRO  58           HB2      PRO  58  -0.829   1.185  -5.616
  408    HB3  PRO  58           HB3      PRO  58  -2.395   1.976  -5.456
  409    HG2  PRO  58           HG3      PRO  58  -1.762  -0.855  -5.677
  410    HG3  PRO  58           HG2      PRO  58  -3.206  -0.058  -5.065
  411    HD2  PRO  58           HD3      PRO  58  -2.965  -1.379  -7.533
  412    HD3  PRO  58           HD2      PRO  58  -4.297  -0.317  -7.039
  413    H    ARG  59           H        ARG  59  -0.469   3.237  -8.803
  414    HA   ARG  59           HA       ARG  59   1.769   1.399  -9.370
  415    HB2  ARG  59           HB3      ARG  59   0.547   3.380 -10.866
  416    HB3  ARG  59           HB2      ARG  59   2.010   4.179 -10.292
  417    HG2  ARG  59           HG3      ARG  59   3.368   2.282 -11.118
  418    HG3  ARG  59           HG2      ARG  59   1.902   1.502 -11.714
  419    HD2  ARG  59           HD3      ARG  59   1.613   3.045 -13.428
  420    HD3  ARG  59           HD2      ARG  59   2.498   4.312 -12.578
  421    HE   ARG  59           HE       ARG  59   4.488   3.478 -13.533
  422   HH11  ARG  59          HH22      ARG  59   1.909   1.198 -13.674
  423   HH12  ARG  59          HH21      ARG  59   2.787   0.061 -14.641
  424   HH21  ARG  59          HH11      ARG  59   5.656   2.005 -14.791
  425   HH22  ARG  59          HH12      ARG  59   4.910   0.519 -15.274
  426    H    ALA  60           H        ALA  60   0.883   3.684  -7.046
  427    HA   ALA  60           HA       ALA  60   3.608   3.678  -5.950
  428    HB1  ALA  60           HB1      ALA  60   2.317   6.370  -6.333
  429    HB2  ALA  60           HB2      ALA  60   3.306   5.667  -7.613
  430    HB3  ALA  60           HB3      ALA  60   4.012   5.987  -6.029
  431    H    TRP  61           H        TRP  61   3.631   4.779  -3.790
  432    HA   TRP  61           HA       TRP  61   0.987   5.098  -2.474
  433    HB2  TRP  61           HB3      TRP  61   1.607   3.520  -0.662
  434    HB3  TRP  61           HB2      TRP  61   1.471   2.701  -2.216
  435    HD1  TRP  61           HD1      TRP  61   4.020   2.690  -3.584
  436    HE1  TRP  61           HE1      TRP  61   6.273   1.962  -2.571
  437    HE3  TRP  61           HE3      TRP  61   2.936   3.157   1.379
  438    HZ2  TRP  61           HZ2      TRP  61   7.456   1.613   0.009
  439    HZ3  TRP  61           HZ3      TRP  61   4.638   2.607   3.094
  440    HH2  TRP  61           HH2      TRP  61   6.897   1.838   2.417
  441    H    ARG  62           H        ARG  62   1.260   6.163  -0.327
  442    HA   ARG  62           HA       ARG  62   3.974   7.330   0.109
  443    HB2  ARG  62           HB3      ARG  62   2.460   8.868  -1.224
  444    HB3  ARG  62           HB2      ARG  62   1.448   8.975   0.217
  445    HG2  ARG  62           HG3      ARG  62   3.648   9.589   1.453
  446    HG3  ARG  62           HG2      ARG  62   4.290   9.908  -0.159
  447    HD2  ARG  62           HD3      ARG  62   2.458  11.493  -0.589
  448    HD3  ARG  62           HD2      ARG  62   1.788  11.163   1.009
  449    HE   ARG  62           HE       ARG  62   4.072  12.878   0.436
  450   HH11  ARG  62          HH22      ARG  62   2.548  10.762   2.692
  451   HH12  ARG  62          HH21      ARG  62   3.261  11.514   4.080
  452   HH21  ARG  62          HH11      ARG  62   5.010  13.871   2.236
  453   HH22  ARG  62          HH12      ARG  62   4.653  13.274   3.823
  454    HA   PRO  63           HA       PRO  63   2.560   5.835   4.218
  455    HB2  PRO  63           HB2      PRO  63   5.094   6.944   5.194
  456    HB3  PRO  63           HB3      PRO  63   4.503   5.277   5.258
  457    HG2  PRO  63           HG3      PRO  63   6.515   6.178   3.632
  458    HG3  PRO  63           HG2      PRO  63   5.569   4.713   3.364
  459    HD2  PRO  63           HD3      PRO  63   5.481   7.268   1.906
  460    HD3  PRO  63           HD2      PRO  63   4.894   5.666   1.415
  461    H    THR  64           H        THR  64   1.179   7.133   5.401
  462    HA   THR  64           HA       THR  64   1.807  10.033   5.605
  463    HB   THR  64           HB       THR  64  -0.674   9.747   6.706
  464    HG1  THR  64           HG1      THR  64  -0.679   7.520   6.269
  465   HG21  THR  64          HG21      THR  64  -0.365  11.334   4.995
  466   HG22  THR  64          HG22      THR  64  -1.472  10.171   4.270
  467   HG23  THR  64          HG23      THR  64   0.243  10.128   3.863
  468    HA   PRO  65           HA       PRO  65   2.906   9.696   9.872
  469    HB2  PRO  65           HB2      PRO  65   1.693  11.927  10.956
  470    HB3  PRO  65           HB3      PRO  65   3.200  11.964  10.022
  471    HG2  PRO  65           HG3      PRO  65   0.429  12.619   9.177
  472    HG3  PRO  65           HG2      PRO  65   1.963  13.379   8.719
  473    HD2  PRO  65           HD3      PRO  65   0.633  11.641   7.085
  474    HD3  PRO  65           HD2      PRO  65   2.401  11.816   7.067
  475    H    ALA  66           H        ALA  66   0.236   8.477   8.981
  476    HA   ALA  66           HA       ALA  66  -0.680   7.746  11.625
  477    HB1  ALA  66           HB1      ALA  66  -1.899   9.739  11.768
  478    HB2  ALA  66           HB2      ALA  66  -3.085   8.634  11.073
  479    HB3  ALA  66           HB3      ALA  66  -2.229   9.775  10.036
  480    H    GLY  67           H        GLY  67   0.073   6.692   8.853
  481    HA2  GLY  67           HA3      GLY  67  -1.102   4.288   8.692
  482    HA3  GLY  67           HA2      GLY  67  -2.413   5.289   8.081
  483    H    ILE  68           H        ILE  68  -1.572   3.511   6.290
  484    HA   ILE  68           HA       ILE  68   0.498   4.816   4.591
  485    HB   ILE  68           HB       ILE  68  -0.742   2.055   4.557
  486   HG12  ILE  68          HG13      ILE  68   2.153   2.885   4.871
  487   HG13  ILE  68          HG12      ILE  68   1.073   2.666   6.248
  488   HG21  ILE  68          HG21      ILE  68   1.287   1.898   2.781
  489   HG22  ILE  68          HG22      ILE  68   0.785   3.566   2.505
  490   HG23  ILE  68          HG23      ILE  68  -0.373   2.253   2.304
  491   HD11  ILE  68          HD11      ILE  68   2.439   0.622   5.678
  492   HD12  ILE  68          HD12      ILE  68   1.561   0.535   4.150
  493   HD13  ILE  68          HD13      ILE  68   0.697   0.350   5.677
  494    H    ALA  69           H        ALA  69   0.011   5.452   2.462
  495    HA   ALA  69           HA       ALA  69  -2.888   5.375   1.703
  496    HB1  ALA  69           HB1      ALA  69  -0.844   7.578   1.307
  497    HB2  ALA  69           HB2      ALA  69  -2.305   7.652   2.291
  498    HB3  ALA  69           HB3      ALA  69  -2.427   7.559   0.535
  499    H    LEU  70           H        LEU  70  -3.323   4.835  -0.442
  500    HA   LEU  70           HA       LEU  70  -0.969   3.904  -2.040
  501    HB2  LEU  70           HB3      LEU  70  -3.870   3.100  -2.009
  502    HB3  LEU  70           HB2      LEU  70  -2.760   2.579  -3.264
  503    HG   LEU  70           HG       LEU  70  -1.754   2.205  -0.520
  504   HD11  LEU  70          HD11      LEU  70  -4.012   1.614   0.001
  505   HD12  LEU  70          HD12      LEU  70  -3.171   0.091  -0.290
  506   HD13  LEU  70          HD13      LEU  70  -4.218   0.772  -1.534
  507   HD21  LEU  70          HD21      LEU  70  -0.904   0.176  -1.461
  508   HD22  LEU  70          HD22      LEU  70  -0.758   1.388  -2.734
  509   HD23  LEU  70          HD23      LEU  70  -2.075   0.215  -2.779
  510    H    LEU  71           H        LEU  71  -0.534   4.945  -3.950
  511    HA   LEU  71           HA       LEU  71  -2.642   6.777  -5.056
  512    HB2  LEU  71           HB3      LEU  71   0.369   7.171  -4.981
  513    HB3  LEU  71           HB2      LEU  71  -0.782   8.268  -5.735
  514    HG   LEU  71           HG       LEU  71  -1.267   7.541  -2.881
  515   HD11  LEU  71          HD11      LEU  71   0.903   9.465  -3.774
  516   HD12  LEU  71          HD12      LEU  71   1.166   7.939  -2.931
  517   HD13  LEU  71          HD13      LEU  71   0.333   9.264  -2.117
  518   HD21  LEU  71          HD21      LEU  71  -1.246  10.322  -3.986
  519   HD22  LEU  71          HD22      LEU  71  -2.360   9.584  -2.838
  520   HD23  LEU  71          HD23      LEU  71  -2.503   9.229  -4.560
  521    H    GLU  72           H        GLU  72  -2.778   6.813  -7.347
  522    HA   GLU  72           HA       GLU  72  -1.574   4.523  -8.697
  523    HB2  GLU  72           HB3      GLU  72  -2.749   5.539 -10.760
  524    HB3  GLU  72           HB2      GLU  72  -3.758   4.897  -9.472
  525    HG2  GLU  72           HG3      GLU  72  -4.781   6.889  -9.323
  526    HG3  GLU  72           HG2      GLU  72  -3.268   7.622  -8.812
  527    H    ARG  73           H        ARG  73  -1.597   7.929  -9.542
  528    HA   ARG  73           HA       ARG  73   1.241   8.210  -9.580
  529    HB2  ARG  73           HB3      ARG  73   1.499   8.428 -12.091
  530    HB3  ARG  73           HB2      ARG  73   1.287   6.792 -11.487
  531    HG2  ARG  73           HG3      ARG  73  -1.070   6.819 -12.086
  532    HG3  ARG  73           HG2      ARG  73  -0.953   8.512 -12.570
  533    HD2  ARG  73           HD3      ARG  73   0.136   8.023 -14.527
  534    HD3  ARG  73           HD2      ARG  73   0.987   6.646 -13.826
  535    HE   ARG  73           HE       ARG  73  -0.742   5.287 -14.655
  536   HH11  ARG  73          HH22      ARG  73  -1.798   8.535 -14.189
  537   HH12  ARG  73          HH21      ARG  73  -3.381   8.253 -14.832
  538   HH21  ARG  73          HH11      ARG  73  -2.805   4.897 -15.494
  539   HH22  ARG  73          HH12      ARG  73  -3.952   6.194 -15.570
  540    H    GLY  74           H        GLY  74  -1.871   9.389 -10.778
  541    HA2  GLY  74           HA3      GLY  74  -0.817  12.012 -11.444
  542    HA3  GLY  74           HA2      GLY  74  -2.523  11.576 -11.380
  543    H    GLY  75           H        GLY  75  -1.610  10.513  -8.503
  544    HA2  GLY  75           HA3      GLY  75  -1.063  11.696  -6.419
  545    HA3  GLY  75           HA2      GLY  75  -1.712  13.168  -7.142
  546    H    LEU  76           H        LEU  76  -3.646  10.572  -8.008
  547    HA   LEU  76           HA       LEU  76  -5.765  11.472  -6.184
  548    HB2  LEU  76           HB3      LEU  76  -5.863   9.209  -8.196
  549    HB3  LEU  76           HB2      LEU  76  -7.231  10.063  -7.484
  550    HG   LEU  76           HG       LEU  76  -5.123  11.314  -9.272
  551   HD11  LEU  76          HD11      LEU  76  -7.873  10.209  -9.744
  552   HD12  LEU  76          HD12      LEU  76  -6.432  10.084 -10.753
  553   HD13  LEU  76          HD13      LEU  76  -7.333  11.599 -10.688
  554   HD21  LEU  76          HD21      LEU  76  -5.878  13.061  -7.900
  555   HD22  LEU  76          HD22      LEU  76  -7.497  12.376  -7.756
  556   HD23  LEU  76          HD23      LEU  76  -6.997  13.149  -9.259
  557    H    THR  77           H        THR  77  -5.372  10.727  -4.112
  558    HA   THR  77           HA       THR  77  -4.220   8.254  -3.366
  559    HB   THR  77           HB       THR  77  -6.444   9.267  -1.687
  560    HG1  THR  77           HG1      THR  77  -5.574  11.192  -1.359
  561   HG21  THR  77          HG21      THR  77  -4.535   7.555  -1.150
  562   HG22  THR  77          HG22      THR  77  -5.000   8.743   0.067
  563   HG23  THR  77          HG23      THR  77  -3.559   9.005  -0.915
  564    H    LEU  78           H        LEU  78  -5.005   6.188  -3.236
  565    HA   LEU  78           HA       LEU  78  -7.740   5.728  -4.310
  566    HB2  LEU  78           HB3      LEU  78  -5.589   3.677  -3.761
  567    HB3  LEU  78           HB2      LEU  78  -7.025   3.472  -4.742
  568    HG   LEU  78           HG       LEU  78  -4.870   5.497  -5.400
  569   HD11  LEU  78          HD11      LEU  78  -4.914   3.352  -7.265
  570   HD12  LEU  78          HD12      LEU  78  -4.789   2.638  -5.659
  571   HD13  LEU  78          HD13      LEU  78  -3.599   3.825  -6.192
  572   HD21  LEU  78          HD21      LEU  78  -7.258   4.359  -6.875
  573   HD22  LEU  78          HD22      LEU  78  -5.969   5.239  -7.690
  574   HD23  LEU  78          HD23      LEU  78  -6.947   6.048  -6.468
  575    H    MET  79           H        MET  79  -5.681   4.819  -1.527
  576    HA   MET  79           HA       MET  79  -8.115   4.591   0.115
  577    HB2  MET  79           HB3      MET  79  -7.797   2.360  -1.022
  578    HB3  MET  79           HB2      MET  79  -6.280   2.198  -0.146
  579    HG2  MET  79           HG3      MET  79  -7.934   1.064   1.167
  580    HG3  MET  79           HG2      MET  79  -7.617   2.591   1.988
  581    HE1  MET  79           HE1      MET  79  -9.728   0.524  -0.278
  582    HE2  MET  79           HE2      MET  79 -11.385   1.040   0.065
  583    HE3  MET  79           HE3      MET  79 -10.406   0.303   1.332
  584    H    LEU  80           H        LEU  80  -7.695   4.896   2.286
  585    HA   LEU  80           HA       LEU  80  -4.859   5.483   3.004
  586    HB2  LEU  80           HB3      LEU  80  -6.353   7.374   3.335
  587    HB3  LEU  80           HB2      LEU  80  -7.489   6.371   4.233
  588    HG   LEU  80           HG       LEU  80  -5.892   6.076   6.041
  589   HD11  LEU  80          HD11      LEU  80  -3.717   7.514   5.818
  590   HD12  LEU  80          HD12      LEU  80  -4.020   7.392   4.084
  591   HD13  LEU  80          HD13      LEU  80  -3.772   5.932   5.042
  592   HD21  LEU  80          HD21      LEU  80  -5.913   8.274   6.905
  593   HD22  LEU  80          HD22      LEU  80  -7.250   8.261   5.756
  594   HD23  LEU  80          HD23      LEU  80  -5.711   8.996   5.309
  595    H    LEU  81           H        LEU  81  -4.068   3.517   3.702
  596    HA   LEU  81           HA       LEU  81  -5.663   1.728   5.375
  597    HB2  LEU  81           HB3      LEU  81  -3.074   1.665   3.993
  598    HB3  LEU  81           HB2      LEU  81  -3.026   0.892   5.573
  599    HG   LEU  81           HG       LEU  81  -5.007  -0.471   4.954
  600   HD11  LEU  81          HD11      LEU  81  -5.000  -0.171   2.138
  601   HD12  LEU  81          HD12      LEU  81  -5.105   1.456   2.810
  602   HD13  LEU  81          HD13      LEU  81  -6.302   0.239   3.254
  603   HD21  LEU  81          HD21      LEU  81  -3.816  -2.007   3.605
  604   HD22  LEU  81          HD22      LEU  81  -2.547  -1.103   4.430
  605   HD23  LEU  81          HD23      LEU  81  -2.953  -0.727   2.755
  606    H    GLY  82           H        GLY  82  -5.823   1.911   7.573
  607    HA2  GLY  82           HA3      GLY  82  -4.043   3.853   8.938
  608    HA3  GLY  82           HA2      GLY  82  -5.539   3.196   9.591
  609    H    ARG  83           H        ARG  83  -2.469   3.224  10.330
  610    HA   ARG  83           HA       ARG  83  -1.751   0.429  10.576
  611    HB2  ARG  83           HB3      ARG  83  -0.132   2.347  10.634
  612    HB3  ARG  83           HB2      ARG  83  -0.767   2.778  12.217
  613    HG2  ARG  83           HG3      ARG  83  -0.206  -0.009  12.279
  614    HG3  ARG  83           HG2      ARG  83   1.196   0.785  11.561
  615    HD2  ARG  83           HD3      ARG  83   1.364   0.670  14.038
  616    HD3  ARG  83           HD2      ARG  83   1.328   2.333  13.452
  617    HE   ARG  83           HE       ARG  83  -1.346   1.563  14.016
  618   HH11  ARG  83          HH22      ARG  83   1.689   2.079  15.569
  619   HH12  ARG  83          HH21      ARG  83   0.986   2.564  17.076
  620   HH21  ARG  83          HH11      ARG  83  -2.281   2.196  15.975
  621   HH22  ARG  83          HH12      ARG  83  -1.262   2.631  17.305
  622    H    GLN  84           H        GLN  84  -2.601  -1.011  12.076
  623    HA   GLN  84           HA       GLN  84  -4.295   0.076  14.234
  624    HB2  GLN  84           HB3      GLN  84  -4.260  -2.313  12.669
  625    HB3  GLN  84           HB2      GLN  84  -4.038  -2.774  14.357
  626    HG2  GLN  84           HG3      GLN  84  -6.238  -0.957  13.328
  627    HG3  GLN  84           HG2      GLN  84  -6.440  -2.660  13.738
  628   HE21  GLN  84          HE22      GLN  84  -7.250   0.172  15.016
  629   HE22  GLN  84          HE21      GLN  84  -6.972  -0.109  16.666
  630    H    GLY  85           H        GLY  85  -1.154  -1.307  13.738
  631    HA2  GLY  85           HA3      GLY  85  -0.005  -0.552  16.141
  632    HA3  GLY  85           HA2      GLY  85  -0.714  -2.132  16.489
  633    H    GLU  86           H        GLU  86   2.145  -0.839  15.765
  634    HA   GLU  86           HA       GLU  86   4.100  -1.627  14.708
  635    HB2  GLU  86           HB3      GLU  86   3.271  -3.571  16.303
  636    HB3  GLU  86           HB2      GLU  86   2.940  -4.393  14.778
  637    HG2  GLU  86           HG3      GLU  86   5.141  -5.035  15.091
  638    HG3  GLU  86           HG2      GLU  86   5.393  -3.538  14.192
  639    H    GLY  87           H        GLY  87   4.024  -4.170  13.059
  640    HA2  GLY  87           HA3      GLY  87   3.302  -2.872  10.540
  641    HA3  GLY  87           HA2      GLY  87   3.979  -4.490  10.708
  642    H    ASP  88           H        ASP  88   0.967  -2.716  11.428
  643    HA   ASP  88           HA       ASP  88  -0.570  -4.915  10.201
  644    HB2  ASP  88           HB3      ASP  88  -0.194  -4.856  12.983
  645    HB3  ASP  88           HB2      ASP  88  -1.807  -4.186  12.727
  646    H    TYR  89           H        TYR  89  -1.773  -3.769   8.784
  647    HA   TYR  89           HA       TYR  89  -3.091  -1.260   9.742
  648    HB2  TYR  89           HB3      TYR  89  -2.269  -1.839   6.904
  649    HB3  TYR  89           HB2      TYR  89  -2.861  -0.327   7.531
  650    HD1  TYR  89           HD1      TYR  89  -0.068  -2.790   8.084
  651    HD2  TYR  89           HD2      TYR  89  -1.323   1.326   8.133
  652    HE1  TYR  89           HE1      TYR  89   2.241  -2.083   8.608
  653    HE2  TYR  89           HE2      TYR  89   1.002   2.021   8.644
  654    HH   TYR  89           HH       TYR  89   3.081   1.359   9.002
  655    H    ARG  90           H        ARG  90  -5.264  -1.027   9.210
  656    HA   ARG  90           HA       ARG  90  -6.503  -3.100   7.485
  657    HB2  ARG  90           HB3      ARG  90  -7.883  -2.378  10.045
  658    HB3  ARG  90           HB2      ARG  90  -8.000  -3.858   9.094
  659    HG2  ARG  90           HG3      ARG  90  -5.696  -4.467   9.786
  660    HG3  ARG  90           HG2      ARG  90  -5.626  -3.011  10.778
  661    HD2  ARG  90           HD3      ARG  90  -6.231  -4.924  12.174
  662    HD3  ARG  90           HD2      ARG  90  -7.595  -3.812  12.059
  663    HE   ARG  90           HE       ARG  90  -8.106  -5.568  10.018
  664   HH11  ARG  90          HH22      ARG  90  -7.217  -5.908  13.333
  665   HH12  ARG  90          HH21      ARG  90  -8.053  -7.412  13.539
  666   HH21  ARG  90          HH11      ARG  90  -9.203  -7.528  10.271
  667   HH22  ARG  90          HH12      ARG  90  -9.177  -8.329  11.807
  668    H    VAL  91           H        VAL  91  -8.521  -2.413   6.603
  669    HA   VAL  91           HA       VAL  91  -9.323   0.402   7.135
  670    HB   VAL  91           HB       VAL  91  -7.702   0.251   5.145
  671   HG11  VAL  91          HG11      VAL  91  -8.919  -1.926   4.381
  672   HG12  VAL  91          HG12      VAL  91  -8.421  -0.766   3.147
  673   HG13  VAL  91          HG13      VAL  91 -10.104  -0.826   3.676
  674   HG21  VAL  91          HG21      VAL  91 -10.439   1.447   5.189
  675   HG22  VAL  91          HG22      VAL  91  -9.558   1.504   3.662
  676   HG23  VAL  91          HG23      VAL  91  -8.867   2.243   5.106
  677    H    GLN  92           H        GLN  92 -11.534   0.702   6.955
  678    HA   GLN  92           HA       GLN  92 -13.199  -1.671   6.843
  679    HB2  GLN  92           HB3      GLN  92 -14.053   1.239   6.740
  680    HB3  GLN  92           HB2      GLN  92 -15.058  -0.141   7.187
  681    HG2  GLN  92           HG3      GLN  92 -13.124  -0.539   8.967
  682    HG3  GLN  92           HG2      GLN  92 -12.875   1.193   8.738
  683   HE21  GLN  92          HE22      GLN  92 -14.424  -0.836  10.783
  684   HE22  GLN  92          HE21      GLN  92 -15.785   0.100  11.175
  685    H    LYS  93           H        LYS  93 -13.672  -2.658   4.937
  686    HA   LYS  93           HA       LYS  93 -13.648  -1.090   2.432
  687    HB2  LYS  93           HB3      LYS  93 -12.601  -3.402   2.657
  688    HB3  LYS  93           HB2      LYS  93 -14.243  -4.041   2.764
  689    HG2  LYS  93           HG3      LYS  93 -14.685  -2.728   0.577
  690    HG3  LYS  93           HG2      LYS  93 -12.928  -2.629   0.443
  691    HD2  LYS  93           HD3      LYS  93 -13.169  -4.630  -0.634
  692    HD3  LYS  93           HD2      LYS  93 -13.218  -5.269   1.010
  693    HE2  LYS  93           HE3      LYS  93 -15.113  -6.146  -0.258
  694    HE3  LYS  93           HE2      LYS  93 -15.697  -5.045   0.991
  695    HZ1  LYS  93           HZ1      LYS  93 -15.693  -4.741  -1.903
  696    HZ2  LYS  93           HZ2      LYS  93 -15.337  -3.346  -1.006
  697    HZ3  LYS  93           HZ3      LYS  93 -16.802  -4.168  -0.749
  698    H    GLY  94           H        GLY  94 -15.591   0.174   2.967
  699    HA2  GLY  94           HA3      GLY  94 -17.895   0.592   2.814
  700    HA3  GLY  94           HA2      GLY  94 -17.963  -0.836   1.781
  701    H    ASP  95           H        ASP  95 -18.235  -2.933   2.830
  702    HA   ASP  95           HA       ASP  95 -18.644  -3.245   5.640
  703    HB2  ASP  95           HB3      ASP  95 -20.599  -1.907   5.508
  704    HB3  ASP  95           HB2      ASP  95 -21.083  -2.624   3.970
  705    H    GLY  96           H        GLY  96 -17.351  -5.091   4.813
  706    HA2  GLY  96           HA3      GLY  96 -18.356  -7.555   4.877
  707    HA3  GLY  96           HA2      GLY  96 -18.878  -7.103   3.254
  708    H    GLY  97           H        GLY  97 -15.915  -7.157   5.263
  709    HA2  GLY  97           HA3      GLY  97 -14.197  -8.748   4.062
  710    HA3  GLY  97           HA2      GLY  97 -14.315  -7.545   2.779
  711    H    GLN  98           H        GLN  98 -12.677  -8.406   5.585
  712    HA   GLN  98           HA       GLN  98 -11.790  -5.623   6.144
  713    HB2  GLN  98           HB3      GLN  98 -12.429  -7.552   7.906
  714    HB3  GLN  98           HB2      GLN  98 -10.723  -7.937   7.690
  715    HG2  GLN  98           HG3      GLN  98 -10.108  -5.614   8.212
  716    HG3  GLN  98           HG2      GLN  98 -11.817  -5.213   8.434
  717   HE21  GLN  98          HE22      GLN  98 -11.769  -8.266   9.553
  718   HE22  GLN  98          HE21      GLN  98 -11.376  -8.001  11.184
  719    H    LEU  99           H        LEU  99 -10.094  -4.945   5.014
  720    HA   LEU  99           HA       LEU  99  -8.225  -6.859   3.798
  721    HB2  LEU  99           HB3      LEU  99  -7.763  -3.897   3.814
  722    HB3  LEU  99           HB2      LEU  99  -7.427  -5.066   2.549
  723    HG   LEU  99           HG       LEU  99 -10.200  -4.179   3.376
  724   HD11  LEU  99          HD11      LEU  99  -8.257  -2.881   1.763
  725   HD12  LEU  99          HD12      LEU  99  -9.950  -2.439   1.982
  726   HD13  LEU  99          HD13      LEU  99  -9.487  -3.529   0.677
  727   HD21  LEU  99          HD21      LEU  99 -10.898  -5.381   1.339
  728   HD22  LEU  99          HD22      LEU  99 -10.091  -6.478   2.457
  729   HD23  LEU  99          HD23      LEU  99  -9.228  -5.864   1.047
  730    H    VAL 100           H        VAL 100  -6.060  -7.093   4.430
  731    HA   VAL 100           HA       VAL 100  -5.148  -5.553   6.807
  732    HB   VAL 100           HB       VAL 100  -5.448  -8.547   6.617
  733   HG11  VAL 100          HG11      VAL 100  -3.436  -6.922   8.144
  734   HG12  VAL 100          HG12      VAL 100  -3.233  -8.481   7.342
  735   HG13  VAL 100          HG13      VAL 100  -4.098  -8.385   8.876
  736   HG21  VAL 100          HG21      VAL 100  -7.219  -7.064   7.661
  737   HG22  VAL 100          HG22      VAL 100  -6.022  -6.606   8.872
  738   HG23  VAL 100          HG23      VAL 100  -6.552  -8.283   8.747
  739    H    LEU 101           H        LEU 101  -3.278  -4.648   6.046
  740    HA   LEU 101           HA       LEU 101  -1.546  -6.198   4.188
  741    HB2  LEU 101           HB3      LEU 101  -2.125  -3.769   3.736
  742    HB3  LEU 101           HB2      LEU 101  -1.231  -3.365   5.180
  743    HG   LEU 101           HG       LEU 101   0.380  -5.075   3.531
  744   HD11  LEU 101          HD11      LEU 101  -0.758  -2.567   2.261
  745   HD12  LEU 101          HD12      LEU 101  -0.882  -4.213   1.641
  746   HD13  LEU 101          HD13      LEU 101   0.681  -3.400   1.672
  747   HD21  LEU 101          HD21      LEU 101   0.708  -2.138   4.210
  748   HD22  LEU 101          HD22      LEU 101   1.984  -3.295   3.833
  749   HD23  LEU 101          HD23      LEU 101   1.082  -3.439   5.340
  750    H    ARG 102           H        ARG 102   0.095  -7.427   5.157
  751    HA   ARG 102           HA       ARG 102   1.500  -6.220   7.466
  752    HB2  ARG 102           HB3      ARG 102  -0.288  -7.728   8.367
  753    HB3  ARG 102           HB2      ARG 102   0.448  -9.064   7.479
  754    HG2  ARG 102           HG3      ARG 102   2.515  -7.726   8.933
  755    HG3  ARG 102           HG2      ARG 102   1.182  -8.039  10.045
  756    HD2  ARG 102           HD3      ARG 102   2.571 -10.073   8.277
  757    HD3  ARG 102           HD2      ARG 102   2.669  -9.967  10.034
  758    HE   ARG 102           HE       ARG 102  -0.048 -10.233   9.524
  759   HH11  ARG 102          HH22      ARG 102   2.850 -11.917   8.707
  760   HH12  ARG 102          HH21      ARG 102   2.083 -13.469   8.632
  761   HH21  ARG 102          HH11      ARG 102  -1.062 -12.251   9.431
  762   HH22  ARG 102          HH12      ARG 102  -0.130 -13.659   9.042
  763    H    ARG 103           H        ARG 103   3.659  -6.713   7.463
  764    HA   ARG 103           HA       ARG 103   5.110  -7.350   5.239
  765    HB2  ARG 103           HB3      ARG 103   6.282  -8.684   7.565
  766    HB3  ARG 103           HB2      ARG 103   6.887  -7.312   6.636
  767    HG2  ARG 103           HG3      ARG 103   5.218  -5.855   7.825
  768    HG3  ARG 103           HG2      ARG 103   4.815  -7.236   8.846
  769    HD2  ARG 103           HD3      ARG 103   7.591  -6.046   8.561
  770    HD3  ARG 103           HD2      ARG 103   6.497  -5.740   9.911
  771    HE   ARG 103           HE       ARG 103   6.690  -8.507   9.813
  772   HH11  ARG 103          HH22      ARG 103   8.863  -5.836   9.972
  773   HH12  ARG 103          HH21      ARG 103  10.068  -6.698  10.868
  774   HH21  ARG 103          HH11      ARG 103   8.252  -9.649  10.984
  775   HH22  ARG 103          HH12      ARG 103   9.722  -8.858  11.441
  776    H    ALA 104           H        ALA 104   5.282  -9.098   3.927
  777    HA   ALA 104           HA       ALA 104   3.809 -11.466   4.212
  778    HB1  ALA 104           HB1      ALA 104   4.752 -12.024   2.227
  779    HB2  ALA 104           HB2      ALA 104   6.388 -11.875   2.867
  780    HB3  ALA 104           HB3      ALA 104   5.525 -10.442   2.307
  781    H    THR 105           H        THR 105   4.163 -13.413   5.247
  782    HA   THR 105           HA       THR 105   6.380 -13.469   7.196
  783    HB   THR 105           HB       THR 105   4.752 -15.853   7.218
  784    HG1  THR 105           HG1      THR 105   3.461 -13.352   7.027
  785   HG21  THR 105          HG21      THR 105   6.002 -14.905   9.128
  786   HG22  THR 105          HG22      THR 105   4.288 -15.080   9.505
  787   HG23  THR 105          HG23      THR 105   4.945 -13.492   9.109
  788    HA   PRO 106           HA       PRO 106   7.030 -17.548   4.539
  789    HB2  PRO 106           HB2      PRO 106   6.101 -16.548   1.905
  790    HB3  PRO 106           HB3      PRO 106   5.840 -18.128   2.669
  791    HG2  PRO 106           HG3      PRO 106   3.880 -16.327   2.448
  792    HG3  PRO 106           HG2      PRO 106   4.011 -17.408   3.845
  793    HD2  PRO 106           HD3      PRO 106   4.703 -14.502   3.637
  794    HD3  PRO 106           HD2      PRO 106   4.001 -15.400   5.002
  Start of MODEL   14
    1    H1   SER   1           H        SER   1  12.702  25.331  -3.734
    2    H2   SER   1           H2       SER   1  14.137  26.240  -3.761
    3    H3   SER   1           1HT      SER   1  13.302  25.922  -5.207
    4    HA   SER   1           HA       SER   1  13.814  23.612  -5.102
    5    HB2  SER   1           HB3      SER   1  15.555  25.248  -5.954
    6    HB3  SER   1           HB2      SER   1  16.314  25.157  -4.366
    7    HG   SER   1           HG       SER   1  17.167  23.658  -5.929
    8    H    SER   2           H        SER   2  12.670  23.093  -2.956
    9    HA   SER   2           HA       SER   2  14.436  22.946  -0.605
   10    HB2  SER   2           HB3      SER   2  11.603  21.981  -1.083
   11    HB3  SER   2           HB2      SER   2  12.449  21.844   0.456
   12    HG   SER   2           HG       SER   2  12.633  24.102   0.483
   13    H    LEU   3           H        LEU   3  12.410  20.430  -2.148
   14    HA   LEU   3           HA       LEU   3  12.834  18.133  -2.411
   15    HB2  LEU   3           HB3      LEU   3  15.666  19.095  -2.907
   16    HB3  LEU   3           HB2      LEU   3  14.935  17.602  -3.497
   17    HG   LEU   3           HG       LEU   3  13.225  19.723  -4.292
   18   HD11  LEU   3          HD11      LEU   3  16.128  20.208  -5.029
   19   HD12  LEU   3          HD12      LEU   3  15.194  21.203  -3.913
   20   HD13  LEU   3          HD13      LEU   3  14.737  21.120  -5.616
   21   HD21  LEU   3          HD21      LEU   3  13.517  17.621  -5.498
   22   HD22  LEU   3          HD22      LEU   3  15.213  18.001  -5.808
   23   HD23  LEU   3          HD23      LEU   3  13.942  18.960  -6.567
   24    H    ILE   4           H        ILE   4  12.555  17.341  -0.302
   25    HA   ILE   4           HA       ILE   4  14.763  17.539   1.630
   26    HB   ILE   4           HB       ILE   4  12.101  16.093   1.781
   27   HG12  ILE   4          HG13      ILE   4  12.346  18.736   1.646
   28   HG13  ILE   4          HG12      ILE   4  11.217  17.992   2.775
   29   HG21  ILE   4          HG21      ILE   4  12.671  16.250   4.300
   30   HG22  ILE   4          HG22      ILE   4  14.331  16.523   3.767
   31   HG23  ILE   4          HG23      ILE   4  13.507  15.023   3.348
   32   HD11  ILE   4          HD11      ILE   4  12.797  19.821   3.695
   33   HD12  ILE   4          HD12      ILE   4  14.062  18.598   3.586
   34   HD13  ILE   4          HD13      ILE   4  12.660  18.326   4.619
   35    H    LEU   5           H        LEU   5  12.892  14.587   1.163
   36    HA   LEU   5           HA       LEU   5  14.874  13.104  -0.267
   37    HB2  LEU   5           HB3      LEU   5  15.491  13.569   2.488
   38    HB3  LEU   5           HB2      LEU   5  15.094  11.862   2.296
   39    HG   LEU   5           HG       LEU   5  17.066  13.376   0.560
   40   HD11  LEU   5          HD11      LEU   5  17.601  11.315   2.718
   41   HD12  LEU   5          HD12      LEU   5  17.792  13.054   2.946
   42   HD13  LEU   5          HD13      LEU   5  18.803  12.202   1.779
   43   HD21  LEU   5          HD21      LEU   5  17.388  10.533   0.553
   44   HD22  LEU   5          HD22      LEU   5  16.938  11.579  -0.794
   45   HD23  LEU   5          HD23      LEU   5  15.688  10.888   0.242
   46    H    LEU   6           H        LEU   6  13.158  12.062  -1.270
   47    HA   LEU   6           HA       LEU   6  11.098  10.757   0.418
   48    HB2  LEU   6           HB3      LEU   6  11.275  10.773  -2.604
   49    HB3  LEU   6           HB2      LEU   6   9.855  10.448  -1.609
   50    HG   LEU   6           HG       LEU   6  10.741  12.957  -0.752
   51   HD11  LEU   6          HD11      LEU   6  10.801  12.782  -3.780
   52   HD12  LEU   6          HD12      LEU   6  12.205  13.060  -2.751
   53   HD13  LEU   6          HD13      LEU   6  10.917  14.262  -2.830
   54   HD21  LEU   6          HD21      LEU   6   8.588  12.219  -2.761
   55   HD22  LEU   6          HD22      LEU   6   8.671  13.743  -1.877
   56   HD23  LEU   6          HD23      LEU   6   8.404  12.231  -1.007
   57    H    SER   7           H        SER   7  13.848   9.751   0.438
   58    HA   SER   7           HA       SER   7  13.677   7.230  -1.112
   59    HB2  SER   7           HB3      SER   7  15.906   8.020   0.762
   60    HB3  SER   7           HB2      SER   7  15.973   6.923  -0.614
   61    HG   SER   7           HG       SER   7  15.784   8.653  -1.983
   62    H    ALA   8           H        ALA   8  13.090   5.320  -0.173
   63    HA   ALA   8           HA       ALA   8  12.445   5.351   2.721
   64    HB1  ALA   8           HB1      ALA   8  11.491   3.900   0.353
   65    HB2  ALA   8           HB2      ALA   8  10.656   4.252   1.867
   66    HB3  ALA   8           HB3      ALA   8  11.733   2.860   1.757
   67    H    SER   9           H        SER   9  13.432   3.940   4.198
   68    HA   SER   9           HA       SER   9  15.509   2.079   3.185
   69    HB2  SER   9           HB3      SER   9  16.527   3.471   5.499
   70    HB3  SER   9           HB2      SER   9  17.254   3.303   3.904
   71    HG   SER   9           HG       SER   9  15.995   5.065   3.221
   72    H    ASP  10           H        ASP  10  13.429   3.223   5.765
   73    HA   ASP  10           HA       ASP  10  14.063   0.837   7.416
   74    HB2  ASP  10           HB3      ASP  10  13.895   2.655   8.853
   75    HB3  ASP  10           HB2      ASP  10  12.639   3.432   7.889
   76    H    LEU  11           H        LEU  11  11.630   2.103   5.278
   77    HA   LEU  11           HA       LEU  11   9.767  -0.113   6.018
   78    HB2  LEU  11           HB3      LEU  11   9.269   2.377   4.356
   79    HB3  LEU  11           HB2      LEU  11   8.056   1.178   4.801
   80    HG   LEU  11           HG       LEU  11   9.658   2.442   6.990
   81   HD11  LEU  11          HD11      LEU  11   7.294   3.747   5.605
   82   HD12  LEU  11          HD12      LEU  11   8.953   4.347   5.590
   83   HD13  LEU  11          HD13      LEU  11   8.043   4.307   7.100
   84   HD21  LEU  11          HD21      LEU  11   8.038   0.609   7.422
   85   HD22  LEU  11          HD22      LEU  11   6.756   1.594   6.715
   86   HD23  LEU  11          HD23      LEU  11   7.545   2.111   8.205
   87    H    ALA  12           H        ALA  12   8.395  -0.165   3.509
   88    HA   ALA  12           HA       ALA  12   8.571  -1.011   1.323
   89    HB1  ALA  12           HB1      ALA  12  11.543  -0.963   1.300
   90    HB2  ALA  12           HB2      ALA  12  10.742   0.601   1.454
   91    HB3  ALA  12           HB3      ALA  12  10.399  -0.432   0.067
   92    H    GLY  13           H        GLY  13   9.541  -3.002   0.228
   93    HA2  GLY  13           HA3      GLY  13  11.054  -5.014   0.847
   94    HA3  GLY  13           HA2      GLY  13  10.080  -5.077   2.312
   95    H    GLN  14           H        GLN  14   8.773  -6.839   2.093
   96    HA   GLN  14           HA       GLN  14   7.189  -7.079  -0.431
   97    HB2  GLN  14           HB3      GLN  14   8.362  -9.255   1.331
   98    HB3  GLN  14           HB2      GLN  14   7.158  -9.558   0.079
   99    HG2  GLN  14           HG3      GLN  14   8.631  -8.832  -1.655
  100    HG3  GLN  14           HG2      GLN  14   9.768  -8.145  -0.493
  101   HE21  GLN  14          HE22      GLN  14   8.174 -11.323  -0.149
  102   HE22  GLN  14          HE21      GLN  14   9.603 -12.232  -0.263
  103    H    TRP  15           H        TRP  15   4.963  -7.571  -0.077
  104    HA   TRP  15           HA       TRP  15   4.071  -7.886   2.726
  105    HB2  TRP  15           HB3      TRP  15   3.075  -5.655   0.930
  106    HB3  TRP  15           HB2      TRP  15   2.431  -6.053   2.512
  107    HD1  TRP  15           HD1      TRP  15   5.848  -4.970   0.970
  108    HE1  TRP  15           HE1      TRP  15   7.059  -3.523   2.718
  109    HE3  TRP  15           HE3      TRP  15   2.503  -5.237   4.829
  110    HZ2  TRP  15           HZ2      TRP  15   6.673  -2.593   5.392
  111    HZ3  TRP  15           HZ3      TRP  15   2.952  -4.058   6.961
  112    HH2  TRP  15           HH2      TRP  15   5.029  -2.735   7.247
  113    H    THR  16           H        THR  16   1.520  -8.014   2.622
  114    HA   THR  16           HA       THR  16   0.579  -9.260   0.095
  115    HB   THR  16           HB       THR  16  -0.347 -11.104   1.870
  116    HG1  THR  16           HG1      THR  16   1.459  -9.857   3.209
  117   HG21  THR  16          HG21      THR  16   0.639 -11.705  -0.235
  118   HG22  THR  16          HG22      THR  16   1.540 -12.555   1.020
  119   HG23  THR  16          HG23      THR  16   2.221 -11.111   0.273
  120    H    LEU  17           H        LEU  17  -1.819  -9.777   0.312
  121    HA   LEU  17           HA       LEU  17  -3.123  -7.830   2.185
  122    HB2  LEU  17           HB3      LEU  17  -3.311  -8.037  -0.627
  123    HB3  LEU  17           HB2      LEU  17  -4.832  -8.667   0.006
  124    HG   LEU  17           HG       LEU  17  -4.984  -6.609   1.462
  125   HD11  LEU  17          HD11      LEU  17  -3.230  -5.004  -0.195
  126   HD12  LEU  17          HD12      LEU  17  -2.324  -6.289   0.604
  127   HD13  LEU  17          HD13      LEU  17  -3.272  -5.152   1.563
  128   HD21  LEU  17          HD21      LEU  17  -5.025  -6.551  -1.536
  129   HD22  LEU  17          HD22      LEU  17  -5.312  -5.053  -0.653
  130   HD23  LEU  17          HD23      LEU  17  -6.368  -6.442  -0.398
  131    H    GLN  18           H        GLN  18  -5.249  -8.535   3.013
  132    HA   GLN  18           HA       GLN  18  -5.882 -11.392   2.751
  133    HB2  GLN  18           HB3      GLN  18  -4.841 -10.197   5.330
  134    HB3  GLN  18           HB2      GLN  18  -5.743 -11.707   5.271
  135    HG2  GLN  18           HG3      GLN  18  -4.002 -12.488   3.541
  136    HG3  GLN  18           HG2      GLN  18  -3.044 -11.101   4.062
  137   HE21  GLN  18          HE22      GLN  18  -2.813 -10.976   6.600
  138   HE22  GLN  18          HE21      GLN  18  -2.538 -12.453   7.391
  139    H    GLN  19           H        GLN  19  -8.055 -11.527   2.729
  140    HA   GLN  19           HA       GLN  19  -9.642  -9.347   4.003
  141    HB2  GLN  19           HB3      GLN  19 -11.216 -11.359   2.618
  142    HB3  GLN  19           HB2      GLN  19 -11.102  -9.628   2.301
  143    HG2  GLN  19           HG3      GLN  19  -9.150 -11.735   1.328
  144    HG3  GLN  19           HG2      GLN  19 -10.370 -10.929   0.351
  145   HE21  GLN  19          HE22      GLN  19  -7.117 -10.778   1.175
  146   HE22  GLN  19          HE21      GLN  19  -6.831  -9.144   0.820
  147    H    ASP  20           H        ASP  20 -10.160  -9.822   6.111
  148    HA   ASP  20           HA       ASP  20 -10.641 -11.106   8.024
  149    HB2  ASP  20           HB3      ASP  20 -12.857 -11.055   7.138
  150    HB3  ASP  20           HB2      ASP  20 -12.465 -12.238   5.894
  151    H    GLU  21           H        GLU  21 -11.447 -13.995   6.295
  152    HA   GLU  21           HA       GLU  21  -9.236 -15.406   7.567
  153    HB2  GLU  21           HB3      GLU  21 -11.663 -16.132   6.088
  154    HB3  GLU  21           HB2      GLU  21 -10.277 -17.130   5.635
  155    HG2  GLU  21           HG3      GLU  21  -9.879 -17.724   7.954
  156    HG3  GLU  21           HG2      GLU  21 -11.134 -16.608   8.495
  157    H    ALA  22           H        ALA  22 -10.033 -14.245   4.350
  158    HA   ALA  22           HA       ALA  22  -8.511 -13.517   2.687
  159    HB1  ALA  22           HB1      ALA  22  -6.213 -13.688   2.918
  160    HB2  ALA  22           HB2      ALA  22  -6.298 -15.225   3.768
  161    HB3  ALA  22           HB3      ALA  22  -6.721 -13.731   4.604
  162    HA   PRO  23           HA       PRO  23  -9.604 -17.875   1.177
  163    HB2  PRO  23           HB2      PRO  23 -11.093 -16.205  -0.783
  164    HB3  PRO  23           HB3      PRO  23 -11.615 -17.663   0.082
  165    HG2  PRO  23           HG3      PRO  23 -12.524 -15.224   0.715
  166    HG3  PRO  23           HG2      PRO  23 -12.284 -16.495   1.926
  167    HD2  PRO  23           HD3      PRO  23 -10.642 -14.057   1.408
  168    HD3  PRO  23           HD2      PRO  23 -10.927 -14.933   2.926
  169    H    ALA  24           H        ALA  24  -8.129 -15.003   0.133
  170    HA   ALA  24           HA       ALA  24  -6.519 -16.446  -1.861
  171    HB1  ALA  24           HB1      ALA  24  -6.960 -14.452  -3.489
  172    HB2  ALA  24           HB2      ALA  24  -8.435 -14.220  -2.550
  173    HB3  ALA  24           HB3      ALA  24  -8.162 -15.741  -3.400
  174    H    ILE  25           H        ILE  25  -4.446 -15.610  -1.858
  175    HA   ILE  25           HA       ILE  25  -3.997 -13.136  -0.233
  176    HB   ILE  25           HB       ILE  25  -2.228 -15.519  -0.827
  177   HG12  ILE  25          HG13      ILE  25  -3.028 -14.361   1.847
  178   HG13  ILE  25          HG12      ILE  25  -4.044 -15.536   1.014
  179   HG21  ILE  25          HG21      ILE  25  -1.596 -12.816   0.361
  180   HG22  ILE  25          HG22      ILE  25  -0.730 -13.687  -0.904
  181   HG23  ILE  25          HG23      ILE  25  -0.644 -14.243   0.768
  182   HD11  ILE  25          HD11      ILE  25  -2.385 -17.219   1.115
  183   HD12  ILE  25          HD12      ILE  25  -2.315 -16.452   2.702
  184   HD13  ILE  25          HD13      ILE  25  -1.109 -16.056   1.479
  185    H    CYS  26           H        CYS  26  -3.461 -11.359  -1.400
  186    HA   CYS  26           HA       CYS  26  -2.406 -11.721  -4.156
  187    HB2  CYS  26           HB3      CYS  26  -3.839  -9.545  -2.712
  188    HB3  CYS  26           HB2      CYS  26  -2.672  -9.050  -3.930
  189    H    HIS  27           H        HIS  27  -0.226 -11.797  -4.287
  190    HA   HIS  27           HA       HIS  27   1.547 -10.864  -2.227
  191    HB2  HIS  27           HB3      HIS  27   1.771 -12.164  -4.833
  192    HB3  HIS  27           HB2      HIS  27   3.050 -10.979  -4.572
  193    HD1  HIS  27           HD1      HIS  27   4.986 -12.485  -3.957
  194    HD2  HIS  27           HD2      HIS  27   1.560 -13.322  -1.730
  195    HE1  HIS  27           HE1      HIS  27   5.677 -14.149  -2.175
  196    HE2  HIS  27           HE2      HIS  27   3.600 -14.666  -0.815
  197    H    LEU  28           H        LEU  28   2.296  -8.829  -1.886
  198    HA   LEU  28           HA       LEU  28   2.039  -6.827  -4.097
  199    HB2  LEU  28           HB3      LEU  28   0.966  -6.806  -1.369
  200    HB3  LEU  28           HB2      LEU  28   1.932  -5.385  -1.724
  201    HG   LEU  28           HG       LEU  28  -0.483  -5.087  -2.284
  202   HD11  LEU  28          HD11      LEU  28   1.791  -4.506  -3.891
  203   HD12  LEU  28          HD12      LEU  28   0.263  -3.629  -3.820
  204   HD13  LEU  28          HD13      LEU  28   0.476  -4.937  -4.983
  205   HD21  LEU  28          HD21      LEU  28  -1.620  -6.478  -3.692
  206   HD22  LEU  28          HD22      LEU  28  -0.410  -7.644  -3.159
  207   HD23  LEU  28          HD23      LEU  28  -0.206  -6.799  -4.695
  208    H    GLU  29           H        GLU  29   3.652  -5.066  -3.932
  209    HA   GLU  29           HA       GLU  29   5.960  -5.594  -2.161
  210    HB2  GLU  29           HB3      GLU  29   5.935  -6.518  -4.827
  211    HB3  GLU  29           HB2      GLU  29   6.923  -5.057  -4.843
  212    HG2  GLU  29           HG3      GLU  29   8.163  -5.990  -2.842
  213    HG3  GLU  29           HG2      GLU  29   7.291  -7.504  -3.099
  214    H    LEU  30           H        LEU  30   6.450  -3.680  -1.302
  215    HA   LEU  30           HA       LEU  30   5.624  -1.197  -2.661
  216    HB2  LEU  30           HB3      LEU  30   6.574  -1.948   0.082
  217    HB3  LEU  30           HB2      LEU  30   6.706  -0.273  -0.440
  218    HG   LEU  30           HG       LEU  30   4.325  -0.155  -0.882
  219   HD11  LEU  30          HD11      LEU  30   3.746  -2.260  -1.755
  220   HD12  LEU  30          HD12      LEU  30   2.966  -2.259  -0.174
  221   HD13  LEU  30          HD13      LEU  30   4.486  -3.124  -0.408
  222   HD21  LEU  30          HD21      LEU  30   3.778   0.093   1.310
  223   HD22  LEU  30          HD22      LEU  30   5.430  -0.430   1.632
  224   HD23  LEU  30          HD23      LEU  30   4.111  -1.599   1.672
  225    H    ARG  31           H        ARG  31   7.062  -0.596  -4.249
  226    HA   ARG  31           HA       ARG  31   9.860  -1.211  -4.225
  227    HB2  ARG  31           HB3      ARG  31   8.018   0.327  -5.890
  228    HB3  ARG  31           HB2      ARG  31   9.608   1.082  -5.783
  229    HG2  ARG  31           HG3      ARG  31  10.681  -1.017  -6.454
  230    HG3  ARG  31           HG2      ARG  31   9.112  -1.824  -6.499
  231    HD2  ARG  31           HD3      ARG  31   9.777  -1.164  -8.764
  232    HD3  ARG  31           HD2      ARG  31   8.367  -0.234  -8.255
  233    HE   ARG  31           HE       ARG  31  10.512   1.365  -7.530
  234   HH11  ARG  31          HH22      ARG  31   9.443  -0.239 -10.388
  235   HH12  ARG  31          HH21      ARG  31  10.107   0.947 -11.462
  236   HH21  ARG  31          HH11      ARG  31  11.383   2.924  -8.914
  237   HH22  ARG  31          HH12      ARG  31  11.204   2.737 -10.627
  238    H    ASP  32           H        ASP  32  11.661   0.212  -3.819
  239    HA   ASP  32           HA       ASP  32  11.054   2.288  -1.766
  240    HB2  ASP  32           HB3      ASP  32  13.447   2.050  -1.152
  241    HB3  ASP  32           HB2      ASP  32  12.589   0.513  -1.049
  242    H    SER  33           H        SER  33  11.122   2.409  -4.887
  243    HA   SER  33           HA       SER  33  13.273   4.354  -5.358
  244    HB2  SER  33           HB3      SER  33  12.501   2.738  -7.120
  245    HB3  SER  33           HB2      SER  33  10.958   3.588  -7.163
  246    HG   SER  33           HG       SER  33  13.365   4.257  -8.251
  247    H    GLU  34           H        GLU  34  12.502   6.473  -6.535
  248    HA   GLU  34           HA       GLU  34  10.341   7.673  -4.849
  249    HB2  GLU  34           HB3      GLU  34  11.450   9.850  -5.480
  250    HB3  GLU  34           HB2      GLU  34  12.460   8.776  -4.513
  251    HG2  GLU  34           HG3      GLU  34  13.627   8.003  -6.506
  252    HG3  GLU  34           HG2      GLU  34  12.551   8.947  -7.539
  253    H    VAL  35           H        VAL  35   8.827   9.108  -5.893
  254    HA   VAL  35           HA       VAL  35   8.800   9.068  -8.864
  255    HB   VAL  35           HB       VAL  35   6.444   8.215  -7.151
  256   HG11  VAL  35          HG11      VAL  35   6.025   7.560  -9.840
  257   HG12  VAL  35          HG12      VAL  35   6.696   9.191  -9.882
  258   HG13  VAL  35          HG13      VAL  35   5.240   8.860  -8.946
  259   HG21  VAL  35          HG21      VAL  35   6.780   6.026  -8.334
  260   HG22  VAL  35          HG22      VAL  35   8.113   6.446  -7.260
  261   HG23  VAL  35          HG23      VAL  35   8.282   6.665  -9.002
  262    H    ALA  36           H        ALA  36   8.531  11.150  -9.477
  263    HA   ALA  36           HA       ALA  36   7.443  13.109  -7.572
  264    HB1  ALA  36           HB1      ALA  36   8.658  14.607  -8.749
  265    HB2  ALA  36           HB2      ALA  36   7.957  14.081 -10.279
  266    HB3  ALA  36           HB3      ALA  36   9.341  13.223  -9.600
  267    H    GLU  37           H        GLU  37   6.424  11.414 -10.467
  268    HA   GLU  37           HA       GLU  37   4.279  13.096 -11.263
  269    HB2  GLU  37           HB3      GLU  37   5.148  11.082 -12.520
  270    HB3  GLU  37           HB2      GLU  37   4.284  10.066 -11.365
  271    HG2  GLU  37           HG3      GLU  37   2.848  10.356 -13.281
  272    HG3  GLU  37           HG2      GLU  37   2.176  11.323 -11.970
  273    H    ALA  38           H        ALA  38   4.485  10.622  -8.746
  274    HA   ALA  38           HA       ALA  38   1.704  11.326  -7.890
  275    HB1  ALA  38           HB1      ALA  38   2.998   8.801  -8.270
  276    HB2  ALA  38           HB2      ALA  38   1.346   9.109  -7.739
  277    HB3  ALA  38           HB3      ALA  38   2.646   8.992  -6.553
  278    H    SER  39           H        SER  39   4.966  11.670  -7.130
  279    HA   SER  39           HA       SER  39   5.987  12.659  -5.273
  280    HB2  SER  39           HB3      SER  39   4.728  14.120  -4.018
  281    HB3  SER  39           HB2      SER  39   3.585  13.853  -5.331
  282    HG   SER  39           HG       SER  39   3.395  13.200  -2.717
  283    H    GLY  40           H        GLY  40   5.636   9.825  -5.425
  284    HA2  GLY  40           HA3      GLY  40   5.955   9.180  -2.576
  285    HA3  GLY  40           HA2      GLY  40   4.604   8.372  -3.371
  286    H    TYR  41           H        TYR  41   5.806   6.337  -2.919
  287    HA   TYR  41           HA       TYR  41   8.186   5.929  -4.668
  288    HB2  TYR  41           HB3      TYR  41   7.204   3.800  -2.817
  289    HB3  TYR  41           HB2      TYR  41   8.854   4.225  -3.254
  290    HD1  TYR  41           HD1      TYR  41   8.599   7.253  -2.694
  291    HD2  TYR  41           HD2      TYR  41   7.460   3.784  -0.449
  292    HE1  TYR  41           HE1      TYR  41   8.799   8.550  -0.598
  293    HE2  TYR  41           HE2      TYR  41   7.666   5.075   1.654
  294    HH   TYR  41           HH       TYR  41   9.183   7.365   2.260
  295    H    ASP  42           H        ASP  42   8.163   4.136  -6.155
  296    HA   ASP  42           HA       ASP  42   5.649   3.722  -7.466
  297    HB2  ASP  42           HB3      ASP  42   7.901   3.589  -8.564
  298    HB3  ASP  42           HB2      ASP  42   8.156   2.047  -7.746
  299    H    LEU  43           H        LEU  43   4.889   1.430  -7.982
  300    HA   LEU  43           HA       LEU  43   4.928  -0.307  -5.542
  301    HB2  LEU  43           HB3      LEU  43   2.773   0.946  -5.648
  302    HB3  LEU  43           HB2      LEU  43   2.510   0.317  -7.270
  303    HG   LEU  43           HG       LEU  43   2.738  -2.043  -6.164
  304   HD11  LEU  43          HD11      LEU  43   2.832  -2.220  -3.921
  305   HD12  LEU  43          HD12      LEU  43   1.600  -0.978  -3.697
  306   HD13  LEU  43          HD13      LEU  43   3.288  -0.516  -3.911
  307   HD21  LEU  43          HD21      LEU  43   0.652  -1.070  -7.068
  308   HD22  LEU  43          HD22      LEU  43   0.362  -0.290  -5.513
  309   HD23  LEU  43          HD23      LEU  43   0.358  -2.049  -5.630
  310    H    GLY  44           H        GLY  44   5.383  -2.385  -5.980
  311    HA2  GLY  44           HA3      GLY  44   5.008  -3.404  -8.768
  312    HA3  GLY  44           HA2      GLY  44   6.511  -3.700  -7.895
  313    H    GLY  45           H        GLY  45   4.419  -5.626  -8.867
  314    HA2  GLY  45           HA3      GLY  45   4.447  -7.743  -7.323
  315    HA3  GLY  45           HA2      GLY  45   3.469  -6.738  -6.270
  316    H    ASP  46           H        ASP  46   1.787  -8.342  -6.516
  317    HA   ASP  46           HA       ASP  46   0.588  -8.854  -9.115
  318    HB2  ASP  46           HB3      ASP  46   0.484 -10.219  -6.827
  319    HB3  ASP  46           HB2      ASP  46  -0.960  -9.235  -6.585
  320    H    THR  47           H        THR  47   0.854  -6.029  -7.962
  321    HA   THR  47           HA       THR  47  -1.415  -4.737  -7.180
  322    HB   THR  47           HB       THR  47  -0.559  -2.809  -8.120
  323    HG1  THR  47           HG1      THR  47  -0.405  -2.673 -10.196
  324   HG21  THR  47          HG21      THR  47   1.781  -4.638  -8.689
  325   HG22  THR  47          HG22      THR  47   1.290  -4.200  -7.051
  326   HG23  THR  47          HG23      THR  47   1.825  -2.951  -8.175
  327    H    ALA  48           H        ALA  48  -1.059  -6.444 -10.204
  328    HA   ALA  48           HA       ALA  48  -3.378  -5.251 -11.490
  329    HB1  ALA  48           HB1      ALA  48  -1.774  -7.763 -12.007
  330    HB2  ALA  48           HB2      ALA  48  -1.774  -6.266 -12.940
  331    HB3  ALA  48           HB3      ALA  48  -3.181  -7.327 -12.977
  332    H    CYS  49           H        CYS  49  -3.384  -6.775  -8.706
  333    HA   CYS  49           HA       CYS  49  -5.772  -8.492  -9.294
  334    HB2  CYS  49           HB3      CYS  49  -4.993  -9.994  -7.777
  335    HB3  CYS  49           HB2      CYS  49  -3.457  -9.140  -7.904
  336    H    LEU  50           H        LEU  50  -4.499  -5.816  -7.444
  337    HA   LEU  50           HA       LEU  50  -6.576  -5.536  -5.520
  338    HB2  LEU  50           HB3      LEU  50  -4.976  -3.339  -6.859
  339    HB3  LEU  50           HB2      LEU  50  -5.809  -3.223  -5.315
  340    HG   LEU  50           HG       LEU  50  -3.598  -5.213  -5.899
  341   HD11  LEU  50          HD11      LEU  50  -2.185  -3.721  -4.500
  342   HD12  LEU  50          HD12      LEU  50  -3.496  -2.543  -4.468
  343   HD13  LEU  50          HD13      LEU  50  -2.704  -2.940  -5.993
  344   HD21  LEU  50          HD21      LEU  50  -4.809  -6.069  -4.084
  345   HD22  LEU  50          HD22      LEU  50  -5.206  -4.468  -3.463
  346   HD23  LEU  50          HD23      LEU  50  -3.573  -5.104  -3.284
  347    H    THR  51           H        THR  51  -6.978  -5.580  -8.780
  348    HA   THR  51           HA       THR  51  -8.649  -3.299  -9.264
  349    HB   THR  51           HB       THR  51  -9.604  -4.851 -11.108
  350    HG1  THR  51           HG1      THR  51  -7.554  -6.426  -9.963
  351   HG21  THR  51          HG21      THR  51  -6.654  -4.210 -10.898
  352   HG22  THR  51          HG22      THR  51  -7.912  -3.193 -11.599
  353   HG23  THR  51          HG23      THR  51  -7.453  -4.700 -12.392
  354    H    ARG  52           H        ARG  52  -9.111  -5.631  -7.028
  355    HA   ARG  52           HA       ARG  52 -12.083  -5.700  -7.383
  356    HB2  ARG  52           HB3      ARG  52 -12.095  -7.682  -6.014
  357    HB3  ARG  52           HB2      ARG  52 -10.850  -7.900  -7.246
  358    HG2  ARG  52           HG3      ARG  52  -9.356  -6.727  -5.336
  359    HG3  ARG  52           HG2      ARG  52 -10.563  -7.505  -4.311
  360    HD2  ARG  52           HD3      ARG  52  -8.737  -8.821  -6.334
  361    HD3  ARG  52           HD2      ARG  52  -8.796  -9.100  -4.594
  362    HE   ARG  52           HE       ARG  52 -11.334  -9.693  -5.872
  363   HH11  ARG  52          HH22      ARG  52  -8.139 -10.803  -5.199
  364   HH12  ARG  52          HH21      ARG  52  -8.562 -12.480  -5.278
  365   HH21  ARG  52          HH11      ARG  52 -11.905 -11.878  -5.978
  366   HH22  ARG  52          HH12      ARG  52 -10.694 -13.090  -5.718
  367    H    TRP  53           H        TRP  53  -9.485  -4.589  -5.364
  368    HA   TRP  53           HA       TRP  53 -11.455  -3.755  -3.268
  369    HB2  TRP  53           HB3      TRP  53  -8.445  -4.075  -3.097
  370    HB3  TRP  53           HB2      TRP  53  -9.487  -3.541  -1.778
  371    HD1  TRP  53           HD1      TRP  53 -11.808  -5.459  -1.737
  372    HE1  TRP  53           HE1      TRP  53 -11.527  -7.987  -1.343
  373    HE3  TRP  53           HE3      TRP  53  -6.900  -6.022  -3.044
  374    HZ2  TRP  53           HZ2      TRP  53  -9.495  -9.982  -1.554
  375    HZ3  TRP  53           HZ3      TRP  53  -5.820  -8.252  -2.928
  376    HH2  TRP  53           HH2      TRP  53  -7.114 -10.231  -2.174
  377    H    LEU  54           H        LEU  54  -9.378  -2.658  -5.750
  378    HA   LEU  54           HA       LEU  54  -9.657   0.160  -4.780
  379    HB2  LEU  54           HB3      LEU  54  -7.493  -1.140  -6.456
  380    HB3  LEU  54           HB2      LEU  54  -7.621   0.597  -6.241
  381    HG   LEU  54           HG       LEU  54  -7.329  -1.398  -3.970
  382   HD11  LEU  54          HD11      LEU  54  -5.242   0.594  -4.808
  383   HD12  LEU  54          HD12      LEU  54  -5.337  -0.972  -5.609
  384   HD13  LEU  54          HD13      LEU  54  -5.050  -0.889  -3.873
  385   HD21  LEU  54          HD21      LEU  54  -7.888   1.489  -4.114
  386   HD22  LEU  54          HD22      LEU  54  -6.547   1.065  -3.055
  387   HD23  LEU  54          HD23      LEU  54  -8.140   0.357  -2.788
  388    HA   PRO  55           HA       PRO  55 -12.047   0.743  -8.477
  389    HB2  PRO  55           HB2      PRO  55 -11.705   3.398  -8.974
  390    HB3  PRO  55           HB3      PRO  55 -12.681   2.793  -7.621
  391    HG2  PRO  55           HG3      PRO  55  -9.917   3.876  -7.626
  392    HG3  PRO  55           HG2      PRO  55 -11.211   4.090  -6.438
  393    HD2  PRO  55           HD3      PRO  55  -9.109   2.338  -6.116
  394    HD3  PRO  55           HD2      PRO  55 -10.685   2.144  -5.329
  395    H    SER  56           H        SER  56  -8.666   1.264  -8.484
  396    HA   SER  56           HA       SER  56  -8.540   0.717 -11.368
  397    HB2  SER  56           HB3      SER  56  -7.980   2.787 -12.075
  398    HB3  SER  56           HB2      SER  56  -8.449   3.388 -10.487
  399    HG   SER  56           HG       SER  56  -6.373   3.958 -10.605
  400    H    GLU  57           H        GLU  57  -6.262   0.242 -12.014
  401    HA   GLU  57           HA       GLU  57  -4.916  -1.272  -9.966
  402    HB2  GLU  57           HB3      GLU  57  -4.852  -1.777 -12.438
  403    HB3  GLU  57           HB2      GLU  57  -3.794  -0.381 -12.637
  404    HG2  GLU  57           HG3      GLU  57  -2.201  -1.396 -11.013
  405    HG3  GLU  57           HG2      GLU  57  -3.238  -2.821 -10.924
  406    HA   PRO  58           HA       PRO  58  -2.719   2.399  -8.453
  407    HB2  PRO  58           HB2      PRO  58  -1.103   1.134  -6.626
  408    HB3  PRO  58           HB3      PRO  58  -2.778   1.602  -6.311
  409    HG2  PRO  58           HG3      PRO  58  -1.643  -1.053  -6.898
  410    HG3  PRO  58           HG2      PRO  58  -3.060  -0.616  -5.942
  411    HD2  PRO  58           HD3      PRO  58  -3.133  -1.658  -8.521
  412    HD3  PRO  58           HD2      PRO  58  -4.459  -0.771  -7.745
  413    H    ARG  59           H        ARG  59  -0.238   2.750  -7.823
  414    HA   ARG  59           HA       ARG  59   1.743   1.248  -9.284
  415    HB2  ARG  59           HB3      ARG  59   0.311   3.298 -10.738
  416    HB3  ARG  59           HB2      ARG  59   2.009   3.746 -10.569
  417    HG2  ARG  59           HG3      ARG  59   2.731   1.646 -11.526
  418    HG3  ARG  59           HG2      ARG  59   1.079   1.030 -11.536
  419    HD2  ARG  59           HD3      ARG  59   0.413   2.763 -13.139
  420    HD3  ARG  59           HD2      ARG  59   2.041   3.441 -13.101
  421    HE   ARG  59           HE       ARG  59   1.217   1.044 -14.552
  422   HH11  ARG  59          HH22      ARG  59   3.760   2.773 -12.997
  423   HH12  ARG  59          HH21      ARG  59   5.017   2.024 -13.924
  424   HH21  ARG  59          HH11      ARG  59   2.842   0.054 -15.773
  425   HH22  ARG  59          HH12      ARG  59   4.497   0.484 -15.496
  426    H    ALA  60           H        ALA  60   0.714   3.887  -7.324
  427    HA   ALA  60           HA       ALA  60   3.519   4.277  -6.415
  428    HB1  ALA  60           HB1      ALA  60   3.484   6.382  -7.232
  429    HB2  ALA  60           HB2      ALA  60   2.236   6.741  -6.040
  430    HB3  ALA  60           HB3      ALA  60   1.781   6.241  -7.668
  431    H    TRP  61           H        TRP  61   3.701   4.608  -4.197
  432    HA   TRP  61           HA       TRP  61   1.229   4.847  -2.566
  433    HB2  TRP  61           HB3      TRP  61   1.534   2.867  -1.357
  434    HB3  TRP  61           HB2      TRP  61   1.971   2.356  -2.986
  435    HD1  TRP  61           HD1      TRP  61   4.643   2.290  -3.549
  436    HE1  TRP  61           HE1      TRP  61   6.639   1.755  -2.006
  437    HE3  TRP  61           HE3      TRP  61   2.450   3.002   1.000
  438    HZ2  TRP  61           HZ2      TRP  61   7.223   1.646   0.795
  439    HZ3  TRP  61           HZ3      TRP  61   3.746   2.677   3.087
  440    HH2  TRP  61           HH2      TRP  61   6.126   2.001   2.992
  441    H    ARG  62           H        ARG  62   1.770   5.603  -0.358
  442    HA   ARG  62           HA       ARG  62   4.590   6.172   0.204
  443    HB2  ARG  62           HB3      ARG  62   3.786   8.690   0.582
  444    HB3  ARG  62           HB2      ARG  62   4.451   8.136  -0.944
  445    HG2  ARG  62           HG3      ARG  62   2.206   7.755  -1.834
  446    HG3  ARG  62           HG2      ARG  62   1.493   8.199  -0.282
  447    HD2  ARG  62           HD3      ARG  62   3.232  10.317  -0.993
  448    HD3  ARG  62           HD2      ARG  62   2.323   9.915  -2.449
  449    HE   ARG  62           HE       ARG  62   0.343  10.659  -1.370
  450   HH11  ARG  62          HH22      ARG  62   3.011  10.337   0.794
  451   HH12  ARG  62          HH21      ARG  62   2.214  11.145   2.104
  452   HH21  ARG  62          HH11      ARG  62  -0.708  11.714   0.327
  453   HH22  ARG  62          HH12      ARG  62   0.110  11.923   1.840
  454    HA   PRO  63           HA       PRO  63   2.615   5.493   4.257
  455    HB2  PRO  63           HB2      PRO  63   5.066   6.585   5.451
  456    HB3  PRO  63           HB3      PRO  63   4.351   4.976   5.632
  457    HG2  PRO  63           HG3      PRO  63   6.623   5.522   4.218
  458    HG3  PRO  63           HG2      PRO  63   5.591   4.107   3.970
  459    HD2  PRO  63           HD3      PRO  63   5.920   6.495   2.267
  460    HD3  PRO  63           HD2      PRO  63   5.307   4.878   1.861
  461    H    THR  64           H        THR  64   1.371   6.920   5.488
  462    HA   THR  64           HA       THR  64   2.011   9.827   5.235
  463    HB   THR  64           HB       THR  64  -0.522   9.754   6.243
  464    HG1  THR  64           HG1      THR  64   0.043   7.321   5.047
  465   HG21  THR  64          HG21      THR  64   0.240  10.989   4.239
  466   HG22  THR  64          HG22      THR  64  -1.276  10.140   3.932
  467   HG23  THR  64          HG23      THR  64   0.243   9.482   3.321
  468    HA   PRO  65           HA       PRO  65   2.965  10.089   9.537
  469    HB2  PRO  65           HB2      PRO  65   1.601  12.392  10.287
  470    HB3  PRO  65           HB3      PRO  65   3.169  12.363   9.461
  471    HG2  PRO  65           HG3      PRO  65   0.451  12.811   8.348
  472    HG3  PRO  65           HG2      PRO  65   1.994  13.564   7.911
  473    HD2  PRO  65           HD3      PRO  65   0.860  11.622   6.394
  474    HD3  PRO  65           HD2      PRO  65   2.621  11.805   6.532
  475    H    ALA  66           H        ALA  66   0.592   8.452   8.873
  476    HA   ALA  66           HA       ALA  66  -0.408   7.932  11.451
  477    HB1  ALA  66           HB1      ALA  66  -1.869  10.067   9.963
  478    HB2  ALA  66           HB2      ALA  66  -1.650   9.859  11.699
  479    HB3  ALA  66           HB3      ALA  66  -2.838   8.884  10.838
  480    H    GLY  67           H        GLY  67   0.205   6.883   8.627
  481    HA2  GLY  67           HA3      GLY  67  -1.030   4.487   8.564
  482    HA3  GLY  67           HA2      GLY  67  -2.311   5.512   7.946
  483    H    ILE  68           H        ILE  68  -1.816   3.893   6.050
  484    HA   ILE  68           HA       ILE  68   0.337   5.056   4.325
  485    HB   ILE  68           HB       ILE  68  -0.794   2.258   4.500
  486   HG12  ILE  68          HG13      ILE  68   2.070   3.235   4.595
  487   HG13  ILE  68          HG12      ILE  68   1.082   3.035   6.037
  488   HG21  ILE  68          HG21      ILE  68   1.077   2.000   2.613
  489   HG22  ILE  68          HG22      ILE  68   0.626   3.671   2.286
  490   HG23  ILE  68          HG23      ILE  68  -0.591   2.400   2.204
  491   HD11  ILE  68          HD11      ILE  68   2.389   1.011   5.710
  492   HD12  ILE  68          HD12      ILE  68   1.822   0.875   4.046
  493   HD13  ILE  68          HD13      ILE  68   0.693   0.649   5.383
  494    H    ALA  69           H        ALA  69  -0.187   5.492   2.153
  495    HA   ALA  69           HA       ALA  69  -3.079   5.235   1.411
  496    HB1  ALA  69           HB1      ALA  69  -1.612   7.577   0.350
  497    HB2  ALA  69           HB2      ALA  69  -1.951   7.623   2.080
  498    HB3  ALA  69           HB3      ALA  69  -3.275   7.455   0.926
  499    H    LEU  70           H        LEU  70  -3.454   5.017  -0.871
  500    HA   LEU  70           HA       LEU  70  -1.016   4.254  -2.445
  501    HB2  LEU  70           HB3      LEU  70  -3.785   3.088  -2.358
  502    HB3  LEU  70           HB2      LEU  70  -2.694   2.768  -3.698
  503    HG   LEU  70           HG       LEU  70  -1.597   2.398  -0.956
  504   HD11  LEU  70          HD11      LEU  70  -2.584   0.067  -0.918
  505   HD12  LEU  70          HD12      LEU  70  -3.672   0.580  -2.208
  506   HD13  LEU  70          HD13      LEU  70  -3.746   1.362  -0.629
  507   HD21  LEU  70          HD21      LEU  70  -1.458   0.503  -3.295
  508   HD22  LEU  70          HD22      LEU  70  -0.266   0.781  -2.026
  509   HD23  LEU  70          HD23      LEU  70  -0.501   1.983  -3.296
  510    H    LEU  71           H        LEU  71  -0.895   5.065  -4.561
  511    HA   LEU  71           HA       LEU  71  -3.028   7.030  -5.305
  512    HB2  LEU  71           HB3      LEU  71  -0.168   7.085  -6.280
  513    HB3  LEU  71           HB2      LEU  71  -1.357   8.385  -6.317
  514    HG   LEU  71           HG       LEU  71  -0.122   7.184  -3.817
  515   HD11  LEU  71          HD11      LEU  71   0.445   9.872  -3.849
  516   HD12  LEU  71          HD12      LEU  71   0.574   9.453  -5.557
  517   HD13  LEU  71          HD13      LEU  71   1.558   8.605  -4.365
  518   HD21  LEU  71          HD21      LEU  71  -1.303   9.450  -2.983
  519   HD22  LEU  71          HD22      LEU  71  -2.148   7.904  -2.996
  520   HD23  LEU  71          HD23      LEU  71  -2.392   9.054  -4.311
  521    H    GLU  72           H        GLU  72  -3.209   7.354  -7.721
  522    HA   GLU  72           HA       GLU  72  -3.050   4.707  -9.091
  523    HB2  GLU  72           HB3      GLU  72  -4.731   5.692 -10.659
  524    HB3  GLU  72           HB2      GLU  72  -5.300   5.614  -8.997
  525    HG2  GLU  72           HG3      GLU  72  -4.550   8.008  -8.714
  526    HG3  GLU  72           HG2      GLU  72  -4.237   8.047 -10.450
  527    H    ARG  73           H        ARG  73  -0.995   7.086  -8.825
  528    HA   ARG  73           HA       ARG  73   0.821   7.648 -10.216
  529    HB2  ARG  73           HB3      ARG  73  -0.109   5.520 -11.585
  530    HB3  ARG  73           HB2      ARG  73  -0.528   6.796 -12.727
  531    HG2  ARG  73           HG3      ARG  73   1.910   7.631 -12.317
  532    HG3  ARG  73           HG2      ARG  73   2.187   6.000 -11.705
  533    HD2  ARG  73           HD3      ARG  73   2.659   5.626 -13.928
  534    HD3  ARG  73           HD2      ARG  73   0.917   5.354 -13.971
  535    HE   ARG  73           HE       ARG  73   0.731   7.289 -15.296
  536   HH11  ARG  73          HH22      ARG  73   3.656   7.266 -13.469
  537   HH12  ARG  73          HH21      ARG  73   4.272   8.715 -14.189
  538   HH21  ARG  73          HH11      ARG  73   1.521   9.182 -16.246
  539   HH22  ARG  73          HH12      ARG  73   3.064   9.800 -15.760
  540    H    GLY  74           H        GLY  74  -1.453   9.321  -9.561
  541    HA2  GLY  74           HA3      GLY  74  -1.117  11.315 -11.714
  542    HA3  GLY  74           HA2      GLY  74  -2.770  10.803 -11.376
  543    H    GLY  75           H        GLY  75  -1.380  10.492  -8.476
  544    HA2  GLY  75           HA3      GLY  75  -0.812  12.122  -6.753
  545    HA3  GLY  75           HA2      GLY  75  -1.595  13.370  -7.720
  546    H    LEU  76           H        LEU  76  -3.666  10.907  -8.047
  547    HA   LEU  76           HA       LEU  76  -5.416  11.944  -5.910
  548    HB2  LEU  76           HB3      LEU  76  -5.804  10.817  -8.505
  549    HB3  LEU  76           HB2      LEU  76  -6.613   9.770  -7.339
  550    HG   LEU  76           HG       LEU  76  -6.956  12.779  -7.471
  551   HD11  LEU  76          HD11      LEU  76  -7.886  11.429  -9.428
  552   HD12  LEU  76          HD12      LEU  76  -9.064  12.388  -8.531
  553   HD13  LEU  76          HD13      LEU  76  -8.953  10.647  -8.262
  554   HD21  LEU  76          HD21      LEU  76  -7.933  12.543  -5.455
  555   HD22  LEU  76          HD22      LEU  76  -7.551  10.821  -5.466
  556   HD23  LEU  76          HD23      LEU  76  -9.073  11.391  -6.148
  557    H    THR  77           H        THR  77  -6.133  10.697  -4.159
  558    HA   THR  77           HA       THR  77  -4.496   8.303  -3.574
  559    HB   THR  77           HB       THR  77  -6.569   9.316  -1.679
  560    HG1  THR  77           HG1      THR  77  -4.794  10.854  -1.059
  561   HG21  THR  77          HG21      THR  77  -5.127   8.493  -0.067
  562   HG22  THR  77          HG22      THR  77  -3.693   8.794  -1.047
  563   HG23  THR  77          HG23      THR  77  -4.739   7.422  -1.412
  564    H    LEU  78           H        LEU  78  -5.328   6.239  -3.559
  565    HA   LEU  78           HA       LEU  78  -8.138   5.924  -4.456
  566    HB2  LEU  78           HB3      LEU  78  -5.984   3.821  -4.147
  567    HB3  LEU  78           HB2      LEU  78  -7.529   3.614  -4.949
  568    HG   LEU  78           HG       LEU  78  -5.600   5.742  -5.862
  569   HD11  LEU  78          HD11      LEU  78  -4.153   4.020  -6.276
  570   HD12  LEU  78          HD12      LEU  78  -5.218   3.726  -7.649
  571   HD13  LEU  78          HD13      LEU  78  -5.416   2.797  -6.167
  572   HD21  LEU  78          HD21      LEU  78  -8.200   5.056  -6.597
  573   HD22  LEU  78          HD22      LEU  78  -7.208   4.263  -7.818
  574   HD23  LEU  78          HD23      LEU  78  -7.080   6.004  -7.563
  575    H    MET  79           H        MET  79  -5.972   4.732  -1.874
  576    HA   MET  79           HA       MET  79  -8.369   4.399  -0.156
  577    HB2  MET  79           HB3      MET  79  -7.749   2.256  -1.476
  578    HB3  MET  79           HB2      MET  79  -6.395   2.136  -0.367
  579    HG2  MET  79           HG3      MET  79  -8.082   0.881   0.698
  580    HG3  MET  79           HG2      MET  79  -8.182   2.448   1.500
  581    HE1  MET  79           HE1      MET  79  -9.959   3.964   1.511
  582    HE2  MET  79           HE2      MET  79 -10.678   2.543   2.283
  583    HE3  MET  79           HE3      MET  79 -11.617   3.501   1.141
  584    H    LEU  80           H        LEU  80  -7.946   4.870   1.945
  585    HA   LEU  80           HA       LEU  80  -5.134   5.524   2.657
  586    HB2  LEU  80           HB3      LEU  80  -6.865   7.286   2.967
  587    HB3  LEU  80           HB2      LEU  80  -7.728   6.220   4.072
  588    HG   LEU  80           HG       LEU  80  -5.747   6.170   5.564
  589   HD11  LEU  80          HD11      LEU  80  -4.598   7.740   3.300
  590   HD12  LEU  80          HD12      LEU  80  -3.821   6.565   4.362
  591   HD13  LEU  80          HD13      LEU  80  -4.121   8.207   4.933
  592   HD21  LEU  80          HD21      LEU  80  -7.353   7.806   6.161
  593   HD22  LEU  80          HD22      LEU  80  -6.941   8.831   4.787
  594   HD23  LEU  80          HD23      LEU  80  -5.823   8.683   6.143
  595    H    LEU  81           H        LEU  81  -4.431   3.366   3.101
  596    HA   LEU  81           HA       LEU  81  -5.870   1.665   4.972
  597    HB2  LEU  81           HB3      LEU  81  -3.409   1.533   3.365
  598    HB3  LEU  81           HB2      LEU  81  -3.248   0.761   4.934
  599    HG   LEU  81           HG       LEU  81  -5.333  -0.534   4.475
  600   HD11  LEU  81          HD11      LEU  81  -5.541   1.380   2.362
  601   HD12  LEU  81          HD12      LEU  81  -6.687   0.114   2.801
  602   HD13  LEU  81          HD13      LEU  81  -5.407  -0.220   1.635
  603   HD21  LEU  81          HD21      LEU  81  -3.770  -2.028   3.826
  604   HD22  LEU  81          HD22      LEU  81  -2.772  -0.764   3.107
  605   HD23  LEU  81          HD23      LEU  81  -4.073  -1.501   2.171
  606    H    GLY  82           H        GLY  82  -5.896   2.003   7.161
  607    HA2  GLY  82           HA3      GLY  82  -3.863   3.835   8.313
  608    HA3  GLY  82           HA2      GLY  82  -5.402   3.427   9.050
  609    H    ARG  83           H        ARG  83  -2.414   3.221   9.836
  610    HA   ARG  83           HA       ARG  83  -1.865   0.425  10.292
  611    HB2  ARG  83           HB3      ARG  83  -0.268   2.484  10.377
  612    HB3  ARG  83           HB2      ARG  83  -0.825   2.643  12.030
  613    HG2  ARG  83           HG3      ARG  83  -0.277   0.033  12.083
  614    HG3  ARG  83           HG2      ARG  83   0.812   0.481  10.770
  615    HD2  ARG  83           HD3      ARG  83   2.207   0.837  12.585
  616    HD3  ARG  83           HD2      ARG  83   1.481   2.437  12.434
  617    HE   ARG  83           HE       ARG  83  -0.075   0.733  14.184
  618   HH11  ARG  83          HH22      ARG  83   2.753   2.684  13.891
  619   HH12  ARG  83          HH21      ARG  83   2.822   3.072  15.577
  620   HH21  ARG  83          HH11      ARG  83  -0.000   1.230  16.389
  621   HH22  ARG  83          HH12      ARG  83   1.263   2.250  16.991
  622    H    GLN  84           H        GLN  84  -2.953  -0.886  11.763
  623    HA   GLN  84           HA       GLN  84  -4.428   0.456  13.979
  624    HB2  GLN  84           HB3      GLN  84  -4.712  -2.216  12.603
  625    HB3  GLN  84           HB2      GLN  84  -5.488  -1.885  14.151
  626    HG2  GLN  84           HG3      GLN  84  -5.820  -0.029  11.793
  627    HG3  GLN  84           HG2      GLN  84  -6.876  -1.423  12.029
  628   HE21  GLN  84          HE22      GLN  84  -6.128   1.798  13.177
  629   HE22  GLN  84          HE21      GLN  84  -7.348   1.874  14.355
  630    H    GLY  85           H        GLY  85  -1.936  -1.911  13.249
  631    HA2  GLY  85           HA3      GLY  85  -1.501  -2.358  16.180
  632    HA3  GLY  85           HA2      GLY  85  -0.982  -3.471  14.914
  633    H    GLU  86           H        GLU  86   1.074  -3.224  14.086
  634    HA   GLU  86           HA       GLU  86   2.432  -0.617  14.409
  635    HB2  GLU  86           HB3      GLU  86   2.933  -2.375  16.322
  636    HB3  GLU  86           HB2      GLU  86   3.951  -3.113  15.084
  637    HG2  GLU  86           HG3      GLU  86   4.795  -0.618  14.766
  638    HG3  GLU  86           HG2      GLU  86   4.229  -0.453  16.429
  639    H    GLY  87           H        GLY  87   1.638  -3.324  12.703
  640    HA2  GLY  87           HA3      GLY  87   3.197  -2.496  10.367
  641    HA3  GLY  87           HA2      GLY  87   3.640  -4.082  10.993
  642    H    ASP  88           H        ASP  88   0.412  -3.390  11.633
  643    HA   ASP  88           HA       ASP  88  -0.495  -4.923   9.228
  644    HB2  ASP  88           HB3      ASP  88  -1.547  -4.962  12.078
  645    HB3  ASP  88           HB2      ASP  88  -2.342  -5.753  10.714
  646    H    TYR  89           H        TYR  89  -1.451  -3.423   7.930
  647    HA   TYR  89           HA       TYR  89  -2.985  -1.215   9.194
  648    HB2  TYR  89           HB3      TYR  89  -2.134  -1.541   6.317
  649    HB3  TYR  89           HB2      TYR  89  -2.886  -0.135   7.008
  650    HD1  TYR  89           HD1      TYR  89   0.118  -2.352   7.618
  651    HD2  TYR  89           HD2      TYR  89  -1.522   1.629   7.665
  652    HE1  TYR  89           HE1      TYR  89   2.328  -1.442   8.238
  653    HE2  TYR  89           HE2      TYR  89   0.704   2.527   8.279
  654    HH   TYR  89           HH       TYR  89   3.355   0.432   9.154
  655    H    ARG  90           H        ARG  90  -5.143  -1.044   8.918
  656    HA   ARG  90           HA       ARG  90  -6.479  -2.974   7.082
  657    HB2  ARG  90           HB3      ARG  90  -7.878  -2.384   9.625
  658    HB3  ARG  90           HB2      ARG  90  -7.748  -3.905   8.742
  659    HG2  ARG  90           HG3      ARG  90  -5.388  -4.119   9.524
  660    HG3  ARG  90           HG2      ARG  90  -5.600  -2.654  10.479
  661    HD2  ARG  90           HD3      ARG  90  -5.928  -4.704  11.836
  662    HD3  ARG  90           HD2      ARG  90  -7.381  -3.707  11.774
  663    HE   ARG  90           HE       ARG  90  -7.796  -5.447   9.702
  664   HH11  ARG  90          HH22      ARG  90  -6.781  -5.813  12.980
  665   HH12  ARG  90          HH21      ARG  90  -7.466  -7.393  13.153
  666   HH21  ARG  90          HH11      ARG  90  -8.694  -7.511   9.915
  667   HH22  ARG  90          HH12      ARG  90  -8.548  -8.354  11.420
  668    H    VAL  91           H        VAL  91  -8.673  -2.283   6.494
  669    HA   VAL  91           HA       VAL  91  -9.312   0.555   7.066
  670    HB   VAL  91           HB       VAL  91  -7.905   0.096   4.840
  671   HG11  VAL  91          HG11      VAL  91 -10.731  -0.186   3.806
  672   HG12  VAL  91          HG12      VAL  91  -9.719  -1.594   4.130
  673   HG13  VAL  91          HG13      VAL  91  -9.216  -0.404   2.932
  674   HG21  VAL  91          HG21      VAL  91 -10.363   1.873   4.974
  675   HG22  VAL  91          HG22      VAL  91  -9.013   2.075   3.855
  676   HG23  VAL  91          HG23      VAL  91  -8.760   2.284   5.587
  677    H    GLN  92           H        GLN  92 -11.543   0.982   6.947
  678    HA   GLN  92           HA       GLN  92 -13.270  -1.341   7.162
  679    HB2  GLN  92           HB3      GLN  92 -13.696   1.639   7.240
  680    HB3  GLN  92           HB2      GLN  92 -15.076   0.544   7.167
  681    HG2  GLN  92           HG3      GLN  92 -12.869   0.258   9.218
  682    HG3  GLN  92           HG2      GLN  92 -14.330   1.203   9.511
  683   HE21  GLN  92          HE22      GLN  92 -13.218  -1.612  10.474
  684   HE22  GLN  92          HE21      GLN  92 -14.591  -2.601  10.351
  685    H    LYS  93           H        LYS  93 -13.979  -2.439   5.402
  686    HA   LYS  93           HA       LYS  93 -14.196  -1.021   2.804
  687    HB2  LYS  93           HB3      LYS  93 -13.116  -3.389   3.243
  688    HB3  LYS  93           HB2      LYS  93 -14.790  -3.940   3.169
  689    HG2  LYS  93           HG3      LYS  93 -15.035  -2.813   0.963
  690    HG3  LYS  93           HG2      LYS  93 -13.331  -2.360   1.030
  691    HD2  LYS  93           HD3      LYS  93 -13.056  -4.330  -0.102
  692    HD3  LYS  93           HD2      LYS  93 -13.126  -5.017   1.521
  693    HE2  LYS  93           HE3      LYS  93 -14.672  -6.236   0.097
  694    HE3  LYS  93           HE2      LYS  93 -15.602  -5.277   1.248
  695    HZ1  LYS  93           HZ1      LYS  93 -15.427  -3.523  -0.685
  696    HZ2  LYS  93           HZ2      LYS  93 -16.648  -4.700  -0.664
  697    HZ3  LYS  93           HZ3      LYS  93 -15.273  -4.923  -1.636
  698    H    GLY  94           H        GLY  94 -16.116  -0.079   4.467
  699    HA2  GLY  94           HA3      GLY  94 -18.443   0.355   4.238
  700    HA3  GLY  94           HA2      GLY  94 -18.573  -1.051   3.180
  701    H    ASP  95           H        ASP  95 -18.689  -3.171   4.172
  702    HA   ASP  95           HA       ASP  95 -18.737  -3.558   7.017
  703    HB2  ASP  95           HB3      ASP  95 -21.268  -2.757   5.679
  704    HB3  ASP  95           HB2      ASP  95 -21.375  -4.111   6.805
  705    H    GLY  96           H        GLY  96 -17.424  -5.294   5.985
  706    HA2  GLY  96           HA3      GLY  96 -18.204  -7.822   6.119
  707    HA3  GLY  96           HA2      GLY  96 -19.013  -7.397   4.611
  708    H    GLY  97           H        GLY  97 -15.758  -7.110   6.093
  709    HA2  GLY  97           HA3      GLY  97 -14.189  -8.609   4.530
  710    HA3  GLY  97           HA2      GLY  97 -14.562  -7.317   3.389
  711    H    GLN  98           H        GLN  98 -12.723  -8.232   6.160
  712    HA   GLN  98           HA       GLN  98 -11.689  -5.468   6.506
  713    HB2  GLN  98           HB3      GLN  98 -12.347  -7.223   8.414
  714    HB3  GLN  98           HB2      GLN  98 -10.688  -7.754   8.144
  715    HG2  GLN  98           HG3      GLN  98  -9.892  -5.437   8.452
  716    HG3  GLN  98           HG2      GLN  98 -11.551  -4.922   8.773
  717   HE21  GLN  98          HE22      GLN  98  -9.907  -4.403  10.857
  718   HE22  GLN  98          HE21      GLN  98 -10.082  -5.540  12.106
  719    H    LEU  99           H        LEU  99  -9.982  -4.936   5.303
  720    HA   LEU  99           HA       LEU  99  -8.258  -7.034   4.165
  721    HB2  LEU  99           HB3      LEU  99  -7.629  -4.135   3.857
  722    HB3  LEU  99           HB2      LEU  99  -7.541  -5.431   2.671
  723    HG   LEU  99           HG       LEU  99 -10.052  -4.103   3.700
  724   HD11  LEU  99          HD11      LEU  99  -8.285  -3.442   1.603
  725   HD12  LEU  99          HD12      LEU  99  -9.892  -2.776   1.890
  726   HD13  LEU  99          HD13      LEU  99  -9.692  -4.176   0.836
  727   HD21  LEU  99          HD21      LEU  99 -10.865  -5.643   1.628
  728   HD22  LEU  99          HD22      LEU  99 -10.904  -6.196   3.303
  729   HD23  LEU  99          HD23      LEU  99  -9.560  -6.652   2.254
  730    H    VAL 100           H        VAL 100  -6.023  -7.203   4.651
  731    HA   VAL 100           HA       VAL 100  -4.999  -5.536   6.890
  732    HB   VAL 100           HB       VAL 100  -5.352  -8.522   6.891
  733   HG11  VAL 100          HG11      VAL 100  -3.048  -8.445   7.361
  734   HG12  VAL 100          HG12      VAL 100  -3.777  -8.364   8.965
  735   HG13  VAL 100          HG13      VAL 100  -3.177  -6.896   8.195
  736   HG21  VAL 100          HG21      VAL 100  -6.224  -8.106   9.105
  737   HG22  VAL 100          HG22      VAL 100  -6.963  -6.930   8.021
  738   HG23  VAL 100          HG23      VAL 100  -5.640  -6.443   9.079
  739    H    LEU 101           H        LEU 101  -3.214  -4.641   5.896
  740    HA   LEU 101           HA       LEU 101  -1.574  -6.276   4.043
  741    HB2  LEU 101           HB3      LEU 101  -2.179  -3.879   3.525
  742    HB3  LEU 101           HB2      LEU 101  -1.233  -3.414   4.920
  743    HG   LEU 101           HG       LEU 101   0.363  -5.161   3.338
  744   HD11  LEU 101          HD11      LEU 101   0.531  -3.697   1.311
  745   HD12  LEU 101          HD12      LEU 101  -0.892  -2.819   1.876
  746   HD13  LEU 101          HD13      LEU 101  -1.023  -4.522   1.433
  747   HD21  LEU 101          HD21      LEU 101   0.558  -2.167   3.783
  748   HD22  LEU 101          HD22      LEU 101   1.882  -3.256   3.370
  749   HD23  LEU 101          HD23      LEU 101   1.099  -3.378   4.945
  750    H    ARG 102           H        ARG 102   0.134  -7.463   4.945
  751    HA   ARG 102           HA       ARG 102   1.647  -6.193   7.166
  752    HB2  ARG 102           HB3      ARG 102  -0.001  -7.847   8.106
  753    HB3  ARG 102           HB2      ARG 102   0.780  -9.099   7.140
  754    HG2  ARG 102           HG3      ARG 102   2.843  -7.698   8.503
  755    HG3  ARG 102           HG2      ARG 102   1.587  -8.052   9.690
  756    HD2  ARG 102           HD3      ARG 102   2.926 -10.048   7.843
  757    HD3  ARG 102           HD2      ARG 102   3.146  -9.926   9.588
  758    HE   ARG 102           HE       ARG 102   0.437 -10.295   9.357
  759   HH11  ARG 102          HH22      ARG 102   3.220 -11.843   8.035
  760   HH12  ARG 102          HH21      ARG 102   2.470 -13.400   7.934
  761   HH21  ARG 102          HH11      ARG 102  -0.560 -12.318   9.229
  762   HH22  ARG 102          HH12      ARG 102   0.329 -13.669   8.610
  763    H    ARG 103           H        ARG 103   3.781  -6.430   6.946
  764    HA   ARG 103           HA       ARG 103   5.086  -6.989   4.610
  765    HB2  ARG 103           HB3      ARG 103   7.104  -7.431   5.957
  766    HB3  ARG 103           HB2      ARG 103   6.207  -6.051   6.575
  767    HG2  ARG 103           HG3      ARG 103   5.068  -8.182   7.927
  768    HG3  ARG 103           HG2      ARG 103   6.773  -8.629   7.851
  769    HD2  ARG 103           HD3      ARG 103   7.292  -6.261   8.652
  770    HD3  ARG 103           HD2      ARG 103   5.570  -6.104   9.004
  771    HE   ARG 103           HE       ARG 103   6.224  -8.424  10.311
  772   HH11  ARG 103          HH22      ARG 103   7.602  -5.267  10.141
  773   HH12  ARG 103          HH21      ARG 103   8.239  -5.313  11.750
  774   HH21  ARG 103          HH11      ARG 103   7.049  -8.503  12.414
  775   HH22  ARG 103          HH12      ARG 103   7.927  -7.146  13.038
  776    H    ALA 104           H        ALA 104   5.731  -8.788   3.477
  777    HA   ALA 104           HA       ALA 104   4.482 -11.318   4.037
  778    HB1  ALA 104           HB1      ALA 104   5.736 -10.146   1.850
  779    HB2  ALA 104           HB2      ALA 104   5.134 -11.802   1.923
  780    HB3  ALA 104           HB3      ALA 104   6.825 -11.461   2.289
  781    H    THR 105           H        THR 105   5.402 -13.234   4.864
  782    HA   THR 105           HA       THR 105   7.584 -12.864   6.749
  783    HB   THR 105           HB       THR 105   6.477 -14.594   7.685
  784    HG1  THR 105           HG1      THR 105   7.584 -16.285   7.193
  785   HG21  THR 105          HG21      THR 105   4.541 -14.057   6.282
  786   HG22  THR 105          HG22      THR 105   4.689 -15.804   6.463
  787   HG23  THR 105          HG23      THR 105   5.206 -15.027   4.966
  788    HA   PRO 106           HA       PRO 106  10.998 -14.087   4.240
  789    HB2  PRO 106           HB2      PRO 106  12.435 -15.713   5.921
  790    HB3  PRO 106           HB3      PRO 106  12.376 -13.948   6.074
  791    HG2  PRO 106           HG3      PRO 106  10.912 -16.030   7.607
  792    HG3  PRO 106           HG2      PRO 106  11.609 -14.498   8.160
  793    HD2  PRO 106           HD3      PRO 106   8.930 -14.834   7.694
  794    HD3  PRO 106           HD2      PRO 106   9.758 -13.271   7.524
  Start of MODEL   15
    1    H1   SER   1           H        SER   1  13.278  18.982  -6.928
    2    H2   SER   1           H2       SER   1  14.183  19.154  -8.355
    3    H3   SER   1           1HT      SER   1  12.563  18.646  -8.428
    4    HA   SER   1           HA       SER   1  13.971  16.752  -8.761
    5    HB2  SER   1           HB3      SER   1  15.243  17.786  -6.227
    6    HB3  SER   1           HB2      SER   1  15.423  16.107  -6.725
    7    HG   SER   1           HG       SER   1  16.686  18.295  -7.630
    8    H    SER   2           H        SER   2  14.089  16.217  -5.415
    9    HA   SER   2           HA       SER   2  11.231  15.495  -5.192
   10    HB2  SER   2           HB3      SER   2  12.170  13.485  -6.190
   11    HB3  SER   2           HB2      SER   2  13.486  13.473  -5.018
   12    HG   SER   2           HG       SER   2  12.195  12.540  -3.653
   13    H    LEU   3           H        LEU   3  11.556  17.280  -3.586
   14    HA   LEU   3           HA       LEU   3  13.128  16.536  -1.191
   15    HB2  LEU   3           HB3      LEU   3  12.021  19.017  -2.329
   16    HB3  LEU   3           HB2      LEU   3  11.837  18.897  -0.581
   17    HG   LEU   3           HG       LEU   3  13.991  19.978  -1.312
   18   HD11  LEU   3          HD11      LEU   3  14.728  19.259   0.684
   19   HD12  LEU   3          HD12      LEU   3  15.185  17.716  -0.037
   20   HD13  LEU   3          HD13      LEU   3  13.570  17.929   0.636
   21   HD21  LEU   3          HD21      LEU   3  14.051  17.978  -3.186
   22   HD22  LEU   3          HD22      LEU   3  15.180  17.358  -1.979
   23   HD23  LEU   3          HD23      LEU   3  15.452  18.939  -2.715
   24    H    ILE   4           H        ILE   4  10.401  15.377  -2.199
   25    HA   ILE   4           HA       ILE   4   8.682  15.999   0.122
   26    HB   ILE   4           HB       ILE   4   8.221  14.054  -2.160
   27   HG12  ILE   4          HG13      ILE   4   6.556  16.247  -2.502
   28   HG13  ILE   4          HG12      ILE   4   8.075  16.979  -1.984
   29   HG21  ILE   4          HG21      ILE   4   6.784  13.541  -0.303
   30   HG22  ILE   4          HG22      ILE   4   5.810  14.446  -1.462
   31   HG23  ILE   4          HG23      ILE   4   6.438  15.247  -0.022
   32   HD11  ILE   4          HD11      ILE   4   8.025  16.741  -4.433
   33   HD12  ILE   4          HD12      ILE   4   7.753  15.007  -4.264
   34   HD13  ILE   4          HD13      ILE   4   9.278  15.715  -3.735
   35    H    LEU   5           H        LEU   5   9.103  14.916   1.981
   36    HA   LEU   5           HA       LEU   5   9.815  13.200   3.424
   37    HB2  LEU   5           HB3      LEU   5   7.968  12.064   1.431
   38    HB3  LEU   5           HB2      LEU   5   9.007  10.863   2.197
   39    HG   LEU   5           HG       LEU   5   6.840  11.265   3.415
   40   HD11  LEU   5          HD11      LEU   5   9.497  11.123   4.458
   41   HD12  LEU   5          HD12      LEU   5   8.005  10.546   5.197
   42   HD13  LEU   5          HD13      LEU   5   8.561  12.190   5.504
   43   HD21  LEU   5          HD21      LEU   5   6.211  13.337   4.115
   44   HD22  LEU   5          HD22      LEU   5   7.346  13.910   2.893
   45   HD23  LEU   5          HD23      LEU   5   7.854  13.781   4.577
   46    H    LEU   6           H        LEU   6  11.453  13.889   0.833
   47    HA   LEU   6           HA       LEU   6  13.391  13.068  -0.226
   48    HB2  LEU   6           HB3      LEU   6  13.867  11.594   2.366
   49    HB3  LEU   6           HB2      LEU   6  15.058  12.320   1.286
   50    HG   LEU   6           HG       LEU   6  13.059  13.769   3.042
   51   HD11  LEU   6          HD11      LEU   6  15.688  12.865   3.484
   52   HD12  LEU   6          HD12      LEU   6  14.786  14.018   4.468
   53   HD13  LEU   6          HD13      LEU   6  15.836  14.595   3.174
   54   HD21  LEU   6          HD21      LEU   6  14.782  14.703   0.750
   55   HD22  LEU   6          HD22      LEU   6  14.366  15.804   2.064
   56   HD23  LEU   6          HD23      LEU   6  13.091  15.078   1.084
   57    H    SER   7           H        SER   7  14.761  10.628   0.110
   58    HA   SER   7           HA       SER   7  12.818   8.789  -1.171
   59    HB2  SER   7           HB3      SER   7  15.814   8.973  -1.072
   60    HB3  SER   7           HB2      SER   7  15.049   7.444  -1.493
   61    HG   SER   7           HG       SER   7  14.296   8.306  -3.302
   62    H    ALA   8           H        ALA   8  11.683   7.833   0.531
   63    HA   ALA   8           HA       ALA   8  13.036   6.883   2.932
   64    HB1  ALA   8           HB1      ALA   8  10.591   7.616   2.764
   65    HB2  ALA   8           HB2      ALA   8  10.885   6.104   3.625
   66    HB3  ALA   8           HB3      ALA   8  10.285   6.073   1.967
   67    H    SER   9           H        SER   9  14.591   5.345   2.344
   68    HA   SER   9           HA       SER   9  13.737   3.053   0.667
   69    HB2  SER   9           HB3      SER   9  16.170   4.429   0.995
   70    HB3  SER   9           HB2      SER   9  16.425   2.846   1.721
   71    HG   SER   9           HG       SER   9  16.414   2.029  -0.209
   72    H    ASP  10           H        ASP  10  13.969   3.901   3.952
   73    HA   ASP  10           HA       ASP  10  14.563   1.213   4.942
   74    HB2  ASP  10           HB3      ASP  10  13.285   3.387   6.587
   75    HB3  ASP  10           HB2      ASP  10  14.428   2.143   7.093
   76    H    LEU  11           H        LEU  11  11.725   3.055   4.080
   77    HA   LEU  11           HA       LEU  11   9.879   1.266   5.488
   78    HB2  LEU  11           HB3      LEU  11   9.635   3.655   3.705
   79    HB3  LEU  11           HB2      LEU  11   8.241   2.582   3.849
   80    HG   LEU  11           HG       LEU  11   9.656   3.443   6.347
   81   HD11  LEU  11          HD11      LEU  11   9.383   5.593   5.456
   82   HD12  LEU  11          HD12      LEU  11   7.870   5.357   6.331
   83   HD13  LEU  11          HD13      LEU  11   7.918   5.151   4.579
   84   HD21  LEU  11          HD21      LEU  11   7.649   2.869   7.364
   85   HD22  LEU  11          HD22      LEU  11   7.615   1.777   5.977
   86   HD23  LEU  11          HD23      LEU  11   6.692   3.280   5.940
   87    H    ALA  12           H        ALA  12  11.823   0.382   3.237
   88    HA   ALA  12           HA       ALA  12   9.891  -0.658   1.250
   89    HB1  ALA  12           HB1      ALA  12  12.654   0.024   1.207
   90    HB2  ALA  12           HB2      ALA  12  11.665  -0.563  -0.131
   91    HB3  ALA  12           HB3      ALA  12  12.538  -1.707   0.892
   92    H    GLY  13           H        GLY  13  10.393  -3.092   0.637
   93    HA2  GLY  13           HA3      GLY  13  11.379  -5.128   2.036
   94    HA3  GLY  13           HA2      GLY  13  10.118  -4.630   3.160
   95    H    GLN  14           H        GLN  14   9.235  -6.828   2.747
   96    HA   GLN  14           HA       GLN  14   7.719  -6.972   0.168
   97    HB2  GLN  14           HB3      GLN  14   8.558  -9.212   2.041
   98    HB3  GLN  14           HB2      GLN  14   7.657  -9.412   0.537
   99    HG2  GLN  14           HG3      GLN  14   9.541  -8.462  -0.731
  100    HG3  GLN  14           HG2      GLN  14  10.445  -8.241   0.768
  101   HE21  GLN  14          HE22      GLN  14   9.043 -10.756  -1.359
  102   HE22  GLN  14          HE21      GLN  14  10.045 -12.010  -0.803
  103    H    TRP  15           H        TRP  15   5.466  -7.407   0.356
  104    HA   TRP  15           HA       TRP  15   4.356  -7.699   3.085
  105    HB2  TRP  15           HB3      TRP  15   3.513  -5.475   1.210
  106    HB3  TRP  15           HB2      TRP  15   2.786  -5.838   2.765
  107    HD1  TRP  15           HD1      TRP  15   6.279  -4.835   1.365
  108    HE1  TRP  15           HE1      TRP  15   7.431  -3.365   3.135
  109    HE3  TRP  15           HE3      TRP  15   2.777  -5.008   5.083
  110    HZ2  TRP  15           HZ2      TRP  15   6.938  -2.381   5.775
  111    HZ3  TRP  15           HZ3      TRP  15   3.141  -3.789   7.208
  112    HH2  TRP  15           HH2      TRP  15   5.216  -2.478   7.560
  113    H    THR  16           H        THR  16   1.864  -7.905   2.872
  114    HA   THR  16           HA       THR  16   1.044  -9.093   0.271
  115    HB   THR  16           HB       THR  16   0.137 -11.092   1.532
  116    HG1  THR  16           HG1      THR  16   1.714  -9.882   3.533
  117   HG21  THR  16          HG21      THR  16   2.230 -11.187   0.195
  118   HG22  THR  16          HG22      THR  16   2.280 -12.271   1.584
  119   HG23  THR  16          HG23      THR  16   3.144 -10.735   1.632
  120    H    LEU  17           H        LEU  17  -1.357  -9.510   0.283
  121    HA   LEU  17           HA       LEU  17  -2.757  -7.611   2.139
  122    HB2  LEU  17           HB3      LEU  17  -2.749  -7.751  -0.688
  123    HB3  LEU  17           HB2      LEU  17  -4.325  -8.346  -0.170
  124    HG   LEU  17           HG       LEU  17  -4.561  -6.321   1.282
  125   HD11  LEU  17          HD11      LEU  17  -2.642  -4.665  -0.056
  126   HD12  LEU  17          HD12      LEU  17  -1.801  -6.054   0.633
  127   HD13  LEU  17          HD13      LEU  17  -2.775  -5.012   1.669
  128   HD21  LEU  17          HD21      LEU  17  -5.727  -5.684  -0.549
  129   HD22  LEU  17          HD22      LEU  17  -4.559  -6.441  -1.631
  130   HD23  LEU  17          HD23      LEU  17  -4.288  -4.798  -1.050
  131    H    GLN  18           H        GLN  18  -4.892  -8.298   2.886
  132    HA   GLN  18           HA       GLN  18  -5.554 -11.159   2.472
  133    HB2  GLN  18           HB3      GLN  18  -4.173 -10.301   4.746
  134    HB3  GLN  18           HB2      GLN  18  -5.855 -10.396   5.270
  135    HG2  GLN  18           HG3      GLN  18  -4.929 -12.571   5.633
  136    HG3  GLN  18           HG2      GLN  18  -5.927 -12.704   4.185
  137   HE21  GLN  18          HE22      GLN  18  -2.680 -12.979   5.411
  138   HE22  GLN  18          HE21      GLN  18  -1.933 -13.339   3.931
  139    H    GLN  19           H        GLN  19  -7.647 -11.092   1.840
  140    HA   GLN  19           HA       GLN  19  -9.407  -8.919   2.876
  141    HB2  GLN  19           HB3      GLN  19  -9.351  -9.193   0.437
  142    HB3  GLN  19           HB2      GLN  19  -9.785 -10.895   0.600
  143    HG2  GLN  19           HG3      GLN  19 -11.646  -9.176   2.040
  144    HG3  GLN  19           HG2      GLN  19 -11.565  -8.759   0.328
  145   HE21  GLN  19          HE22      GLN  19 -13.550 -10.429   2.158
  146   HE22  GLN  19          HE21      GLN  19 -13.846 -11.802   1.205
  147    H    ASP  20           H        ASP  20 -10.474  -9.512   4.716
  148    HA   ASP  20           HA       ASP  20 -11.451 -10.909   6.338
  149    HB2  ASP  20           HB3      ASP  20 -12.823 -11.509   3.730
  150    HB3  ASP  20           HB2      ASP  20 -13.302 -12.360   5.197
  151    H    GLU  21           H        GLU  21  -8.969 -11.896   5.636
  152    HA   GLU  21           HA       GLU  21  -7.688 -13.882   5.331
  153    HB2  GLU  21           HB3      GLU  21  -9.722 -14.579   7.467
  154    HB3  GLU  21           HB2      GLU  21  -8.244 -15.491   7.164
  155    HG2  GLU  21           HG3      GLU  21  -7.791 -13.945   8.964
  156    HG3  GLU  21           HG2      GLU  21  -6.947 -13.359   7.530
  157    H    ALA  22           H        ALA  22  -9.776 -13.786   3.342
  158    HA   ALA  22           HA       ALA  22 -10.602 -16.659   3.216
  159    HB1  ALA  22           HB1      ALA  22 -11.962 -15.141   1.240
  160    HB2  ALA  22           HB2      ALA  22 -12.040 -14.216   2.742
  161    HB3  ALA  22           HB3      ALA  22 -12.643 -15.874   2.694
  162    HA   PRO  23           HA       PRO  23  -8.144 -17.792  -0.256
  163    HB2  PRO  23           HB2      PRO  23 -10.663 -17.744  -1.885
  164    HB3  PRO  23           HB3      PRO  23  -9.406 -18.992  -1.788
  165    HG2  PRO  23           HG3      PRO  23 -11.781 -19.152  -0.496
  166    HG3  PRO  23           HG2      PRO  23 -10.296 -19.924   0.077
  167    HD2  PRO  23           HD3      PRO  23 -11.759 -17.687   1.260
  168    HD3  PRO  23           HD2      PRO  23 -10.418 -18.630   1.943
  169    H    ALA  24           H        ALA  24  -7.122 -15.661  -0.387
  170    HA   ALA  24           HA       ALA  24  -7.187 -14.439  -2.910
  171    HB1  ALA  24           HB1      ALA  24  -9.219 -13.382  -1.006
  172    HB2  ALA  24           HB2      ALA  24  -9.253 -13.440  -2.767
  173    HB3  ALA  24           HB3      ALA  24  -8.312 -12.197  -1.943
  174    H    ILE  25           H        ILE  25  -4.934 -14.689  -2.098
  175    HA   ILE  25           HA       ILE  25  -4.105 -12.449  -0.290
  176    HB   ILE  25           HB       ILE  25  -2.637 -15.018  -0.962
  177   HG12  ILE  25          HG13      ILE  25  -3.200 -14.935   1.767
  178   HG13  ILE  25          HG12      ILE  25  -4.683 -14.349   1.015
  179   HG21  ILE  25          HG21      ILE  25  -2.043 -12.701   0.897
  180   HG22  ILE  25          HG22      ILE  25  -1.055 -13.286  -0.441
  181   HG23  ILE  25          HG23      ILE  25  -1.230 -14.263   1.016
  182   HD11  ILE  25          HD11      ILE  25  -4.830 -16.761   1.174
  183   HD12  ILE  25          HD12      ILE  25  -3.247 -16.950   0.419
  184   HD13  ILE  25          HD13      ILE  25  -4.607 -16.338  -0.524
  185    H    CYS  26           H        CYS  26  -3.446 -10.763  -1.552
  186    HA   CYS  26           HA       CYS  26  -2.127 -11.337  -4.149
  187    HB2  CYS  26           HB3      CYS  26  -3.515  -8.988  -2.948
  188    HB3  CYS  26           HB2      CYS  26  -2.237  -8.664  -4.108
  189    H    HIS  27           H        HIS  27   0.050 -11.377  -4.221
  190    HA   HIS  27           HA       HIS  27   1.701 -10.569  -1.991
  191    HB2  HIS  27           HB3      HIS  27   2.061 -11.897  -4.552
  192    HB3  HIS  27           HB2      HIS  27   3.334 -10.708  -4.277
  193    HD1  HIS  27           HD1      HIS  27   5.284 -11.966  -3.349
  194    HD2  HIS  27           HD2      HIS  27   1.692 -13.209  -1.630
  195    HE1  HIS  27           HE1      HIS  27   5.892 -13.645  -1.551
  196    HE2  HIS  27           HE2      HIS  27   3.714 -14.407  -0.497
  197    H    LEU  28           H        LEU  28   2.703  -8.596  -1.658
  198    HA   LEU  28           HA       LEU  28   2.425  -6.545  -3.826
  199    HB2  LEU  28           HB3      LEU  28   1.520  -6.536  -1.027
  200    HB3  LEU  28           HB2      LEU  28   2.465  -5.119  -1.462
  201    HG   LEU  28           HG       LEU  28   0.018  -4.811  -1.851
  202   HD11  LEU  28          HD11      LEU  28   0.623  -3.383  -3.474
  203   HD12  LEU  28          HD12      LEU  28   0.808  -4.711  -4.618
  204   HD13  LEU  28          HD13      LEU  28   2.165  -4.226  -3.602
  205   HD21  LEU  28          HD21      LEU  28   0.147  -6.593  -4.236
  206   HD22  LEU  28          HD22      LEU  28  -1.223  -6.178  -3.212
  207   HD23  LEU  28          HD23      LEU  28  -0.042  -7.362  -2.661
  208    H    GLU  29           H        GLU  29   4.118  -4.932  -3.864
  209    HA   GLU  29           HA       GLU  29   6.533  -5.575  -2.239
  210    HB2  GLU  29           HB3      GLU  29   6.195  -6.029  -5.072
  211    HB3  GLU  29           HB2      GLU  29   7.432  -4.799  -4.809
  212    HG2  GLU  29           HG3      GLU  29   8.583  -6.294  -3.218
  213    HG3  GLU  29           HG2      GLU  29   7.348  -7.526  -3.482
  214    H    LEU  30           H        LEU  30   7.005  -3.747  -1.185
  215    HA   LEU  30           HA       LEU  30   6.155  -1.140  -2.257
  216    HB2  LEU  30           HB3      LEU  30   7.146  -2.202   0.344
  217    HB3  LEU  30           HB2      LEU  30   7.497  -0.514  -0.009
  218    HG   LEU  30           HG       LEU  30   5.141  -0.038  -0.359
  219   HD11  LEU  30          HD11      LEU  30   4.966  -3.017  -0.303
  220   HD12  LEU  30          HD12      LEU  30   4.125  -1.863  -1.340
  221   HD13  LEU  30          HD13      LEU  30   3.598  -2.101   0.326
  222   HD21  LEU  30          HD21      LEU  30   5.089  -1.751   2.100
  223   HD22  LEU  30          HD22      LEU  30   4.478  -0.113   1.869
  224   HD23  LEU  30          HD23      LEU  30   6.212  -0.393   2.035
  225    H    ARG  31           H        ARG  31   7.505  -0.466  -3.906
  226    HA   ARG  31           HA       ARG  31  10.352  -1.045  -3.902
  227    HB2  ARG  31           HB3      ARG  31   8.415   0.253  -5.671
  228    HB3  ARG  31           HB2      ARG  31   9.986   1.057  -5.672
  229    HG2  ARG  31           HG3      ARG  31  11.097  -1.093  -6.135
  230    HG3  ARG  31           HG2      ARG  31   9.534  -1.910  -6.113
  231    HD2  ARG  31           HD3      ARG  31  10.124  -1.479  -8.423
  232    HD3  ARG  31           HD2      ARG  31   8.797  -0.403  -7.985
  233    HE   ARG  31           HE       ARG  31  11.353   0.870  -7.537
  234   HH11  ARG  31          HH22      ARG  31   9.051  -0.091  -9.915
  235   HH12  ARG  31          HH21      ARG  31   9.488   1.154 -11.035
  236   HH21  ARG  31          HH11      ARG  31  11.937   2.504  -8.987
  237   HH22  ARG  31          HH12      ARG  31  11.123   2.624 -10.510
  238    H    ASP  32           H        ASP  32  12.031   0.690  -3.876
  239    HA   ASP  32           HA       ASP  32  11.335   2.797  -1.872
  240    HB2  ASP  32           HB3      ASP  32  13.938   2.811  -1.656
  241    HB3  ASP  32           HB2      ASP  32  13.034   1.484  -0.923
  242    H    SER  33           H        SER  33  11.368   2.636  -5.034
  243    HA   SER  33           HA       SER  33  13.301   4.694  -5.759
  244    HB2  SER  33           HB3      SER  33  11.086   4.419  -7.619
  245    HB3  SER  33           HB2      SER  33  12.792   4.049  -7.860
  246    HG   SER  33           HG       SER  33  12.343   2.026  -7.551
  247    H    GLU  34           H        GLU  34  12.721   6.870  -6.443
  248    HA   GLU  34           HA       GLU  34  10.491   7.963  -4.836
  249    HB2  GLU  34           HB3      GLU  34  11.542  10.164  -5.891
  250    HB3  GLU  34           HB2      GLU  34  12.334   9.344  -4.544
  251    HG2  GLU  34           HG3      GLU  34  13.882   8.244  -6.007
  252    HG3  GLU  34           HG2      GLU  34  12.973   8.732  -7.438
  253    H    VAL  35           H        VAL  35   8.767   9.153  -5.763
  254    HA   VAL  35           HA       VAL  35   8.565   9.128  -8.742
  255    HB   VAL  35           HB       VAL  35   6.495   8.087  -6.787
  256   HG11  VAL  35          HG11      VAL  35   6.259   9.211  -9.509
  257   HG12  VAL  35          HG12      VAL  35   5.025   9.001  -8.267
  258   HG13  VAL  35          HG13      VAL  35   5.487   7.641  -9.290
  259   HG21  VAL  35          HG21      VAL  35   8.082   6.852  -9.054
  260   HG22  VAL  35          HG22      VAL  35   6.688   6.069  -8.312
  261   HG23  VAL  35          HG23      VAL  35   8.126   6.404  -7.349
  262    H    ALA  36           H        ALA  36   8.467  11.290  -9.167
  263    HA   ALA  36           HA       ALA  36   7.212  13.147  -7.287
  264    HB1  ALA  36           HB1      ALA  36   8.095  14.850  -8.619
  265    HB2  ALA  36           HB2      ALA  36   7.991  13.888 -10.092
  266    HB3  ALA  36           HB3      ALA  36   9.245  13.543  -8.903
  267    H    GLU  37           H        GLU  37   6.318  11.531 -10.286
  268    HA   GLU  37           HA       GLU  37   4.162  13.150 -11.110
  269    HB2  GLU  37           HB3      GLU  37   5.034  11.113 -12.318
  270    HB3  GLU  37           HB2      GLU  37   4.184  10.117 -11.137
  271    HG2  GLU  37           HG3      GLU  37   2.751  10.348 -13.071
  272    HG3  GLU  37           HG2      GLU  37   2.056  11.317 -11.771
  273    H    ALA  38           H        ALA  38   4.379  10.794  -8.505
  274    HA   ALA  38           HA       ALA  38   1.627  11.583  -7.630
  275    HB1  ALA  38           HB1      ALA  38   2.371   9.061  -8.344
  276    HB2  ALA  38           HB2      ALA  38   1.108   9.409  -7.162
  277    HB3  ALA  38           HB3      ALA  38   2.745   9.038  -6.621
  278    H    SER  39           H        SER  39   4.834  11.933  -6.989
  279    HA   SER  39           HA       SER  39   6.006  12.660  -5.104
  280    HB2  SER  39           HB3      SER  39   4.868  14.101  -3.678
  281    HB3  SER  39           HB2      SER  39   3.780  14.083  -5.062
  282    HG   SER  39           HG       SER  39   2.714  13.702  -3.047
  283    H    GLY  40           H        GLY  40   5.690   9.904  -5.290
  284    HA2  GLY  40           HA3      GLY  40   5.792   9.165  -2.440
  285    HA3  GLY  40           HA2      GLY  40   4.548   8.352  -3.387
  286    H    TYR  41           H        TYR  41   5.432   6.294  -3.377
  287    HA   TYR  41           HA       TYR  41   8.036   5.968  -4.808
  288    HB2  TYR  41           HB3      TYR  41   6.975   4.256  -2.543
  289    HB3  TYR  41           HB2      TYR  41   8.523   4.057  -3.368
  290    HD1  TYR  41           HD1      TYR  41   6.524   6.545  -1.408
  291    HD2  TYR  41           HD2      TYR  41  10.415   5.222  -2.632
  292    HE1  TYR  41           HE1      TYR  41   7.564   8.208   0.106
  293    HE2  TYR  41           HE2      TYR  41  11.461   6.878  -1.110
  294    HH   TYR  41           HH       TYR  41   9.815   9.443   0.213
  295    H    ASP  42           H        ASP  42   8.167   4.094  -6.162
  296    HA   ASP  42           HA       ASP  42   5.789   3.471  -7.580
  297    HB2  ASP  42           HB3      ASP  42   8.029   3.243  -8.566
  298    HB3  ASP  42           HB2      ASP  42   8.386   1.911  -7.469
  299    H    LEU  43           H        LEU  43   4.827   1.347  -7.835
  300    HA   LEU  43           HA       LEU  43   4.826  -0.299  -5.331
  301    HB2  LEU  43           HB3      LEU  43   2.786   1.144  -5.411
  302    HB3  LEU  43           HB2      LEU  43   2.381   0.436  -6.971
  303    HG   LEU  43           HG       LEU  43   2.225  -1.796  -5.934
  304   HD11  LEU  43          HD11      LEU  43   3.637  -1.916  -4.111
  305   HD12  LEU  43          HD12      LEU  43   2.118  -1.588  -3.277
  306   HD13  LEU  43          HD13      LEU  43   3.260  -0.278  -3.576
  307   HD21  LEU  43          HD21      LEU  43   0.648   0.422  -4.617
  308   HD22  LEU  43          HD22      LEU  43   0.251  -1.289  -4.441
  309   HD23  LEU  43          HD23      LEU  43   0.201  -0.529  -6.029
  310    H    GLY  44           H        GLY  44   6.223  -1.826  -6.495
  311    HA2  GLY  44           HA3      GLY  44   5.189  -3.048  -8.945
  312    HA3  GLY  44           HA2      GLY  44   6.641  -3.542  -8.073
  313    H    GLY  45           H        GLY  45   5.533  -5.726  -8.646
  314    HA2  GLY  45           HA3      GLY  45   4.873  -7.632  -7.308
  315    HA3  GLY  45           HA2      GLY  45   3.951  -6.557  -6.270
  316    H    ASP  46           H        ASP  46   1.959  -7.597  -6.498
  317    HA   ASP  46           HA       ASP  46   0.844  -7.875  -9.231
  318    HB2  ASP  46           HB3      ASP  46   0.805  -9.792  -7.497
  319    HB3  ASP  46           HB2      ASP  46  -0.434  -8.845  -6.673
  320    H    THR  47           H        THR  47   0.468  -5.614  -9.475
  321    HA   THR  47           HA       THR  47  -1.474  -4.356  -7.607
  322    HB   THR  47           HB       THR  47  -1.035  -2.294  -8.812
  323    HG1  THR  47           HG1      THR  47  -0.857  -2.776 -10.887
  324   HG21  THR  47          HG21      THR  47   1.727  -3.326  -8.857
  325   HG22  THR  47          HG22      THR  47   0.850  -3.632  -7.358
  326   HG23  THR  47          HG23      THR  47   1.039  -1.982  -7.948
  327    H    ALA  48           H        ALA  48  -1.241  -6.068 -10.504
  328    HA   ALA  48           HA       ALA  48  -3.654  -5.018 -11.781
  329    HB1  ALA  48           HB1      ALA  48  -3.382  -6.953 -13.317
  330    HB2  ALA  48           HB2      ALA  48  -2.093  -7.570 -12.284
  331    HB3  ALA  48           HB3      ALA  48  -1.883  -6.040 -13.136
  332    H    CYS  49           H        CYS  49  -3.548  -6.370  -8.954
  333    HA   CYS  49           HA       CYS  49  -5.904  -8.171  -9.409
  334    HB2  CYS  49           HB3      CYS  49  -5.130  -9.654  -7.799
  335    HB3  CYS  49           HB2      CYS  49  -3.597  -9.093  -8.463
  336    H    LEU  50           H        LEU  50  -4.473  -5.580  -7.522
  337    HA   LEU  50           HA       LEU  50  -6.477  -5.443  -5.477
  338    HB2  LEU  50           HB3      LEU  50  -4.849  -3.170  -6.647
  339    HB3  LEU  50           HB2      LEU  50  -5.645  -3.183  -5.079
  340    HG   LEU  50           HG       LEU  50  -3.527  -5.190  -5.874
  341   HD11  LEU  50          HD11      LEU  50  -2.426  -3.066  -5.906
  342   HD12  LEU  50          HD12      LEU  50  -2.053  -3.787  -4.341
  343   HD13  LEU  50          HD13      LEU  50  -3.281  -2.527  -4.463
  344   HD21  LEU  50          HD21      LEU  50  -4.745  -6.052  -4.044
  345   HD22  LEU  50          HD22      LEU  50  -4.939  -4.463  -3.304
  346   HD23  LEU  50          HD23      LEU  50  -3.370  -5.259  -3.284
  347    H    THR  51           H        THR  51  -6.862  -5.112  -8.743
  348    HA   THR  51           HA       THR  51  -8.552  -2.803  -8.950
  349    HB   THR  51           HB       THR  51  -9.256  -5.031 -10.728
  350    HG1  THR  51           HG1      THR  51  -6.576  -4.134 -10.508
  351   HG21  THR  51          HG21      THR  51  -9.667  -2.543 -11.042
  352   HG22  THR  51          HG22      THR  51  -8.917  -3.363 -12.413
  353   HG23  THR  51          HG23      THR  51  -7.935  -2.378 -11.330
  354    H    ARG  52           H        ARG  52  -9.002  -5.301  -6.966
  355    HA   ARG  52           HA       ARG  52 -11.958  -5.460  -7.387
  356    HB2  ARG  52           HB3      ARG  52 -11.895  -7.520  -6.091
  357    HB3  ARG  52           HB2      ARG  52 -10.704  -7.624  -7.389
  358    HG2  ARG  52           HG3      ARG  52  -9.084  -6.606  -5.570
  359    HG3  ARG  52           HG2      ARG  52 -10.268  -7.270  -4.445
  360    HD2  ARG  52           HD3      ARG  52  -8.509  -8.715  -6.405
  361    HD3  ARG  52           HD2      ARG  52  -8.809  -9.074  -4.704
  362    HE   ARG  52           HE       ARG  52 -11.215  -9.355  -6.298
  363   HH11  ARG  52          HH22      ARG  52  -8.228 -10.800  -5.358
  364   HH12  ARG  52          HH21      ARG  52  -8.782 -12.422  -5.602
  365   HH21  ARG  52          HH11      ARG  52 -11.955 -11.467  -6.623
  366   HH22  ARG  52          HH12      ARG  52 -10.891 -12.800  -6.319
  367    H    TRP  53           H        TRP  53  -9.440  -4.368  -5.265
  368    HA   TRP  53           HA       TRP  53 -11.475  -3.747  -3.150
  369    HB2  TRP  53           HB3      TRP  53  -8.456  -3.954  -2.931
  370    HB3  TRP  53           HB2      TRP  53  -9.555  -3.567  -1.608
  371    HD1  TRP  53           HD1      TRP  53 -11.764  -5.594  -1.733
  372    HE1  TRP  53           HE1      TRP  53 -11.357  -8.131  -1.513
  373    HE3  TRP  53           HE3      TRP  53  -6.830  -5.807  -3.014
  374    HZ2  TRP  53           HZ2      TRP  53  -9.213 -10.004  -1.838
  375    HZ3  TRP  53           HZ3      TRP  53  -5.630  -7.974  -3.052
  376    HH2  TRP  53           HH2      TRP  53  -6.810 -10.070  -2.467
  377    H    LEU  54           H        LEU  54  -9.620  -2.421  -5.624
  378    HA   LEU  54           HA       LEU  54  -9.933   0.322  -4.472
  379    HB2  LEU  54           HB3      LEU  54  -7.642  -0.829  -6.073
  380    HB3  LEU  54           HB2      LEU  54  -7.836   0.892  -5.804
  381    HG   LEU  54           HG       LEU  54  -7.703  -1.134  -3.553
  382   HD11  LEU  54          HD11      LEU  54  -5.596  -0.870  -5.052
  383   HD12  LEU  54          HD12      LEU  54  -5.404  -0.715  -3.309
  384   HD13  LEU  54          HD13      LEU  54  -5.466   0.727  -4.321
  385   HD21  LEU  54          HD21      LEU  54  -8.253   1.715  -3.702
  386   HD22  LEU  54          HD22      LEU  54  -6.810   1.402  -2.741
  387   HD23  LEU  54          HD23      LEU  54  -8.339   0.635  -2.312
  388    HA   PRO  55           HA       PRO  55 -12.024   1.041  -8.331
  389    HB2  PRO  55           HB2      PRO  55 -11.767   3.733  -8.641
  390    HB3  PRO  55           HB3      PRO  55 -12.822   3.003  -7.416
  391    HG2  PRO  55           HG3      PRO  55 -10.156   4.259  -7.111
  392    HG3  PRO  55           HG2      PRO  55 -11.538   4.249  -6.005
  393    HD2  PRO  55           HD3      PRO  55  -9.291   2.631  -5.762
  394    HD3  PRO  55           HD2      PRO  55 -10.849   2.325  -4.987
  395    H    SER  56           H        SER  56  -8.673   1.803  -8.017
  396    HA   SER  56           HA       SER  56  -8.338   1.488 -10.940
  397    HB2  SER  56           HB3      SER  56  -6.510   3.510 -10.249
  398    HB3  SER  56           HB2      SER  56  -7.936   3.679 -11.270
  399    HG   SER  56           HG       SER  56  -8.998   3.776  -9.017
  400    H    GLU  57           H        GLU  57  -6.180   0.787 -11.495
  401    HA   GLU  57           HA       GLU  57  -4.942  -0.858  -9.487
  402    HB2  GLU  57           HB3      GLU  57  -4.883  -1.455 -11.861
  403    HB3  GLU  57           HB2      GLU  57  -3.943  -0.009 -12.218
  404    HG2  GLU  57           HG3      GLU  57  -2.907  -1.861 -10.122
  405    HG3  GLU  57           HG2      GLU  57  -2.756  -2.359 -11.807
  406    HA   PRO  58           HA       PRO  58  -2.487   2.662  -7.965
  407    HB2  PRO  58           HB2      PRO  58  -1.207   1.327  -5.931
  408    HB3  PRO  58           HB3      PRO  58  -2.804   2.069  -5.799
  409    HG2  PRO  58           HG3      PRO  58  -2.069  -0.757  -6.038
  410    HG3  PRO  58           HG2      PRO  58  -3.491  -0.008  -5.329
  411    HD2  PRO  58           HD3      PRO  58  -3.390  -1.295  -7.814
  412    HD3  PRO  58           HD2      PRO  58  -4.692  -0.226  -7.251
  413    H    ARG  59           H        ARG  59  -0.745   3.225  -9.138
  414    HA   ARG  59           HA       ARG  59   1.382   1.216  -9.662
  415    HB2  ARG  59           HB3      ARG  59   0.313   3.513 -11.084
  416    HB3  ARG  59           HB2      ARG  59   2.063   3.639 -10.904
  417    HG2  ARG  59           HG3      ARG  59   0.661   1.147 -11.907
  418    HG3  ARG  59           HG2      ARG  59   1.326   2.389 -12.970
  419    HD2  ARG  59           HD3      ARG  59   3.404   1.557 -12.730
  420    HD3  ARG  59           HD2      ARG  59   3.280   1.641 -10.974
  421    HE   ARG  59           HE       ARG  59   2.925  -0.679 -10.998
  422   HH11  ARG  59          HH22      ARG  59   1.973   0.779 -13.973
  423   HH12  ARG  59          HH21      ARG  59   1.534  -0.721 -14.720
  424   HH21  ARG  59          HH11      ARG  59   2.357  -2.646 -11.955
  425   HH22  ARG  59          HH12      ARG  59   1.750  -2.660 -13.578
  426    H    ALA  60           H        ALA  60   0.638   3.569  -7.414
  427    HA   ALA  60           HA       ALA  60   3.420   3.613  -6.461
  428    HB1  ALA  60           HB1      ALA  60   3.200   5.550  -8.069
  429    HB2  ALA  60           HB2      ALA  60   3.638   6.014  -6.425
  430    HB3  ALA  60           HB3      ALA  60   1.981   6.225  -6.989
  431    H    TRP  61           H        TRP  61   3.529   4.726  -4.300
  432    HA   TRP  61           HA       TRP  61   0.934   4.958  -2.879
  433    HB2  TRP  61           HB3      TRP  61   1.743   3.456  -1.061
  434    HB3  TRP  61           HB2      TRP  61   1.529   2.600  -2.585
  435    HD1  TRP  61           HD1      TRP  61   3.983   2.679  -4.134
  436    HE1  TRP  61           HE1      TRP  61   6.320   2.031  -3.273
  437    HE3  TRP  61           HE3      TRP  61   3.228   3.144   0.894
  438    HZ2  TRP  61           HZ2      TRP  61   7.691   1.739  -0.784
  439    HZ3  TRP  61           HZ3      TRP  61   5.066   2.664   2.488
  440    HH2  TRP  61           HH2      TRP  61   7.296   1.964   1.655
  441    H    ARG  62           H        ARG  62   1.198   6.137  -0.843
  442    HA   ARG  62           HA       ARG  62   3.846   7.497  -0.547
  443    HB2  ARG  62           HB3      ARG  62   2.493   9.089  -1.677
  444    HB3  ARG  62           HB2      ARG  62   1.098   8.728  -0.662
  445    HG2  ARG  62           HG3      ARG  62   2.025   9.809   1.214
  446    HG3  ARG  62           HG2      ARG  62   3.658   9.755   0.549
  447    HD2  ARG  62           HD3      ARG  62   3.313  11.577  -0.817
  448    HD3  ARG  62           HD2      ARG  62   1.594  11.235  -1.014
  449    HE   ARG  62           HE       ARG  62   2.777  12.883   1.077
  450   HH11  ARG  62          HH22      ARG  62   0.197  10.786   0.160
  451   HH12  ARG  62          HH21      ARG  62  -0.931  11.464   1.287
  452   HH21  ARG  62          HH11      ARG  62   1.319  13.777   2.554
  453   HH22  ARG  62          HH12      ARG  62  -0.296  13.156   2.643
  454    HA   PRO  63           HA       PRO  63   2.776   5.876   3.619
  455    HB2  PRO  63           HB2      PRO  63   5.358   6.873   4.498
  456    HB3  PRO  63           HB3      PRO  63   4.790   5.202   4.399
  457    HG2  PRO  63           HG3      PRO  63   6.682   6.402   2.759
  458    HG3  PRO  63           HG2      PRO  63   5.862   4.867   2.470
  459    HD2  PRO  63           HD3      PRO  63   5.487   7.436   1.121
  460    HD3  PRO  63           HD2      PRO  63   4.932   5.821   0.636
  461    H    THR  64           H        THR  64   1.653   7.087   5.118
  462    HA   THR  64           HA       THR  64   2.291  10.000   5.310
  463    HB   THR  64           HB       THR  64  -0.125   9.697   6.556
  464    HG1  THR  64           HG1      THR  64  -0.349   7.556   6.064
  465   HG21  THR  64          HG21      THR  64  -1.065  10.270   4.206
  466   HG22  THR  64          HG22      THR  64   0.617  10.212   3.680
  467   HG23  THR  64          HG23      THR  64   0.117  11.370   4.913
  468    HA   PRO  65           HA       PRO  65   3.591   9.409   9.495
  469    HB2  PRO  65           HB2      PRO  65   2.679  11.689  10.724
  470    HB3  PRO  65           HB3      PRO  65   4.058  11.660   9.611
  471    HG2  PRO  65           HG3      PRO  65   1.242  12.476   9.107
  472    HG3  PRO  65           HG2      PRO  65   2.752  13.198   8.525
  473    HD2  PRO  65           HD3      PRO  65   1.194  11.570   6.977
  474    HD3  PRO  65           HD2      PRO  65   2.954  11.701   6.775
  475    H    ALA  66           H        ALA  66   1.490   7.761   9.182
  476    HA   ALA  66           HA       ALA  66   0.398   7.336  11.703
  477    HB1  ALA  66           HB1      ALA  66  -2.061   8.175  10.937
  478    HB2  ALA  66           HB2      ALA  66  -1.068   9.406  10.157
  479    HB3  ALA  66           HB3      ALA  66  -0.966   9.166  11.900
  480    H    GLY  67           H        GLY  67   0.194   7.044   8.271
  481    HA2  GLY  67           HA3      GLY  67  -0.553   4.266   8.432
  482    HA3  GLY  67           HA2      GLY  67  -1.918   5.242   7.894
  483    H    ILE  68           H        ILE  68  -1.243   3.570   6.002
  484    HA   ILE  68           HA       ILE  68   0.733   4.921   4.217
  485    HB   ILE  68           HB       ILE  68  -0.452   2.134   4.069
  486   HG12  ILE  68          HG13      ILE  68   2.377   2.945   4.781
  487   HG13  ILE  68          HG12      ILE  68   1.138   2.649   5.999
  488   HG21  ILE  68          HG21      ILE  68   0.169   2.509   1.882
  489   HG22  ILE  68          HG22      ILE  68   1.734   2.017   2.530
  490   HG23  ILE  68          HG23      ILE  68   1.367   3.728   2.318
  491   HD11  ILE  68          HD11      ILE  68   0.967   0.373   5.460
  492   HD12  ILE  68          HD12      ILE  68   2.696   0.676   5.295
  493   HD13  ILE  68          HD13      ILE  68   1.673   0.601   3.859
  494    H    ALA  69           H        ALA  69   0.113   5.438   2.066
  495    HA   ALA  69           HA       ALA  69  -2.823   5.279   1.493
  496    HB1  ALA  69           HB1      ALA  69  -2.843   7.494   0.706
  497    HB2  ALA  69           HB2      ALA  69  -1.089   7.544   0.528
  498    HB3  ALA  69           HB3      ALA  69  -1.814   7.599   2.136
  499    H    LEU  70           H        LEU  70  -3.361   4.837  -0.668
  500    HA   LEU  70           HA       LEU  70  -1.078   3.941  -2.383
  501    HB2  LEU  70           HB3      LEU  70  -3.969   3.112  -2.248
  502    HB3  LEU  70           HB2      LEU  70  -2.890   2.593  -3.531
  503    HG   LEU  70           HG       LEU  70  -1.831   2.243  -0.795
  504   HD11  LEU  70          HD11      LEU  70  -4.164   1.648  -0.379
  505   HD12  LEU  70          HD12      LEU  70  -3.186   0.181  -0.428
  506   HD13  LEU  70          HD13      LEU  70  -4.185   0.621  -1.813
  507   HD21  LEU  70          HD21      LEU  70  -2.103   0.360  -3.162
  508   HD22  LEU  70          HD22      LEU  70  -1.054   0.138  -1.760
  509   HD23  LEU  70          HD23      LEU  70  -0.736   1.443  -2.903
  510    H    LEU  71           H        LEU  71  -0.766   4.987  -4.327
  511    HA   LEU  71           HA       LEU  71  -2.860   6.957  -5.172
  512    HB2  LEU  71           HB3      LEU  71   0.129   6.964  -5.688
  513    HB3  LEU  71           HB2      LEU  71  -1.008   8.196  -6.234
  514    HG   LEU  71           HG       LEU  71  -0.939   7.510  -3.317
  515   HD11  LEU  71          HD11      LEU  71   1.191   8.939  -4.868
  516   HD12  LEU  71          HD12      LEU  71   1.353   7.846  -3.495
  517   HD13  LEU  71          HD13      LEU  71   0.791   9.499  -3.246
  518   HD21  LEU  71          HD21      LEU  71  -2.463   9.216  -4.708
  519   HD22  LEU  71          HD22      LEU  71  -1.071  10.272  -4.460
  520   HD23  LEU  71          HD23      LEU  71  -1.921   9.591  -3.072
  521    H    GLU  72           H        GLU  72  -2.864   7.337  -7.598
  522    HA   GLU  72           HA       GLU  72  -2.491   4.732  -9.026
  523    HB2  GLU  72           HB3      GLU  72  -4.239   6.024 -10.604
  524    HB3  GLU  72           HB2      GLU  72  -4.754   5.054  -9.228
  525    HG2  GLU  72           HG3      GLU  72  -4.912   7.003  -7.817
  526    HG3  GLU  72           HG2      GLU  72  -4.161   8.018  -9.049
  527    H    ARG  73           H        ARG  73  -0.651   7.234  -8.690
  528    HA   ARG  73           HA       ARG  73   1.051   8.062 -10.087
  529    HB2  ARG  73           HB3      ARG  73   0.265   5.921 -11.554
  530    HB3  ARG  73           HB2      ARG  73  -0.244   7.226 -12.624
  531    HG2  ARG  73           HG3      ARG  73   2.067   8.223 -12.348
  532    HG3  ARG  73           HG2      ARG  73   2.531   6.735 -11.522
  533    HD2  ARG  73           HD3      ARG  73   1.339   5.727 -13.760
  534    HD3  ARG  73           HD2      ARG  73   2.036   7.217 -14.396
  535    HE   ARG  73           HE       ARG  73   3.523   4.870 -13.662
  536   HH11  ARG  73          HH22      ARG  73   3.504   8.315 -13.508
  537   HH12  ARG  73          HH21      ARG  73   5.230   8.456 -13.479
  538   HH21  ARG  73          HH11      ARG  73   5.777   5.034 -13.623
  539   HH22  ARG  73          HH12      ARG  73   6.516   6.598 -13.544
  540    H    GLY  74           H        GLY  74  -1.408   9.415  -9.310
  541    HA2  GLY  74           HA3      GLY  74  -1.301  11.582 -11.317
  542    HA3  GLY  74           HA2      GLY  74  -2.888  10.876 -11.008
  543    H    GLY  75           H        GLY  75  -1.635  10.430  -8.139
  544    HA2  GLY  75           HA3      GLY  75  -1.205  11.894  -6.243
  545    HA3  GLY  75           HA2      GLY  75  -1.936  13.222  -7.143
  546    H    LEU  76           H        LEU  76  -3.905  10.694  -7.769
  547    HA   LEU  76           HA       LEU  76  -5.864  11.597  -5.762
  548    HB2  LEU  76           HB3      LEU  76  -5.959   9.877  -8.225
  549    HB3  LEU  76           HB2      LEU  76  -7.270   9.784  -7.049
  550    HG   LEU  76           HG       LEU  76  -6.382  12.506  -7.867
  551   HD11  LEU  76          HD11      LEU  76  -7.988  10.643  -9.639
  552   HD12  LEU  76          HD12      LEU  76  -6.437  11.388 -10.028
  553   HD13  LEU  76          HD13      LEU  76  -7.882  12.388  -9.869
  554   HD21  LEU  76          HD21      LEU  76  -8.631  13.054  -7.405
  555   HD22  LEU  76          HD22      LEU  76  -8.262  11.806  -6.214
  556   HD23  LEU  76          HD23      LEU  76  -9.180  11.399  -7.664
  557    H    THR  77           H        THR  77  -5.274  10.711  -3.773
  558    HA   THR  77           HA       THR  77  -4.196   8.129  -3.337
  559    HB   THR  77           HB       THR  77  -5.790  10.022  -1.628
  560    HG1  THR  77           HG1      THR  77  -3.864  10.396  -0.794
  561   HG21  THR  77          HG21      THR  77  -6.579   8.006  -0.722
  562   HG22  THR  77          HG22      THR  77  -5.150   8.343   0.256
  563   HG23  THR  77          HG23      THR  77  -5.067   7.159  -1.049
  564    H    LEU  78           H        LEU  78  -5.093   6.163  -3.647
  565    HA   LEU  78           HA       LEU  78  -7.947   5.935  -4.278
  566    HB2  LEU  78           HB3      LEU  78  -5.929   3.708  -3.938
  567    HB3  LEU  78           HB2      LEU  78  -7.460   3.625  -4.787
  568    HG   LEU  78           HG       LEU  78  -5.226   5.502  -5.608
  569   HD11  LEU  78          HD11      LEU  78  -4.196   3.832  -6.708
  570   HD12  LEU  78          HD12      LEU  78  -5.714   3.326  -7.449
  571   HD13  LEU  78          HD13      LEU  78  -5.250   2.691  -5.873
  572   HD21  LEU  78          HD21      LEU  78  -7.293   6.278  -6.485
  573   HD22  LEU  78          HD22      LEU  78  -7.860   4.640  -6.819
  574   HD23  LEU  78          HD23      LEU  78  -6.577   5.346  -7.798
  575    H    MET  79           H        MET  79  -5.800   5.009  -1.600
  576    HA   MET  79           HA       MET  79  -8.142   4.797   0.151
  577    HB2  MET  79           HB3      MET  79  -7.889   2.557  -1.048
  578    HB3  MET  79           HB2      MET  79  -6.395   2.350  -0.141
  579    HG2  MET  79           HG3      MET  79  -8.125   1.279   1.137
  580    HG3  MET  79           HG2      MET  79  -7.739   2.786   1.968
  581    HE1  MET  79           HE1      MET  79 -10.443   0.885   2.092
  582    HE2  MET  79           HE2      MET  79 -10.240   0.584   0.361
  583    HE3  MET  79           HE3      MET  79 -11.714   1.340   0.960
  584    H    LEU  80           H        LEU  80  -7.597   5.008   2.317
  585    HA   LEU  80           HA       LEU  80  -4.711   5.538   2.885
  586    HB2  LEU  80           HB3      LEU  80  -6.081   7.481   3.304
  587    HB3  LEU  80           HB2      LEU  80  -7.263   6.525   4.192
  588    HG   LEU  80           HG       LEU  80  -5.703   6.135   5.995
  589   HD11  LEU  80          HD11      LEU  80  -3.615   5.804   4.951
  590   HD12  LEU  80          HD12      LEU  80  -3.409   7.343   5.789
  591   HD13  LEU  80          HD13      LEU  80  -3.722   7.319   4.053
  592   HD21  LEU  80          HD21      LEU  80  -5.220   9.023   5.306
  593   HD22  LEU  80          HD22      LEU  80  -5.598   8.305   6.871
  594   HD23  LEU  80          HD23      LEU  80  -6.855   8.457   5.645
  595    H    LEU  81           H        LEU  81  -3.927   3.566   3.572
  596    HA   LEU  81           HA       LEU  81  -5.499   1.818   5.321
  597    HB2  LEU  81           HB3      LEU  81  -2.877   1.720   3.936
  598    HB3  LEU  81           HB2      LEU  81  -2.960   0.835   5.457
  599    HG   LEU  81           HG       LEU  81  -4.958  -0.368   4.660
  600   HD11  LEU  81          HD11      LEU  81  -6.087   1.033   3.185
  601   HD12  LEU  81          HD12      LEU  81  -5.298  -0.070   2.056
  602   HD13  LEU  81          HD13      LEU  81  -4.607   1.525   2.360
  603   HD21  LEU  81          HD21      LEU  81  -3.829  -1.600   2.749
  604   HD22  LEU  81          HD22      LEU  81  -2.848  -1.443   4.207
  605   HD23  LEU  81          HD23      LEU  81  -2.547  -0.392   2.825
  606    H    GLY  82           H        GLY  82  -5.576   2.062   7.536
  607    HA2  GLY  82           HA3      GLY  82  -3.666   3.968   8.772
  608    HA3  GLY  82           HA2      GLY  82  -5.170   3.410   9.490
  609    H    ARG  83           H        ARG  83  -2.151   3.340  10.245
  610    HA   ARG  83           HA       ARG  83  -1.466   0.546  10.497
  611    HB2  ARG  83           HB3      ARG  83   0.188   2.405  10.615
  612    HB3  ARG  83           HB2      ARG  83  -0.520   2.903  12.150
  613    HG2  ARG  83           HG3      ARG  83   0.001   0.097  12.290
  614    HG3  ARG  83           HG2      ARG  83   1.457   0.892  11.695
  615    HD2  ARG  83           HD3      ARG  83  -0.086   1.743  14.163
  616    HD3  ARG  83           HD2      ARG  83   1.397   0.789  14.182
  617    HE   ARG  83           HE       ARG  83   1.628   3.328  12.739
  618   HH11  ARG  83          HH22      ARG  83   1.850   1.621  15.726
  619   HH12  ARG  83          HH21      ARG  83   2.951   2.751  16.442
  620   HH21  ARG  83          HH11      ARG  83   3.066   4.811  13.656
  621   HH22  ARG  83          HH12      ARG  83   3.640   4.555  15.271
  622    H    GLN  84           H        GLN  84  -2.441  -0.907  11.896
  623    HA   GLN  84           HA       GLN  84  -4.156   0.147  14.043
  624    HB2  GLN  84           HB3      GLN  84  -4.162  -2.153  12.393
  625    HB3  GLN  84           HB2      GLN  84  -3.866  -2.730  14.031
  626    HG2  GLN  84           HG3      GLN  84  -6.150  -0.932  13.161
  627    HG3  GLN  84           HG2      GLN  84  -6.276  -2.637  13.593
  628   HE21  GLN  84          HE22      GLN  84  -7.288   0.022  14.917
  629   HE22  GLN  84          HE21      GLN  84  -6.848  -0.176  16.544
  630    H    GLY  85           H        GLY  85  -1.048  -1.429  13.597
  631    HA2  GLY  85           HA3      GLY  85   0.245  -0.698  15.844
  632    HA3  GLY  85           HA2      GLY  85  -0.796  -1.964  16.487
  633    H    GLU  86           H        GLU  86   2.060  -1.932  16.372
  634    HA   GLU  86           HA       GLU  86   3.905  -3.267  15.728
  635    HB2  GLU  86           HB3      GLU  86   2.199  -4.773  17.006
  636    HB3  GLU  86           HB2      GLU  86   1.918  -5.500  15.423
  637    HG2  GLU  86           HG3      GLU  86   4.449  -5.776  15.247
  638    HG3  GLU  86           HG2      GLU  86   4.518  -5.360  16.960
  639    H    GLY  87           H        GLY  87   3.008  -1.880  13.467
  640    HA2  GLY  87           HA3      GLY  87   3.355  -1.964  11.140
  641    HA3  GLY  87           HA2      GLY  87   4.027  -3.571  11.367
  642    H    ASP  88           H        ASP  88   0.828  -3.090  12.583
  643    HA   ASP  88           HA       ASP  88  -0.224  -4.735  10.316
  644    HB2  ASP  88           HB3      ASP  88  -0.412  -5.251  12.963
  645    HB3  ASP  88           HB2      ASP  88  -1.871  -4.282  12.749
  646    H    TYR  89           H        TYR  89  -1.502  -3.693   8.858
  647    HA   TYR  89           HA       TYR  89  -2.825  -1.145   9.709
  648    HB2  TYR  89           HB3      TYR  89  -1.985  -1.908   6.926
  649    HB3  TYR  89           HB2      TYR  89  -2.613  -0.362   7.421
  650    HD1  TYR  89           HD1      TYR  89   0.195  -2.736   8.143
  651    HD2  TYR  89           HD2      TYR  89  -1.124   1.351   8.009
  652    HE1  TYR  89           HE1      TYR  89   2.495  -1.973   8.663
  653    HE2  TYR  89           HE2      TYR  89   1.179   2.112   8.523
  654    HH   TYR  89           HH       TYR  89   3.679  -0.122   9.476
  655    H    ARG  90           H        ARG  90  -4.989  -0.909   9.265
  656    HA   ARG  90           HA       ARG  90  -6.319  -2.978   7.601
  657    HB2  ARG  90           HB3      ARG  90  -7.458  -2.130  10.268
  658    HB3  ARG  90           HB2      ARG  90  -7.954  -3.486   9.255
  659    HG2  ARG  90           HG3      ARG  90  -5.797  -4.594   9.667
  660    HG3  ARG  90           HG2      ARG  90  -5.283  -3.237  10.661
  661    HD2  ARG  90           HD3      ARG  90  -6.076  -4.684  12.294
  662    HD3  ARG  90           HD2      ARG  90  -7.526  -3.737  11.962
  663    HE   ARG  90           HE       ARG  90  -7.795  -5.802  10.196
  664   HH11  ARG  90          HH22      ARG  90  -6.985  -5.608  13.544
  665   HH12  ARG  90          HH21      ARG  90  -7.671  -7.149  13.934
  666   HH21  ARG  90          HH11      ARG  90  -8.696  -7.815  10.691
  667   HH22  ARG  90          HH12      ARG  90  -8.641  -8.397  12.321
  668    H    VAL  91           H        VAL  91  -8.319  -2.246   6.710
  669    HA   VAL  91           HA       VAL  91  -8.996   0.623   7.166
  670    HB   VAL  91           HB       VAL  91  -7.495   0.387   5.150
  671   HG11  VAL  91          HG11      VAL  91  -8.782  -1.899   4.639
  672   HG12  VAL  91          HG12      VAL  91  -8.071  -0.935   3.345
  673   HG13  VAL  91          HG13      VAL  91  -9.799  -0.823   3.680
  674   HG21  VAL  91          HG21      VAL  91  -9.137   2.232   5.374
  675   HG22  VAL  91          HG22      VAL  91 -10.360   1.224   4.598
  676   HG23  VAL  91          HG23      VAL  91  -8.940   1.745   3.691
  677    H    GLN  92           H        GLN  92 -11.176   0.941   7.281
  678    HA   GLN  92           HA       GLN  92 -12.948  -1.359   7.137
  679    HB2  GLN  92           HB3      GLN  92 -13.301   1.576   7.702
  680    HB3  GLN  92           HB2      GLN  92 -14.712   0.552   7.436
  681    HG2  GLN  92           HG3      GLN  92 -13.965   0.791   9.864
  682    HG3  GLN  92           HG2      GLN  92 -14.152  -0.863   9.282
  683   HE21  GLN  92          HE22      GLN  92 -11.664   1.668   9.839
  684   HE22  GLN  92          HE21      GLN  92 -10.380   0.575  10.046
  685    H    LYS  93           H        LYS  93 -13.699  -2.135   5.229
  686    HA   LYS  93           HA       LYS  93 -13.757  -0.384   2.855
  687    HB2  LYS  93           HB3      LYS  93 -12.894  -2.712   2.691
  688    HB3  LYS  93           HB2      LYS  93 -14.488  -3.315   3.142
  689    HG2  LYS  93           HG3      LYS  93 -15.487  -2.437   1.152
  690    HG3  LYS  93           HG2      LYS  93 -14.045  -1.496   0.766
  691    HD2  LYS  93           HD3      LYS  93 -12.796  -3.424   0.196
  692    HD3  LYS  93           HD2      LYS  93 -13.940  -4.503   0.995
  693    HE2  LYS  93           HE3      LYS  93 -13.951  -4.150  -1.661
  694    HE3  LYS  93           HE2      LYS  93 -15.434  -4.443  -0.755
  695    HZ1  LYS  93           HZ1      LYS  93 -14.366  -1.737  -1.332
  696    HZ2  LYS  93           HZ2      LYS  93 -15.882  -2.126  -0.676
  697    HZ3  LYS  93           HZ3      LYS  93 -15.532  -2.514  -2.293
  698    H    GLY  94           H        GLY  94 -16.145  -2.818   3.919
  699    HA2  GLY  94           HA3      GLY  94 -18.311  -1.423   4.718
  700    HA3  GLY  94           HA2      GLY  94 -18.302  -1.028   2.999
  701    H    ASP  95           H        ASP  95 -17.999  -3.105   1.567
  702    HA   ASP  95           HA       ASP  95 -20.259  -4.736   1.788
  703    HB2  ASP  95           HB3      ASP  95 -17.642  -5.721   0.633
  704    HB3  ASP  95           HB2      ASP  95 -19.278  -6.142   0.126
  705    H    GLY  96           H        GLY  96 -17.501  -4.770   3.763
  706    HA2  GLY  96           HA3      GLY  96 -17.577  -6.097   5.836
  707    HA3  GLY  96           HA2      GLY  96 -18.331  -7.402   4.922
  708    H    GLY  97           H        GLY  97 -15.943  -5.967   3.064
  709    HA2  GLY  97           HA3      GLY  97 -14.151  -8.274   3.517
  710    HA3  GLY  97           HA2      GLY  97 -14.024  -7.116   2.191
  711    H    GLN  98           H        GLN  98 -12.550  -8.093   4.981
  712    HA   GLN  98           HA       GLN  98 -11.560  -5.379   5.698
  713    HB2  GLN  98           HB3      GLN  98 -12.346  -7.325   7.357
  714    HB3  GLN  98           HB2      GLN  98 -10.666  -7.822   7.159
  715    HG2  GLN  98           HG3      GLN  98  -9.915  -5.548   7.775
  716    HG3  GLN  98           HG2      GLN  98 -11.601  -5.070   8.015
  717   HE21  GLN  98          HE22      GLN  98  -9.879  -8.093   8.969
  718   HE22  GLN  98          HE21      GLN  98 -10.250  -7.958  10.619
  719    H    LEU  99           H        LEU  99  -9.786  -4.722   4.693
  720    HA   LEU  99           HA       LEU  99  -7.944  -6.680   3.487
  721    HB2  LEU  99           HB3      LEU  99  -7.665  -3.672   3.527
  722    HB3  LEU  99           HB2      LEU  99  -6.962  -4.807   2.385
  723    HG   LEU  99           HG       LEU  99  -9.913  -4.238   2.714
  724   HD11  LEU  99          HD11      LEU  99  -8.192  -3.702   0.293
  725   HD12  LEU  99          HD12      LEU  99  -8.373  -2.503   1.574
  726   HD13  LEU  99          HD13      LEU  99  -9.785  -3.048   0.670
  727   HD21  LEU  99          HD21      LEU  99  -9.932  -6.423   1.960
  728   HD22  LEU  99          HD22      LEU  99  -8.345  -6.285   1.203
  729   HD23  LEU  99          HD23      LEU  99  -9.762  -5.592   0.414
  730    H    VAL 100           H        VAL 100  -5.792  -6.936   4.172
  731    HA   VAL 100           HA       VAL 100  -4.922  -5.405   6.570
  732    HB   VAL 100           HB       VAL 100  -4.926  -8.432   6.385
  733   HG11  VAL 100          HG11      VAL 100  -3.188  -8.248   7.821
  734   HG12  VAL 100          HG12      VAL 100  -4.364  -7.646   8.991
  735   HG13  VAL 100          HG13      VAL 100  -3.434  -6.512   8.010
  736   HG21  VAL 100          HG21      VAL 100  -6.615  -6.414   7.849
  737   HG22  VAL 100          HG22      VAL 100  -6.371  -8.024   8.526
  738   HG23  VAL 100          HG23      VAL 100  -7.129  -7.837   6.945
  739    H    LEU 101           H        LEU 101  -3.003  -4.535   5.908
  740    HA   LEU 101           HA       LEU 101  -1.275  -6.067   4.033
  741    HB2  LEU 101           HB3      LEU 101  -1.815  -3.646   3.601
  742    HB3  LEU 101           HB2      LEU 101  -0.964  -3.254   5.076
  743    HG   LEU 101           HG       LEU 101   0.750  -4.928   3.567
  744   HD11  LEU 101          HD11      LEU 101   1.014  -3.470   1.554
  745   HD12  LEU 101          HD12      LEU 101  -0.439  -2.593   2.036
  746   HD13  LEU 101          HD13      LEU 101  -0.542  -4.295   1.585
  747   HD21  LEU 101          HD21      LEU 101   1.370  -3.158   5.215
  748   HD22  LEU 101          HD22      LEU 101   0.825  -1.935   4.070
  749   HD23  LEU 101          HD23      LEU 101   2.207  -2.956   3.676
  750    H    ARG 102           H        ARG 102   0.255  -7.396   5.033
  751    HA   ARG 102           HA       ARG 102   1.574  -6.316   7.489
  752    HB2  ARG 102           HB3      ARG 102  -0.143  -8.192   7.895
  753    HB3  ARG 102           HB2      ARG 102   0.992  -9.248   7.053
  754    HG2  ARG 102           HG3      ARG 102   2.770  -8.363   8.685
  755    HG3  ARG 102           HG2      ARG 102   1.423  -7.722   9.624
  756    HD2  ARG 102           HD3      ARG 102   0.472 -10.173   9.354
  757    HD3  ARG 102           HD2      ARG 102   2.167 -10.577   9.084
  758    HE   ARG 102           HE       ARG 102   0.987  -9.764  11.626
  759   HH11  ARG 102          HH22      ARG 102   3.802  -9.899   9.640
  760   HH12  ARG 102          HH21      ARG 102   4.908  -9.844  10.972
  761   HH21  ARG 102          HH11      ARG 102   2.414  -9.690  13.378
  762   HH22  ARG 102          HH12      ARG 102   4.121  -9.725  13.088
  763    H    ARG 103           H        ARG 103   3.756  -6.389   7.380
  764    HA   ARG 103           HA       ARG 103   5.233  -6.781   5.072
  765    HB2  ARG 103           HB3      ARG 103   6.878  -7.724   7.201
  766    HB3  ARG 103           HB2      ARG 103   6.862  -6.117   6.476
  767    HG2  ARG 103           HG3      ARG 103   5.076  -5.420   8.008
  768    HG3  ARG 103           HG2      ARG 103   5.027  -7.034   8.713
  769    HD2  ARG 103           HD3      ARG 103   7.639  -5.571   8.645
  770    HD3  ARG 103           HD2      ARG 103   6.438  -5.101   9.850
  771    HE   ARG 103           HE       ARG 103   6.537  -7.835  10.127
  772   HH11  ARG 103          HH22      ARG 103   8.879  -5.307   9.981
  773   HH12  ARG 103          HH21      ARG 103  10.011  -6.115  11.012
  774   HH21  ARG 103          HH11      ARG 103   8.004  -8.905  11.475
  775   HH22  ARG 103          HH12      ARG 103   9.515  -8.152  11.859
  776    H    ALA 104           H        ALA 104   5.928  -8.528   3.912
  777    HA   ALA 104           HA       ALA 104   4.856 -11.130   4.390
  778    HB1  ALA 104           HB1      ALA 104   5.736 -11.603   2.352
  779    HB2  ALA 104           HB2      ALA 104   7.350 -11.085   2.837
  780    HB3  ALA 104           HB3      ALA 104   6.167  -9.894   2.295
  781    H    THR 105           H        THR 105   5.724 -12.924   5.420
  782    HA   THR 105           HA       THR 105   8.080 -12.406   7.146
  783    HB   THR 105           HB       THR 105   6.887 -13.586   8.647
  784    HG1  THR 105           HG1      THR 105   6.518 -15.842   8.147
  785   HG21  THR 105          HG21      THR 105   5.004 -14.268   6.371
  786   HG22  THR 105          HG22      THR 105   4.893 -12.836   7.393
  787   HG23  THR 105          HG23      THR 105   4.648 -14.437   8.090
  788    HA   PRO 106           HA       PRO 106  11.188 -14.832   5.201
  789    HB2  PRO 106           HB2      PRO 106  10.727 -16.949   7.271
  790    HB3  PRO 106           HB3      PRO 106  12.249 -16.219   6.726
  791    HG2  PRO 106           HG3      PRO 106  11.023 -15.530   9.033
  792    HG3  PRO 106           HG2      PRO 106  12.030 -14.417   8.094
  793    HD2  PRO 106           HD3      PRO 106   9.128 -14.356   8.516
  794    HD3  PRO 106           HD2      PRO 106  10.192 -13.094   7.858
  Start of MODEL   16
    1    H1   SER   1           H        SER   1   9.700  23.325  -6.926
    2    H2   SER   1           H2       SER   1   9.457  22.635  -8.459
    3    H3   SER   1           1HT      SER   1   8.427  23.867  -7.906
    4    HA   SER   1           HA       SER   1   7.728  22.368  -6.065
    5    HB2  SER   1           HB3      SER   1   6.349  22.687  -8.088
    6    HB3  SER   1           HB2      SER   1   7.258  21.424  -8.911
    7    HG   SER   1           HG       SER   1   5.332  20.615  -7.995
    8    H    SER   2           H        SER   2   7.532  20.030  -5.513
    9    HA   SER   2           HA       SER   2   8.477  17.921  -5.106
   10    HB2  SER   2           HB3      SER   2   8.480  18.074  -7.765
   11    HB3  SER   2           HB2      SER   2  10.223  18.156  -7.525
   12    HG   SER   2           HG       SER   2  10.192  16.186  -6.586
   13    H    LEU   3           H        LEU   3   9.634  20.091  -3.804
   14    HA   LEU   3           HA       LEU   3  12.564  19.824  -4.121
   15    HB2  LEU   3           HB3      LEU   3  10.729  21.706  -2.696
   16    HB3  LEU   3           HB2      LEU   3  12.364  21.509  -2.065
   17    HG   LEU   3           HG       LEU   3  13.299  22.056  -4.271
   18   HD11  LEU   3          HD11      LEU   3  10.395  21.984  -5.017
   19   HD12  LEU   3          HD12      LEU   3  11.789  21.344  -5.889
   20   HD13  LEU   3          HD13      LEU   3  11.470  23.079  -5.888
   21   HD21  LEU   3          HD21      LEU   3  11.235  24.010  -3.213
   22   HD22  LEU   3          HD22      LEU   3  12.470  24.438  -4.397
   23   HD23  LEU   3          HD23      LEU   3  12.942  23.927  -2.775
   24    H    ILE   4           H        ILE   4  10.056  18.391  -2.343
   25    HA   ILE   4           HA       ILE   4  11.773  17.757  -0.017
   26    HB   ILE   4           HB       ILE   4   9.570  16.331   0.478
   27   HG12  ILE   4          HG13      ILE   4   8.529  18.569  -1.281
   28   HG13  ILE   4          HG12      ILE   4   8.704  16.908  -1.848
   29   HG21  ILE   4          HG21      ILE   4   9.747  19.355   0.662
   30   HG22  ILE   4          HG22      ILE   4  10.392  18.207   1.836
   31   HG23  ILE   4          HG23      ILE   4   8.650  18.342   1.600
   32   HD11  ILE   4          HD11      ILE   4   6.405  17.357  -1.032
   33   HD12  ILE   4          HD12      ILE   4   7.061  17.764   0.553
   34   HD13  ILE   4          HD13      ILE   4   7.209  16.120  -0.067
   35    H    LEU   5           H        LEU   5  13.048  15.975  -0.056
   36    HA   LEU   5           HA       LEU   5  12.586  13.934  -2.151
   37    HB2  LEU   5           HB3      LEU   5  14.882  14.974  -1.581
   38    HB3  LEU   5           HB2      LEU   5  14.845  13.947  -0.149
   39    HG   LEU   5           HG       LEU   5  14.169  12.117  -2.013
   40   HD11  LEU   5          HD11      LEU   5  16.190  13.824  -3.465
   41   HD12  LEU   5          HD12      LEU   5  14.460  14.020  -3.746
   42   HD13  LEU   5          HD13      LEU   5  15.241  12.477  -4.090
   43   HD21  LEU   5          HD21      LEU   5  16.007  11.905  -0.402
   44   HD22  LEU   5          HD22      LEU   5  16.979  13.047  -1.332
   45   HD23  LEU   5          HD23      LEU   5  16.575  11.472  -2.014
   46    H    LEU   6           H        LEU   6  13.681  13.589   1.235
   47    HA   LEU   6           HA       LEU   6  12.898  12.166   2.935
   48    HB2  LEU   6           HB3      LEU   6  10.619  13.085   1.819
   49    HB3  LEU   6           HB2      LEU   6  10.470  11.375   1.410
   50    HG   LEU   6           HG       LEU   6  11.122  10.986   3.916
   51   HD11  LEU   6          HD11      LEU   6   9.713  13.561   4.410
   52   HD12  LEU   6          HD12      LEU   6  11.412  13.670   3.953
   53   HD13  LEU   6          HD13      LEU   6  10.942  12.747   5.379
   54   HD21  LEU   6          HD21      LEU   6   8.944  10.385   3.005
   55   HD22  LEU   6          HD22      LEU   6   8.431  12.073   3.028
   56   HD23  LEU   6          HD23      LEU   6   8.701  11.213   4.543
   57    H    SER   7           H        SER   7  14.189  10.382   2.935
   58    HA   SER   7           HA       SER   7  13.879   8.380   0.748
   59    HB2  SER   7           HB3      SER   7  16.086   9.181   2.571
   60    HB3  SER   7           HB2      SER   7  15.986   7.470   2.165
   61    HG   SER   7           HG       SER   7  15.872   9.554   0.244
   62    H    ALA   8           H        ALA   8  12.124   7.127   1.389
   63    HA   ALA   8           HA       ALA   8  12.036   6.121   4.178
   64    HB1  ALA   8           HB1      ALA   8   9.807   5.421   3.704
   65    HB2  ALA   8           HB2      ALA   8  10.071   5.515   1.962
   66    HB3  ALA   8           HB3      ALA   8   9.979   6.992   2.923
   67    H    SER   9           H        SER   9  14.176   4.962   3.401
   68    HA   SER   9           HA       SER   9  13.691   2.545   1.796
   69    HB2  SER   9           HB3      SER   9  16.211   2.419   3.107
   70    HB3  SER   9           HB2      SER   9  15.895   2.782   1.413
   71    HG   SER   9           HG       SER   9  15.756   4.941   1.926
   72    H    ASP  10           H        ASP  10  13.446   3.453   5.078
   73    HA   ASP  10           HA       ASP  10  14.131   0.892   6.258
   74    HB2  ASP  10           HB3      ASP  10  12.187   2.641   7.659
   75    HB3  ASP  10           HB2      ASP  10  13.678   1.910   8.256
   76    H    LEU  11           H        LEU  11  11.295   2.226   4.738
   77    HA   LEU  11           HA       LEU  11   9.537   0.115   5.818
   78    HB2  LEU  11           HB3      LEU  11   8.979   2.209   3.695
   79    HB3  LEU  11           HB2      LEU  11   7.781   1.206   4.510
   80    HG   LEU  11           HG       LEU  11   9.604   3.214   5.869
   81   HD11  LEU  11          HD11      LEU  11   8.039   4.753   5.375
   82   HD12  LEU  11          HD12      LEU  11   6.811   3.762   6.165
   83   HD13  LEU  11          HD13      LEU  11   7.151   3.544   4.447
   84   HD21  LEU  11          HD21      LEU  11   9.156   1.667   7.547
   85   HD22  LEU  11          HD22      LEU  11   7.613   1.189   6.840
   86   HD23  LEU  11          HD23      LEU  11   7.751   2.720   7.703
   87    H    ALA  12           H        ALA  12  11.510   0.730   3.042
   88    HA   ALA  12           HA       ALA  12  10.355  -0.752   0.997
   89    HB1  ALA  12           HB1      ALA  12  12.383  -0.490   0.043
   90    HB2  ALA  12           HB2      ALA  12  13.150  -1.500   1.269
   91    HB3  ALA  12           HB3      ALA  12  12.927   0.226   1.559
   92    H    GLY  13           H        GLY  13  10.452  -3.013   0.397
   93    HA2  GLY  13           HA3      GLY  13  11.543  -5.204   1.495
   94    HA3  GLY  13           HA2      GLY  13  10.395  -4.793   2.762
   95    H    GLN  14           H        GLN  14   9.367  -6.866   2.283
   96    HA   GLN  14           HA       GLN  14   7.679  -6.796  -0.189
   97    HB2  GLN  14           HB3      GLN  14   9.370  -8.717   0.102
   98    HB3  GLN  14           HB2      GLN  14   8.341  -9.265   1.427
   99    HG2  GLN  14           HG3      GLN  14   6.433  -9.456  -0.071
  100    HG3  GLN  14           HG2      GLN  14   7.369  -8.776  -1.404
  101   HE21  GLN  14          HE22      GLN  14   7.308 -11.587   0.839
  102   HE22  GLN  14          HE21      GLN  14   8.098 -12.646  -0.226
  103    H    TRP  15           H        TRP  15   5.445  -7.325   0.115
  104    HA   TRP  15           HA       TRP  15   4.514  -7.720   2.894
  105    HB2  TRP  15           HB3      TRP  15   3.623  -5.400   1.156
  106    HB3  TRP  15           HB2      TRP  15   2.836  -5.883   2.646
  107    HD1  TRP  15           HD1      TRP  15   6.374  -4.744   1.471
  108    HE1  TRP  15           HE1      TRP  15   7.454  -3.441   3.407
  109    HE3  TRP  15           HE3      TRP  15   2.729  -5.236   5.032
  110    HZ2  TRP  15           HZ2      TRP  15   6.864  -2.692   6.099
  111    HZ3  TRP  15           HZ3      TRP  15   3.022  -4.207   7.270
  112    HH2  TRP  15           HH2      TRP  15   5.080  -2.938   7.806
  113    H    THR  16           H        THR  16   1.981  -7.904   2.773
  114    HA   THR  16           HA       THR  16   1.097  -9.103   0.194
  115    HB   THR  16           HB       THR  16   0.088 -10.862   2.062
  116    HG1  THR  16           HG1      THR  16   2.659  -9.989   2.796
  117   HG21  THR  16          HG21      THR  16   2.576 -11.051   0.354
  118   HG22  THR  16          HG22      THR  16   0.943 -11.556  -0.081
  119   HG23  THR  16          HG23      THR  16   1.837 -12.434   1.159
  120    H    LEU  17           H        LEU  17  -1.298  -9.447   0.235
  121    HA   LEU  17           HA       LEU  17  -2.652  -7.586   2.159
  122    HB2  LEU  17           HB3      LEU  17  -2.600  -7.471  -0.639
  123    HB3  LEU  17           HB2      LEU  17  -4.167  -8.184  -0.256
  124    HG   LEU  17           HG       LEU  17  -4.491  -6.318   1.428
  125   HD11  LEU  17          HD11      LEU  17  -2.842  -4.830   1.814
  126   HD12  LEU  17          HD12      LEU  17  -2.653  -4.511   0.091
  127   HD13  LEU  17          HD13      LEU  17  -1.783  -5.850   0.840
  128   HD21  LEU  17          HD21      LEU  17  -5.765  -5.769  -0.380
  129   HD22  LEU  17          HD22      LEU  17  -4.467  -6.122  -1.519
  130   HD23  LEU  17          HD23      LEU  17  -4.508  -4.569  -0.684
  131    H    GLN  18           H        GLN  18  -4.567  -8.360   3.133
  132    HA   GLN  18           HA       GLN  18  -5.355 -11.166   2.474
  133    HB2  GLN  18           HB3      GLN  18  -4.052 -10.306   4.841
  134    HB3  GLN  18           HB2      GLN  18  -5.740 -10.587   5.273
  135    HG2  GLN  18           HG3      GLN  18  -5.632 -12.829   4.243
  136    HG3  GLN  18           HG2      GLN  18  -3.943 -12.550   3.818
  137   HE21  GLN  18          HE22      GLN  18  -6.123 -12.692   6.679
  138   HE22  GLN  18          HE21      GLN  18  -4.917 -13.209   7.758
  139    H    GLN  19           H        GLN  19  -7.426 -11.068   1.823
  140    HA   GLN  19           HA       GLN  19  -9.201  -8.949   2.963
  141    HB2  GLN  19           HB3      GLN  19  -9.281  -8.750   0.624
  142    HB3  GLN  19           HB2      GLN  19  -9.182 -10.493   0.376
  143    HG2  GLN  19           HG3      GLN  19 -11.429 -10.834   0.930
  144    HG3  GLN  19           HG2      GLN  19 -11.537  -9.322   1.829
  145   HE21  GLN  19          HE22      GLN  19 -12.003  -7.379   0.646
  146   HE22  GLN  19          HE21      GLN  19 -12.375  -7.385  -1.011
  147    H    ASP  20           H        ASP  20 -10.184  -9.844   4.759
  148    HA   ASP  20           HA       ASP  20 -10.762 -12.657   5.004
  149    HB2  ASP  20           HB3      ASP  20 -10.731 -10.469   6.739
  150    HB3  ASP  20           HB2      ASP  20 -12.418 -10.979   6.703
  151    H    GLU  21           H        GLU  21 -13.260 -13.143   5.689
  152    HA   GLU  21           HA       GLU  21 -15.433 -13.444   4.865
  153    HB2  GLU  21           HB3      GLU  21 -14.972 -10.683   4.962
  154    HB3  GLU  21           HB2      GLU  21 -15.648 -10.968   3.356
  155    HG2  GLU  21           HG3      GLU  21 -17.504 -12.260   4.403
  156    HG3  GLU  21           HG2      GLU  21 -16.854 -11.856   5.993
  157    H    ALA  22           H        ALA  22 -12.777 -13.369   2.950
  158    HA   ALA  22           HA       ALA  22 -14.075 -14.732   0.772
  159    HB1  ALA  22           HB1      ALA  22 -12.974 -12.597  -0.685
  160    HB2  ALA  22           HB2      ALA  22 -13.916 -11.849   0.605
  161    HB3  ALA  22           HB3      ALA  22 -14.682 -12.987  -0.502
  162    HA   PRO  23           HA       PRO  23  -9.626 -15.854   1.475
  163    HB2  PRO  23           HB2      PRO  23 -10.533 -17.898  -0.517
  164    HB3  PRO  23           HB3      PRO  23  -9.548 -18.106   0.946
  165    HG2  PRO  23           HG3      PRO  23 -12.110 -18.798   0.911
  166    HG3  PRO  23           HG2      PRO  23 -11.373 -18.063   2.345
  167    HD2  PRO  23           HD3      PRO  23 -13.261 -16.863   0.377
  168    HD3  PRO  23           HD2      PRO  23 -13.049 -16.497   2.105
  169    H    ALA  24           H        ALA  24  -8.228 -14.556   0.392
  170    HA   ALA  24           HA       ALA  24  -7.544 -14.956  -2.347
  171    HB1  ALA  24           HB1      ALA  24  -8.314 -12.591  -3.093
  172    HB2  ALA  24           HB2      ALA  24  -9.445 -12.689  -1.744
  173    HB3  ALA  24           HB3      ALA  24  -9.525 -13.872  -3.050
  174    H    ILE  25           H        ILE  25  -5.384 -14.604  -2.039
  175    HA   ILE  25           HA       ILE  25  -4.550 -12.210  -0.447
  176    HB   ILE  25           HB       ILE  25  -3.821 -14.263   0.609
  177   HG12  ILE  25          HG13      ILE  25  -1.439 -13.242  -0.955
  178   HG13  ILE  25          HG12      ILE  25  -2.187 -12.311   0.344
  179   HG21  ILE  25          HG21      ILE  25  -3.543 -15.110  -2.145
  180   HG22  ILE  25          HG22      ILE  25  -3.575 -16.092  -0.681
  181   HG23  ILE  25          HG23      ILE  25  -2.051 -15.416  -1.256
  182   HD11  ILE  25          HD11      ILE  25  -1.473 -15.170   0.874
  183   HD12  ILE  25          HD12      ILE  25  -1.512 -13.801   1.987
  184   HD13  ILE  25          HD13      ILE  25  -0.177 -13.975   0.848
  185    H    CYS  26           H        CYS  26  -2.509 -11.187  -1.220
  186    HA   CYS  26           HA       CYS  26  -1.847 -11.696  -4.069
  187    HB2  CYS  26           HB3      CYS  26  -3.251  -9.301  -3.027
  188    HB3  CYS  26           HB2      CYS  26  -1.892  -8.981  -4.096
  189    H    HIS  27           H        HIS  27   0.353 -11.687  -4.216
  190    HA   HIS  27           HA       HIS  27   2.023 -10.824  -2.024
  191    HB2  HIS  27           HB3      HIS  27   2.357 -12.213  -4.551
  192    HB3  HIS  27           HB2      HIS  27   3.618 -10.998  -4.339
  193    HD1  HIS  27           HD1      HIS  27   5.610 -12.053  -3.287
  194    HD2  HIS  27           HD2      HIS  27   2.063 -13.583  -1.710
  195    HE1  HIS  27           HE1      HIS  27   6.279 -13.706  -1.485
  196    HE2  HIS  27           HE2      HIS  27   4.128 -14.643  -0.520
  197    H    LEU  28           H        LEU  28   3.016  -8.844  -1.754
  198    HA   LEU  28           HA       LEU  28   2.700  -6.829  -3.945
  199    HB2  LEU  28           HB3      LEU  28   1.874  -6.768  -1.114
  200    HB3  LEU  28           HB2      LEU  28   2.773  -5.350  -1.624
  201    HG   LEU  28           HG       LEU  28   0.300  -5.112  -1.926
  202   HD11  LEU  28          HD11      LEU  28   1.257  -5.169  -4.722
  203   HD12  LEU  28          HD12      LEU  28   2.274  -4.264  -3.602
  204   HD13  LEU  28          HD13      LEU  28   0.573  -3.843  -3.787
  205   HD21  LEU  28          HD21      LEU  28   0.263  -7.669  -2.663
  206   HD22  LEU  28          HD22      LEU  28   0.402  -6.952  -4.267
  207   HD23  LEU  28          HD23      LEU  28  -0.953  -6.526  -3.224
  208    H    GLU  29           H        GLU  29   4.369  -5.115  -3.870
  209    HA   GLU  29           HA       GLU  29   6.797  -5.792  -2.303
  210    HB2  GLU  29           HB3      GLU  29   6.514  -6.546  -4.988
  211    HB3  GLU  29           HB2      GLU  29   7.487  -5.075  -5.039
  212    HG2  GLU  29           HG3      GLU  29   8.071  -7.481  -3.285
  213    HG3  GLU  29           HG2      GLU  29   8.881  -7.119  -4.809
  214    H    LEU  30           H        LEU  30   7.382  -3.953  -1.333
  215    HA   LEU  30           HA       LEU  30   6.501  -1.360  -2.419
  216    HB2  LEU  30           HB3      LEU  30   7.560  -2.387   0.165
  217    HB3  LEU  30           HB2      LEU  30   7.931  -0.711  -0.226
  218    HG   LEU  30           HG       LEU  30   5.575  -0.196  -0.503
  219   HD11  LEU  30          HD11      LEU  30   5.342  -3.165  -0.421
  220   HD12  LEU  30          HD12      LEU  30   4.484  -2.001  -1.426
  221   HD13  LEU  30          HD13      LEU  30   4.017  -2.223   0.258
  222   HD21  LEU  30          HD21      LEU  30   4.959  -0.262   1.751
  223   HD22  LEU  30          HD22      LEU  30   6.703  -0.510   1.854
  224   HD23  LEU  30          HD23      LEU  30   5.608  -1.887   1.979
  225    H    ARG  31           H        ARG  31   7.797  -0.730  -4.126
  226    HA   ARG  31           HA       ARG  31  10.584  -1.363  -4.349
  227    HB2  ARG  31           HB3      ARG  31   8.643   0.310  -5.791
  228    HB3  ARG  31           HB2      ARG  31  10.293   0.933  -5.845
  229    HG2  ARG  31           HG3      ARG  31  11.108  -1.241  -6.647
  230    HG3  ARG  31           HG2      ARG  31   9.475  -1.901  -6.553
  231    HD2  ARG  31           HD3      ARG  31   9.954  -1.249  -8.858
  232    HD3  ARG  31           HD2      ARG  31   8.720  -0.182  -8.191
  233    HE   ARG  31           HE       ARG  31  11.057   1.178  -7.671
  234   HH11  ARG  31          HH22      ARG  31   9.653  -0.328 -10.436
  235   HH12  ARG  31          HH21      ARG  31  10.372   0.769 -11.566
  236   HH21  ARG  31          HH11      ARG  31  12.006   2.620  -9.129
  237   HH22  ARG  31          HH12      ARG  31  11.706   2.439 -10.826
  238    H    ASP  32           H        ASP  32  12.356   0.304  -4.342
  239    HA   ASP  32           HA       ASP  32  12.018   2.142  -2.006
  240    HB2  ASP  32           HB3      ASP  32  13.747   0.256  -1.930
  241    HB3  ASP  32           HB2      ASP  32  14.625   1.149  -3.174
  242    H    SER  33           H        SER  33  11.790   2.329  -5.211
  243    HA   SER  33           HA       SER  33  13.624   4.577  -5.695
  244    HB2  SER  33           HB3      SER  33  11.382   3.591  -7.476
  245    HB3  SER  33           HB2      SER  33  12.784   4.545  -7.949
  246    HG   SER  33           HG       SER  33  12.610   1.985  -8.036
  247    H    GLU  34           H        GLU  34  13.057   6.719  -5.562
  248    HA   GLU  34           HA       GLU  34  10.508   7.403  -4.328
  249    HB2  GLU  34           HB3      GLU  34  11.342   9.704  -4.391
  250    HB3  GLU  34           HB2      GLU  34  12.619   8.626  -3.823
  251    HG2  GLU  34           HG3      GLU  34  13.142   8.515  -6.453
  252    HG3  GLU  34           HG2      GLU  34  12.400  10.114  -6.397
  253    H    VAL  35           H        VAL  35   8.992   8.982  -5.302
  254    HA   VAL  35           HA       VAL  35   9.076   9.142  -8.269
  255    HB   VAL  35           HB       VAL  35   6.754   7.997  -6.685
  256   HG11  VAL  35          HG11      VAL  35   6.240   7.646  -9.378
  257   HG12  VAL  35          HG12      VAL  35   6.948   9.261  -9.328
  258   HG13  VAL  35          HG13      VAL  35   5.520   8.893  -8.361
  259   HG21  VAL  35          HG21      VAL  35   8.376   6.281  -6.998
  260   HG22  VAL  35          HG22      VAL  35   8.762   6.838  -8.627
  261   HG23  VAL  35          HG23      VAL  35   7.216   6.051  -8.305
  262    H    ALA  36           H        ALA  36   8.774  11.270  -8.711
  263    HA   ALA  36           HA       ALA  36   7.456  13.011  -6.743
  264    HB1  ALA  36           HB1      ALA  36   7.935  14.677  -8.783
  265    HB2  ALA  36           HB2      ALA  36   9.054  13.392  -9.237
  266    HB3  ALA  36           HB3      ALA  36   9.211  14.185  -7.670
  267    H    GLU  37           H        GLU  37   6.722  11.519  -9.840
  268    HA   GLU  37           HA       GLU  37   4.560  13.110 -10.700
  269    HB2  GLU  37           HB3      GLU  37   5.540  11.126 -11.922
  270    HB3  GLU  37           HB2      GLU  37   4.648  10.080 -10.818
  271    HG2  GLU  37           HG3      GLU  37   3.307  10.346 -12.807
  272    HG3  GLU  37           HG2      GLU  37   2.538  11.281 -11.524
  273    H    ALA  38           H        ALA  38   4.741  10.733  -8.120
  274    HA   ALA  38           HA       ALA  38   1.902  11.362  -7.400
  275    HB1  ALA  38           HB1      ALA  38   3.070   8.914  -6.260
  276    HB2  ALA  38           HB2      ALA  38   2.906   8.878  -8.016
  277    HB3  ALA  38           HB3      ALA  38   1.490   9.163  -7.004
  278    H    SER  39           H        SER  39   5.072  11.852  -6.561
  279    HA   SER  39           HA       SER  39   6.037  12.753  -4.635
  280    HB2  SER  39           HB3      SER  39   3.453  12.859  -3.169
  281    HB3  SER  39           HB2      SER  39   4.700  14.091  -3.335
  282    HG   SER  39           HG       SER  39   2.457  13.992  -4.619
  283    H    GLY  40           H        GLY  40   5.863   9.918  -4.931
  284    HA2  GLY  40           HA3      GLY  40   6.156   9.150  -2.107
  285    HA3  GLY  40           HA2      GLY  40   4.882   8.301  -2.980
  286    H    TYR  41           H        TYR  41   6.010   6.294  -2.802
  287    HA   TYR  41           HA       TYR  41   8.506   6.092  -4.440
  288    HB2  TYR  41           HB3      TYR  41   7.513   4.232  -2.261
  289    HB3  TYR  41           HB2      TYR  41   9.056   4.121  -3.111
  290    HD1  TYR  41           HD1      TYR  41   7.017   6.452  -1.001
  291    HD2  TYR  41           HD2      TYR  41  10.935   5.270  -2.305
  292    HE1  TYR  41           HE1      TYR  41   8.032   8.045   0.602
  293    HE2  TYR  41           HE2      TYR  41  11.951   6.860  -0.694
  294    HH   TYR  41           HH       TYR  41   9.909   8.903   1.402
  295    H    ASP  42           H        ASP  42   8.639   4.319  -5.917
  296    HA   ASP  42           HA       ASP  42   6.220   3.709  -7.288
  297    HB2  ASP  42           HB3      ASP  42   8.514   3.685  -8.293
  298    HB3  ASP  42           HB2      ASP  42   8.823   2.174  -7.442
  299    H    LEU  43           H        LEU  43   5.435   1.496  -7.732
  300    HA   LEU  43           HA       LEU  43   5.574  -0.310  -5.346
  301    HB2  LEU  43           HB3      LEU  43   3.399   0.984  -5.413
  302    HB3  LEU  43           HB2      LEU  43   3.085   0.264  -6.986
  303    HG   LEU  43           HG       LEU  43   3.331  -2.020  -5.866
  304   HD11  LEU  43          HD11      LEU  43   2.524  -1.208  -3.258
  305   HD12  LEU  43          HD12      LEU  43   4.021  -0.355  -3.627
  306   HD13  LEU  43          HD13      LEU  43   3.964  -2.117  -3.710
  307   HD21  LEU  43          HD21      LEU  43   1.163  -1.186  -6.461
  308   HD22  LEU  43          HD22      LEU  43   1.135  -0.102  -5.072
  309   HD23  LEU  43          HD23      LEU  43   1.040  -1.843  -4.833
  310    H    GLY  44           H        GLY  44   6.059  -2.376  -5.881
  311    HA2  GLY  44           HA3      GLY  44   5.591  -3.284  -8.689
  312    HA3  GLY  44           HA2      GLY  44   7.112  -3.619  -7.861
  313    H    GLY  45           H        GLY  45   5.202  -5.593  -8.840
  314    HA2  GLY  45           HA3      GLY  45   5.214  -7.686  -7.239
  315    HA3  GLY  45           HA2      GLY  45   4.081  -6.711  -6.318
  316    H    ASP  46           H        ASP  46   2.270  -8.015  -6.630
  317    HA   ASP  46           HA       ASP  46   1.429  -8.586  -9.427
  318    HB2  ASP  46           HB3      ASP  46   1.364 -10.181  -7.218
  319    HB3  ASP  46           HB2      ASP  46  -0.261  -9.495  -7.173
  320    H    THR  47           H        THR  47   1.336  -5.917  -8.000
  321    HA   THR  47           HA       THR  47  -1.096  -5.009  -7.131
  322    HB   THR  47           HB       THR  47  -0.371  -2.913  -7.691
  323    HG1  THR  47           HG1      THR  47   0.790  -2.802  -9.904
  324   HG21  THR  47          HG21      THR  47   2.078  -4.410  -8.647
  325   HG22  THR  47          HG22      THR  47   1.640  -4.262  -6.945
  326   HG23  THR  47          HG23      THR  47   2.018  -2.821  -7.887
  327    H    ALA  48           H        ALA  48  -0.475  -6.339 -10.280
  328    HA   ALA  48           HA       ALA  48  -2.748  -5.191 -11.633
  329    HB1  ALA  48           HB1      ALA  48  -0.737  -6.387 -12.689
  330    HB2  ALA  48           HB2      ALA  48  -2.322  -6.786 -13.353
  331    HB3  ALA  48           HB3      ALA  48  -1.532  -7.894 -12.232
  332    H    CYS  49           H        CYS  49  -2.805  -6.923  -8.917
  333    HA   CYS  49           HA       CYS  49  -5.227  -8.514  -9.673
  334    HB2  CYS  49           HB3      CYS  49  -4.733 -10.001  -7.879
  335    HB3  CYS  49           HB2      CYS  49  -3.177  -9.694  -8.650
  336    H    LEU  50           H        LEU  50  -4.006  -5.890  -7.788
  337    HA   LEU  50           HA       LEU  50  -6.071  -5.809  -5.785
  338    HB2  LEU  50           HB3      LEU  50  -4.454  -3.507  -6.912
  339    HB3  LEU  50           HB2      LEU  50  -5.323  -3.519  -5.382
  340    HG   LEU  50           HG       LEU  50  -3.157  -5.527  -6.018
  341   HD11  LEU  50          HD11      LEU  50  -2.252  -3.209  -6.162
  342   HD12  LEU  50          HD12      LEU  50  -1.591  -4.107  -4.795
  343   HD13  LEU  50          HD13      LEU  50  -2.852  -2.901  -4.533
  344   HD21  LEU  50          HD21      LEU  50  -3.045  -5.487  -3.450
  345   HD22  LEU  50          HD22      LEU  50  -4.469  -6.238  -4.162
  346   HD23  LEU  50          HD23      LEU  50  -4.568  -4.607  -3.502
  347    H    THR  51           H        THR  51  -6.349  -5.475  -9.079
  348    HA   THR  51           HA       THR  51  -8.110  -3.217  -9.302
  349    HB   THR  51           HB       THR  51  -8.941  -4.935 -11.289
  350    HG1  THR  51           HG1      THR  51  -7.107  -6.258 -10.210
  351   HG21  THR  51          HG21      THR  51  -7.249  -3.735 -12.686
  352   HG22  THR  51          HG22      THR  51  -6.523  -3.111 -11.206
  353   HG23  THR  51          HG23      THR  51  -8.170  -2.656 -11.640
  354    H    ARG  52           H        ARG  52  -8.543  -5.675  -7.326
  355    HA   ARG  52           HA       ARG  52 -11.468  -5.994  -7.855
  356    HB2  ARG  52           HB3      ARG  52 -11.383  -8.041  -6.626
  357    HB3  ARG  52           HB2      ARG  52  -9.983  -8.070  -7.698
  358    HG2  ARG  52           HG3      ARG  52  -8.818  -6.882  -5.617
  359    HG3  ARG  52           HG2      ARG  52 -10.096  -7.719  -4.735
  360    HD2  ARG  52           HD3      ARG  52  -8.125  -9.021  -6.637
  361    HD3  ARG  52           HD2      ARG  52  -8.074  -9.121  -4.877
  362    HE   ARG  52           HE       ARG  52 -10.631 -10.014  -5.664
  363   HH11  ARG  52          HH22      ARG  52  -7.306 -10.823  -6.076
  364   HH12  ARG  52          HH21      ARG  52  -7.602 -12.521  -6.243
  365   HH21  ARG  52          HH11      ARG  52 -11.037 -12.227  -5.880
  366   HH22  ARG  52          HH12      ARG  52  -9.714 -13.316  -6.132
  367    H    TRP  53           H        TRP  53  -9.088  -4.664  -5.742
  368    HA   TRP  53           HA       TRP  53 -11.212  -4.010  -3.725
  369    HB2  TRP  53           HB3      TRP  53  -8.208  -4.152  -3.323
  370    HB3  TRP  53           HB2      TRP  53  -9.402  -3.789  -2.079
  371    HD1  TRP  53           HD1      TRP  53 -11.550  -5.950  -2.510
  372    HE1  TRP  53           HE1      TRP  53 -11.038  -8.447  -2.157
  373    HE3  TRP  53           HE3      TRP  53  -6.465  -5.889  -2.985
  374    HZ2  TRP  53           HZ2      TRP  53  -8.776 -10.194  -2.077
  375    HZ3  TRP  53           HZ3      TRP  53  -5.159  -7.983  -2.763
  376    HH2  TRP  53           HH2      TRP  53  -6.306 -10.133  -2.309
  377    H    LEU  54           H        LEU  54  -8.533  -2.814  -5.669
  378    HA   LEU  54           HA       LEU  54  -9.131  -0.030  -4.812
  379    HB2  LEU  54           HB3      LEU  54  -6.855  -1.215  -6.423
  380    HB3  LEU  54           HB2      LEU  54  -7.005   0.494  -6.058
  381    HG   LEU  54           HG       LEU  54  -6.894  -1.681  -3.948
  382   HD11  LEU  54          HD11      LEU  54  -4.780  -1.269  -5.404
  383   HD12  LEU  54          HD12      LEU  54  -4.607  -1.252  -3.651
  384   HD13  LEU  54          HD13      LEU  54  -4.680   0.268  -4.546
  385   HD21  LEU  54          HD21      LEU  54  -6.063   0.726  -2.855
  386   HD22  LEU  54          HD22      LEU  54  -7.654   0.001  -2.644
  387   HD23  LEU  54          HD23      LEU  54  -7.397   1.206  -3.901
  388    HA   PRO  55           HA       PRO  55 -11.196   0.584  -8.706
  389    HB2  PRO  55           HB2      PRO  55 -10.938   3.264  -9.094
  390    HB3  PRO  55           HB3      PRO  55 -11.996   2.571  -7.851
  391    HG2  PRO  55           HG3      PRO  55  -9.335   3.837  -7.581
  392    HG3  PRO  55           HG2      PRO  55 -10.715   3.858  -6.476
  393    HD2  PRO  55           HD3      PRO  55  -8.461   2.248  -6.185
  394    HD3  PRO  55           HD2      PRO  55 -10.019   1.969  -5.395
  395    H    SER  56           H        SER  56  -7.850   1.330  -8.398
  396    HA   SER  56           HA       SER  56  -7.464   0.881 -11.286
  397    HB2  SER  56           HB3      SER  56  -5.856   3.146 -10.334
  398    HB3  SER  56           HB2      SER  56  -6.751   2.961 -11.840
  399    HG   SER  56           HG       SER  56  -8.619   3.545 -10.766
  400    H    GLU  57           H        GLU  57  -5.209   0.320 -11.759
  401    HA   GLU  57           HA       GLU  57  -3.982  -1.194  -9.651
  402    HB2  GLU  57           HB3      GLU  57  -3.793  -1.699 -12.103
  403    HB3  GLU  57           HB2      GLU  57  -2.715  -0.310 -12.254
  404    HG2  GLU  57           HG3      GLU  57  -1.156  -1.314 -10.650
  405    HG3  GLU  57           HG2      GLU  57  -2.246  -2.683 -10.423
  406    HA   PRO  58           HA       PRO  58  -1.806   2.460  -8.042
  407    HB2  PRO  58           HB2      PRO  58  -0.537   1.243  -5.951
  408    HB3  PRO  58           HB3      PRO  58  -2.217   1.777  -5.896
  409    HG2  PRO  58           HG3      PRO  58  -1.116  -0.937  -6.201
  410    HG3  PRO  58           HG2      PRO  58  -2.620  -0.398  -5.459
  411    HD2  PRO  58           HD3      PRO  58  -2.414  -1.567  -7.978
  412    HD3  PRO  58           HD2      PRO  58  -3.796  -0.608  -7.407
  413    H    ARG  59           H        ARG  59  -0.052   3.142  -9.120
  414    HA   ARG  59           HA       ARG  59   2.207   1.268  -9.597
  415    HB2  ARG  59           HB3      ARG  59   1.052   3.546 -11.012
  416    HB3  ARG  59           HB2      ARG  59   2.799   3.697 -10.829
  417    HG2  ARG  59           HG3      ARG  59   2.178   2.478 -12.907
  418    HG3  ARG  59           HG2      ARG  59   3.125   1.477 -11.807
  419    HD2  ARG  59           HD3      ARG  59   1.424   0.017 -11.510
  420    HD3  ARG  59           HD2      ARG  59   0.250   1.313 -11.284
  421    HE   ARG  59           HE       ARG  59   0.791  -0.088 -13.782
  422   HH11  ARG  59          HH22      ARG  59  -0.249   2.828 -12.265
  423   HH12  ARG  59          HH21      ARG  59  -1.207   3.346 -13.613
  424   HH21  ARG  59          HH11      ARG  59  -0.451   0.571 -15.551
  425   HH22  ARG  59          HH12      ARG  59  -1.321   2.066 -15.474
  426    H    ALA  60           H        ALA  60   1.256   3.566  -7.370
  427    HA   ALA  60           HA       ALA  60   4.017   3.808  -6.368
  428    HB1  ALA  60           HB1      ALA  60   3.839   6.284  -6.162
  429    HB2  ALA  60           HB2      ALA  60   2.331   6.228  -7.073
  430    HB3  ALA  60           HB3      ALA  60   3.843   5.752  -7.844
  431    H    TRP  61           H        TRP  61   4.034   4.808  -4.184
  432    HA   TRP  61           HA       TRP  61   1.433   4.906  -2.782
  433    HB2  TRP  61           HB3      TRP  61   2.290   3.359  -0.994
  434    HB3  TRP  61           HB2      TRP  61   2.011   2.558  -2.535
  435    HD1  TRP  61           HD1      TRP  61   4.421   2.671  -4.165
  436    HE1  TRP  61           HE1      TRP  61   6.770   1.948  -3.404
  437    HE3  TRP  61           HE3      TRP  61   3.811   2.901   0.898
  438    HZ2  TRP  61           HZ2      TRP  61   8.201   1.509  -0.969
  439    HZ3  TRP  61           HZ3      TRP  61   5.679   2.305   2.414
  440    HH2  TRP  61           HH2      TRP  61   7.873   1.614   1.488
  441    H    ARG  62           H        ARG  62   1.678   5.971  -0.662
  442    HA   ARG  62           HA       ARG  62   4.285   7.403  -0.331
  443    HB2  ARG  62           HB3      ARG  62   2.919   9.010  -1.389
  444    HB3  ARG  62           HB2      ARG  62   1.504   8.546  -0.443
  445    HG2  ARG  62           HG3      ARG  62   2.306   9.584   1.505
  446    HG3  ARG  62           HG2      ARG  62   3.972   9.595   0.925
  447    HD2  ARG  62           HD3      ARG  62   3.672  11.498  -0.306
  448    HD3  ARG  62           HD2      ARG  62   2.015  11.077  -0.743
  449    HE   ARG  62           HE       ARG  62   1.897  11.647   1.981
  450   HH11  ARG  62          HH22      ARG  62   2.977  13.206  -0.898
  451   HH12  ARG  62          HH21      ARG  62   2.614  14.802  -0.331
  452   HH21  ARG  62          HH11      ARG  62   1.416  13.723   2.741
  453   HH22  ARG  62          HH12      ARG  62   1.731  15.094   1.731
  454    HA   PRO  63           HA       PRO  63   3.296   5.574   3.780
  455    HB2  PRO  63           HB2      PRO  63   5.898   6.696   4.551
  456    HB3  PRO  63           HB3      PRO  63   5.342   5.017   4.600
  457    HG2  PRO  63           HG3      PRO  63   7.167   5.999   2.822
  458    HG3  PRO  63           HG2      PRO  63   6.183   4.557   2.564
  459    HD2  PRO  63           HD3      PRO  63   5.953   7.217   1.309
  460    HD3  PRO  63           HD2      PRO  63   5.354   5.642   0.744
  461    H    THR  64           H        THR  64   2.055   6.755   5.222
  462    HA   THR  64           HA       THR  64   2.617   9.667   5.489
  463    HB   THR  64           HB       THR  64   0.270   9.249   6.822
  464    HG1  THR  64           HG1      THR  64   0.578   6.976   6.013
  465   HG21  THR  64          HG21      THR  64   0.601   9.589   3.827
  466   HG22  THR  64          HG22      THR  64   0.673  10.888   5.017
  467   HG23  THR  64          HG23      THR  64  -0.835  10.014   4.756
  468    HA   PRO  65           HA       PRO  65   4.140   9.134   9.607
  469    HB2  PRO  65           HB2      PRO  65   2.983  11.264  10.929
  470    HB3  PRO  65           HB3      PRO  65   4.387  11.399   9.856
  471    HG2  PRO  65           HG3      PRO  65   1.530  12.011   9.323
  472    HG3  PRO  65           HG2      PRO  65   2.991  12.844   8.764
  473    HD2  PRO  65           HD3      PRO  65   1.554  11.159   7.169
  474    HD3  PRO  65           HD2      PRO  65   3.307  11.390   6.991
  475    H    ALA  66           H        ALA  66   1.451   7.861   8.911
  476    HA   ALA  66           HA       ALA  66   0.803   6.983  11.589
  477    HB1  ALA  66           HB1      ALA  66  -0.990   8.982  10.222
  478    HB2  ALA  66           HB2      ALA  66  -0.446   8.953  11.901
  479    HB3  ALA  66           HB3      ALA  66  -1.657   7.798  11.345
  480    H    GLY  67           H        GLY  67   1.329   6.071   8.709
  481    HA2  GLY  67           HA3      GLY  67   0.131   3.634   8.621
  482    HA3  GLY  67           HA2      GLY  67  -1.165   4.669   8.025
  483    H    ILE  68           H        ILE  68  -1.065   3.690   5.921
  484    HA   ILE  68           HA       ILE  68   1.175   4.730   4.259
  485    HB   ILE  68           HB       ILE  68   0.127   1.903   3.975
  486   HG12  ILE  68          HG13      ILE  68   2.432   3.008   5.578
  487   HG13  ILE  68          HG12      ILE  68   1.228   1.811   6.058
  488   HG21  ILE  68          HG21      ILE  68   1.281   3.248   2.062
  489   HG22  ILE  68          HG22      ILE  68   1.854   1.617   2.404
  490   HG23  ILE  68          HG23      ILE  68   2.755   3.010   3.000
  491   HD11  ILE  68          HD11      ILE  68   2.239   0.394   4.101
  492   HD12  ILE  68          HD12      ILE  68   3.101   0.475   5.639
  493   HD13  ILE  68          HD13      ILE  68   3.626   1.470   4.279
  494    H    ALA  69           H        ALA  69   0.546   5.224   2.120
  495    HA   ALA  69           HA       ALA  69  -2.362   4.856   1.490
  496    HB1  ALA  69           HB1      ALA  69  -1.731   7.212   2.177
  497    HB2  ALA  69           HB2      ALA  69  -2.444   7.076   0.568
  498    HB3  ALA  69           HB3      ALA  69  -0.701   7.274   0.747
  499    H    LEU  70           H        LEU  70  -2.855   4.474  -0.702
  500    HA   LEU  70           HA       LEU  70  -0.504   3.734  -2.403
  501    HB2  LEU  70           HB3      LEU  70  -3.354   2.756  -2.354
  502    HB3  LEU  70           HB2      LEU  70  -2.209   2.315  -3.613
  503    HG   LEU  70           HG       LEU  70  -1.264   1.964  -0.823
  504   HD11  LEU  70          HD11      LEU  70  -3.479   1.130  -0.472
  505   HD12  LEU  70          HD12      LEU  70  -2.464  -0.284  -0.748
  506   HD13  LEU  70          HD13      LEU  70  -3.497   0.325  -2.041
  507   HD21  LEU  70          HD21      LEU  70  -0.088   0.149  -1.775
  508   HD22  LEU  70          HD22      LEU  70  -0.128   1.338  -3.078
  509   HD23  LEU  70          HD23      LEU  70  -1.247  -0.024  -3.094
  510    H    LEU  71           H        LEU  71  -0.229   4.840  -4.321
  511    HA   LEU  71           HA       LEU  71  -2.411   6.720  -5.142
  512    HB2  LEU  71           HB3      LEU  71   0.577   6.875  -5.643
  513    HB3  LEU  71           HB2      LEU  71  -0.615   8.047  -6.207
  514    HG   LEU  71           HG       LEU  71  -0.571   7.373  -3.293
  515   HD11  LEU  71          HD11      LEU  71   1.151   9.116  -2.920
  516   HD12  LEU  71          HD12      LEU  71   1.388   9.240  -4.662
  517   HD13  LEU  71          HD13      LEU  71   1.799   7.745  -3.822
  518   HD21  LEU  71          HD21      LEU  71  -2.138   8.998  -4.700
  519   HD22  LEU  71          HD22      LEU  71  -0.789  10.112  -4.486
  520   HD23  LEU  71          HD23      LEU  71  -1.608   9.440  -3.078
  521    H    GLU  72           H        GLU  72  -2.397   7.155  -7.568
  522    HA   GLU  72           HA       GLU  72  -1.979   4.572  -9.024
  523    HB2  GLU  72           HB3      GLU  72  -3.708   5.820 -10.618
  524    HB3  GLU  72           HB2      GLU  72  -4.252   4.922  -9.202
  525    HG2  GLU  72           HG3      GLU  72  -5.231   7.245  -9.406
  526    HG3  GLU  72           HG2      GLU  72  -4.395   6.934  -7.885
  527    H    ARG  73           H        ARG  73  -0.179   7.128  -8.640
  528    HA   ARG  73           HA       ARG  73   1.534   7.982 -10.007
  529    HB2  ARG  73           HB3      ARG  73   0.824   5.828 -11.489
  530    HB3  ARG  73           HB2      ARG  73   0.292   7.119 -12.563
  531    HG2  ARG  73           HG3      ARG  73   2.537   8.161 -12.394
  532    HG3  ARG  73           HG2      ARG  73   3.064   6.829 -11.367
  533    HD2  ARG  73           HD3      ARG  73   3.409   5.488 -13.146
  534    HD3  ARG  73           HD2      ARG  73   1.817   5.854 -13.809
  535    HE   ARG  73           HE       ARG  73   2.902   7.310 -15.297
  536   HH11  ARG  73          HH22      ARG  73   4.698   6.911 -12.381
  537   HH12  ARG  73          HH21      ARG  73   6.005   7.929 -12.889
  538   HH21  ARG  73          HH11      ARG  73   4.598   8.642 -15.977
  539   HH22  ARG  73          HH12      ARG  73   5.948   8.909 -14.925
  540    H    GLY  74           H        GLY  74  -0.928   9.302  -9.254
  541    HA2  GLY  74           HA3      GLY  74  -0.838  11.477 -11.237
  542    HA3  GLY  74           HA2      GLY  74  -2.415  10.721 -11.007
  543    H    GLY  75           H        GLY  75  -1.233  10.279  -8.091
  544    HA2  GLY  75           HA3      GLY  75  -0.934  11.738  -6.169
  545    HA3  GLY  75           HA2      GLY  75  -1.693  13.043  -7.078
  546    H    LEU  76           H        LEU  76  -3.506  10.398  -7.770
  547    HA   LEU  76           HA       LEU  76  -5.581  11.212  -5.839
  548    HB2  LEU  76           HB3      LEU  76  -5.533  10.052  -8.472
  549    HB3  LEU  76           HB2      LEU  76  -6.455   9.004  -7.394
  550    HG   LEU  76           HG       LEU  76  -6.884  11.994  -7.636
  551   HD11  LEU  76          HD11      LEU  76  -8.982  11.326  -8.827
  552   HD12  LEU  76          HD12      LEU  76  -8.401   9.661  -8.842
  553   HD13  LEU  76          HD13      LEU  76  -7.522  10.910  -9.722
  554   HD21  LEU  76          HD21      LEU  76  -9.103  10.457  -6.626
  555   HD22  LEU  76          HD22      LEU  76  -8.208  11.750  -5.827
  556   HD23  LEU  76          HD23      LEU  76  -7.659  10.080  -5.687
  557    H    THR  77           H        THR  77  -5.004  10.346  -3.836
  558    HA   THR  77           HA       THR  77  -3.820   7.834  -3.350
  559    HB   THR  77           HB       THR  77  -5.685   9.549  -1.713
  560    HG1  THR  77           HG1      THR  77  -3.521   9.306  -0.475
  561   HG21  THR  77          HG21      THR  77  -4.815   7.921   0.169
  562   HG22  THR  77          HG22      THR  77  -4.679   6.779  -1.168
  563   HG23  THR  77          HG23      THR  77  -6.243   7.495  -0.776
  564    H    LEU  78           H        LEU  78  -4.562   5.802  -3.667
  565    HA   LEU  78           HA       LEU  78  -7.362   5.406  -4.472
  566    HB2  LEU  78           HB3      LEU  78  -5.168   3.350  -4.135
  567    HB3  LEU  78           HB2      LEU  78  -6.678   3.127  -4.994
  568    HG   LEU  78           HG       LEU  78  -4.637   5.232  -5.755
  569   HD11  LEU  78          HD11      LEU  78  -3.401   3.620  -6.707
  570   HD12  LEU  78          HD12      LEU  78  -4.785   3.173  -7.704
  571   HD13  LEU  78          HD13      LEU  78  -4.531   2.387  -6.148
  572   HD21  LEU  78          HD21      LEU  78  -7.332   4.553  -6.636
  573   HD22  LEU  78          HD22      LEU  78  -6.177   4.454  -7.960
  574   HD23  LEU  78          HD23      LEU  78  -6.345   5.951  -7.046
  575    H    MET  79           H        MET  79  -5.265   4.563  -1.731
  576    HA   MET  79           HA       MET  79  -7.638   4.151  -0.072
  577    HB2  MET  79           HB3      MET  79  -7.275   1.969  -1.317
  578    HB3  MET  79           HB2      MET  79  -5.763   1.804  -0.433
  579    HG2  MET  79           HG3      MET  79  -7.336   0.614   0.885
  580    HG3  MET  79           HG2      MET  79  -7.172   2.172   1.691
  581    HE1  MET  79           HE1      MET  79  -9.870  -0.333   0.774
  582    HE2  MET  79           HE2      MET  79  -8.949  -0.012  -0.700
  583    HE3  MET  79           HE3      MET  79 -10.655   0.419  -0.611
  584    H    LEU  80           H        LEU  80  -7.163   4.311   2.118
  585    HA   LEU  80           HA       LEU  80  -4.315   4.925   2.782
  586    HB2  LEU  80           HB3      LEU  80  -5.697   6.856   3.145
  587    HB3  LEU  80           HB2      LEU  80  -6.930   5.896   3.958
  588    HG   LEU  80           HG       LEU  80  -5.500   5.522   5.861
  589   HD11  LEU  80          HD11      LEU  80  -3.355   5.140   4.962
  590   HD12  LEU  80          HD12      LEU  80  -3.176   6.684   5.795
  591   HD13  LEU  80          HD13      LEU  80  -3.373   6.647   4.042
  592   HD21  LEU  80          HD21      LEU  80  -6.620   7.725   5.757
  593   HD22  LEU  80          HD22      LEU  80  -5.212   8.397   4.936
  594   HD23  LEU  80          HD23      LEU  80  -5.076   7.833   6.602
  595    H    LEU  81           H        LEU  81  -3.498   3.008   3.555
  596    HA   LEU  81           HA       LEU  81  -5.126   1.292   5.313
  597    HB2  LEU  81           HB3      LEU  81  -2.467   1.094   3.954
  598    HB3  LEU  81           HB2      LEU  81  -2.678   0.164   5.433
  599    HG   LEU  81           HG       LEU  81  -3.268  -1.130   3.383
  600   HD11  LEU  81          HD11      LEU  81  -4.706  -0.963   5.769
  601   HD12  LEU  81          HD12      LEU  81  -4.769  -2.276   4.596
  602   HD13  LEU  81          HD13      LEU  81  -5.932  -0.954   4.503
  603   HD21  LEU  81          HD21      LEU  81  -5.773   0.333   3.036
  604   HD22  LEU  81          HD22      LEU  81  -4.745  -0.438   1.838
  605   HD23  LEU  81          HD23      LEU  81  -4.328   1.159   2.459
  606    H    GLY  82           H        GLY  82  -5.271   1.866   7.454
  607    HA2  GLY  82           HA3      GLY  82  -3.138   3.556   8.624
  608    HA3  GLY  82           HA2      GLY  82  -4.706   3.223   9.354
  609    H    ARG  83           H        ARG  83  -1.924   2.925  10.440
  610    HA   ARG  83           HA       ARG  83  -1.368   0.092  10.701
  611    HB2  ARG  83           HB3      ARG  83   0.329   1.897  11.045
  612    HB3  ARG  83           HB2      ARG  83  -0.535   2.387  12.498
  613    HG2  ARG  83           HG3      ARG  83  -0.043  -0.468  12.540
  614    HG3  ARG  83           HG2      ARG  83   1.466   0.409  12.295
  615    HD2  ARG  83           HD3      ARG  83  -0.531   0.852  14.534
  616    HD3  ARG  83           HD2      ARG  83   1.088   0.174  14.687
  617    HE   ARG  83           HE       ARG  83   0.436   3.014  14.392
  618   HH11  ARG  83          HH22      ARG  83   2.754   0.482  14.053
  619   HH12  ARG  83          HH21      ARG  83   4.121   1.540  14.164
  620   HH21  ARG  83          HH11      ARG  83   2.208   4.407  14.541
  621   HH22  ARG  83          HH12      ARG  83   3.812   3.762  14.441
  622    H    GLN  84           H        GLN  84  -2.370  -1.356  12.052
  623    HA   GLN  84           HA       GLN  84  -4.250  -0.260  14.093
  624    HB2  GLN  84           HB3      GLN  84  -5.460  -1.532  12.510
  625    HB3  GLN  84           HB2      GLN  84  -4.197  -2.757  12.416
  626    HG2  GLN  84           HG3      GLN  84  -6.310  -3.342  13.758
  627    HG3  GLN  84           HG2      GLN  84  -4.753  -3.669  14.516
  628   HE21  GLN  84          HE22      GLN  84  -6.617  -0.595  14.164
  629   HE22  GLN  84          HE21      GLN  84  -6.647  -0.252  15.825
  630    H    GLY  85           H        GLY  85  -1.681  -2.662  13.540
  631    HA2  GLY  85           HA3      GLY  85  -1.218  -2.718  16.464
  632    HA3  GLY  85           HA2      GLY  85  -1.586  -4.259  15.692
  633    H    GLU  86           H        GLU  86   0.471  -1.482  14.777
  634    HA   GLU  86           HA       GLU  86   2.663  -1.461  13.919
  635    HB2  GLU  86           HB3      GLU  86   2.978  -1.926  16.376
  636    HB3  GLU  86           HB2      GLU  86   3.060  -3.643  15.981
  637    HG2  GLU  86           HG3      GLU  86   5.254  -3.378  15.561
  638    HG3  GLU  86           HG2      GLU  86   4.816  -2.368  14.183
  639    H    GLY  87           H        GLY  87   2.676  -2.269  11.835
  640    HA2  GLY  87           HA3      GLY  87   3.583  -3.873  10.289
  641    HA3  GLY  87           HA2      GLY  87   3.465  -5.106  11.539
  642    H    ASP  88           H        ASP  88   0.651  -4.124  12.128
  643    HA   ASP  88           HA       ASP  88  -0.682  -5.526   9.840
  644    HB2  ASP  88           HB3      ASP  88  -0.877  -5.831  12.722
  645    HB3  ASP  88           HB2      ASP  88  -2.450  -5.447  12.022
  646    H    TYR  89           H        TYR  89  -1.422  -3.908   8.535
  647    HA   TYR  89           HA       TYR  89  -2.776  -1.567   9.804
  648    HB2  TYR  89           HB3      TYR  89  -1.887  -1.877   6.933
  649    HB3  TYR  89           HB2      TYR  89  -2.450  -0.414   7.677
  650    HD1  TYR  89           HD1      TYR  89   0.240  -3.011   8.151
  651    HD2  TYR  89           HD2      TYR  89  -0.868   1.136   8.397
  652    HE1  TYR  89           HE1      TYR  89   2.560  -2.423   8.770
  653    HE2  TYR  89           HE2      TYR  89   1.460   1.717   9.011
  654    HH   TYR  89           HH       TYR  89   3.819  -0.719   9.784
  655    H    ARG  90           H        ARG  90  -4.935  -1.128   9.209
  656    HA   ARG  90           HA       ARG  90  -6.192  -2.820   7.139
  657    HB2  ARG  90           HB3      ARG  90  -7.830  -2.680   9.575
  658    HB3  ARG  90           HB2      ARG  90  -7.541  -4.041   8.495
  659    HG2  ARG  90           HG3      ARG  90  -5.361  -4.443   9.553
  660    HG3  ARG  90           HG2      ARG  90  -5.601  -3.055  10.604
  661    HD2  ARG  90           HD3      ARG  90  -7.178  -5.632  10.565
  662    HD3  ARG  90           HD2      ARG  90  -6.229  -4.967  11.892
  663    HE   ARG  90           HE       ARG  90  -8.195  -3.047  11.316
  664   HH11  ARG  90          HH22      ARG  90  -7.970  -6.350  12.276
  665   HH12  ARG  90          HH21      ARG  90  -9.453  -6.330  13.173
  666   HH21  ARG  90          HH11      ARG  90 -10.130  -3.000  12.482
  667   HH22  ARG  90          HH12      ARG  90 -10.674  -4.432  13.290
  668    H    VAL  91           H        VAL  91  -8.368  -2.007   6.591
  669    HA   VAL  91           HA       VAL  91  -8.930   0.753   7.570
  670    HB   VAL  91           HB       VAL  91  -7.634   0.651   5.315
  671   HG11  VAL  91          HG11      VAL  91  -9.184  -1.226   4.481
  672   HG12  VAL  91          HG12      VAL  91  -8.880   0.101   3.362
  673   HG13  VAL  91          HG13      VAL  91 -10.399   0.033   4.247
  674   HG21  VAL  91          HG21      VAL  91  -8.544   2.735   5.884
  675   HG22  VAL  91          HG22      VAL  91 -10.199   2.127   5.872
  676   HG23  VAL  91          HG23      VAL  91  -9.345   2.386   4.351
  677    H    GLN  92           H        GLN  92 -11.066   0.914   8.135
  678    HA   GLN  92           HA       GLN  92 -12.860  -1.249   8.001
  679    HB2  GLN  92           HB3      GLN  92 -13.126   1.691   8.442
  680    HB3  GLN  92           HB2      GLN  92 -14.602   0.809   8.047
  681    HG2  GLN  92           HG3      GLN  92 -12.717  -0.216  10.163
  682    HG3  GLN  92           HG2      GLN  92 -13.928   1.007  10.550
  683   HE21  GLN  92          HE22      GLN  92 -13.459  -2.380   9.725
  684   HE22  GLN  92          HE21      GLN  92 -15.078  -2.848   9.925
  685    H    LYS  93           H        LYS  93 -13.468  -2.226   6.164
  686    HA   LYS  93           HA       LYS  93 -13.577  -0.859   3.612
  687    HB2  LYS  93           HB3      LYS  93 -14.413  -3.045   2.788
  688    HB3  LYS  93           HB2      LYS  93 -12.935  -3.216   3.726
  689    HG2  LYS  93           HG3      LYS  93 -15.645  -3.521   5.053
  690    HG3  LYS  93           HG2      LYS  93 -14.917  -4.852   4.203
  691    HD2  LYS  93           HD3      LYS  93 -13.698  -5.337   6.009
  692    HD3  LYS  93           HD2      LYS  93 -12.913  -3.770   5.927
  693    HE2  LYS  93           HE3      LYS  93 -14.059  -4.201   8.100
  694    HE3  LYS  93           HE2      LYS  93 -14.703  -2.787   7.271
  695    HZ1  LYS  93           HZ1      LYS  93 -16.176  -4.849   8.187
  696    HZ2  LYS  93           HZ2      LYS  93 -15.995  -5.254   6.550
  697    HZ3  LYS  93           HZ3      LYS  93 -16.674  -3.758   6.983
  698    H    GLY  94           H        GLY  94 -15.833  -1.625   6.137
  699    HA2  GLY  94           HA3      GLY  94 -17.901  -0.165   6.141
  700    HA3  GLY  94           HA2      GLY  94 -18.094  -0.623   4.447
  701    H    ASP  95           H        ASP  95 -17.723  -3.272   4.340
  702    HA   ASP  95           HA       ASP  95 -18.597  -4.959   6.381
  703    HB2  ASP  95           HB3      ASP  95 -20.777  -3.308   5.284
  704    HB3  ASP  95           HB2      ASP  95 -21.132  -5.029   5.261
  705    H    GLY  96           H        GLY  96 -16.954  -5.092   4.031
  706    HA2  GLY  96           HA3      GLY  96 -18.333  -7.294   2.531
  707    HA3  GLY  96           HA2      GLY  96 -17.296  -6.125   1.720
  708    H    GLY  97           H        GLY  97 -15.028  -5.974   2.976
  709    HA2  GLY  97           HA3      GLY  97 -14.127  -8.606   3.949
  710    HA3  GLY  97           HA2      GLY  97 -13.403  -8.059   2.436
  711    H    GLN  98           H        GLN  98 -12.226  -8.483   5.160
  712    HA   GLN  98           HA       GLN  98 -11.426  -5.735   5.955
  713    HB2  GLN  98           HB3      GLN  98 -11.966  -7.764   7.567
  714    HB3  GLN  98           HB2      GLN  98 -10.305  -8.224   7.207
  715    HG2  GLN  98           HG3      GLN  98  -9.735  -5.744   7.747
  716    HG3  GLN  98           HG2      GLN  98 -11.293  -5.734   8.568
  717   HE21  GLN  98          HE22      GLN  98  -8.567  -8.102   8.337
  718   HE22  GLN  98          HE21      GLN  98  -8.476  -8.374  10.010
  719    H    LEU  99           H        LEU  99  -9.824  -4.881   4.848
  720    HA   LEU  99           HA       LEU  99  -7.865  -6.521   3.424
  721    HB2  LEU  99           HB3      LEU  99  -7.683  -3.544   3.800
  722    HB3  LEU  99           HB2      LEU  99  -7.186  -4.509   2.418
  723    HG   LEU  99           HG       LEU  99 -10.063  -4.092   3.275
  724   HD11  LEU  99          HD11      LEU  99  -9.771  -2.067   2.338
  725   HD12  LEU  99          HD12      LEU  99  -9.786  -2.949   0.810
  726   HD13  LEU  99          HD13      LEU  99  -8.250  -2.531   1.574
  727   HD21  LEU  99          HD21      LEU  99 -10.408  -4.995   0.890
  728   HD22  LEU  99          HD22      LEU  99  -9.918  -6.162   2.117
  729   HD23  LEU  99          HD23      LEU  99  -8.730  -5.529   0.977
  730    H    VAL 100           H        VAL 100  -5.801  -6.943   4.144
  731    HA   VAL 100           HA       VAL 100  -4.843  -5.516   6.586
  732    HB   VAL 100           HB       VAL 100  -4.688  -8.515   6.212
  733   HG11  VAL 100          HG11      VAL 100  -3.298  -6.711   7.884
  734   HG12  VAL 100          HG12      VAL 100  -3.320  -8.470   7.998
  735   HG13  VAL 100          HG13      VAL 100  -4.485  -7.513   8.913
  736   HG21  VAL 100          HG21      VAL 100  -6.731  -6.749   7.512
  737   HG22  VAL 100          HG22      VAL 100  -6.343  -8.290   8.274
  738   HG23  VAL 100          HG23      VAL 100  -6.959  -8.254   6.623
  739    H    LEU 101           H        LEU 101  -3.028  -4.502   5.792
  740    HA   LEU 101           HA       LEU 101  -1.240  -5.976   3.917
  741    HB2  LEU 101           HB3      LEU 101  -1.817  -3.522   3.579
  742    HB3  LEU 101           HB2      LEU 101  -0.928  -3.193   5.043
  743    HG   LEU 101           HG       LEU 101   0.683  -4.835   3.337
  744   HD11  LEU 101          HD11      LEU 101  -0.584  -3.888   1.481
  745   HD12  LEU 101          HD12      LEU 101   0.995  -3.106   1.540
  746   HD13  LEU 101          HD13      LEU 101  -0.427  -2.268   2.164
  747   HD21  LEU 101          HD21      LEU 101   2.280  -3.042   3.700
  748   HD22  LEU 101          HD22      LEU 101   1.401  -3.313   5.205
  749   HD23  LEU 101          HD23      LEU 101   0.989  -1.939   4.179
  750    H    ARG 102           H        ARG 102   0.329  -7.289   4.918
  751    HA   ARG 102           HA       ARG 102   1.728  -6.151   7.271
  752    HB2  ARG 102           HB3      ARG 102  -0.135  -7.714   8.026
  753    HB3  ARG 102           HB2      ARG 102   0.742  -9.010   7.212
  754    HG2  ARG 102           HG3      ARG 102   2.698  -7.712   8.723
  755    HG3  ARG 102           HG2      ARG 102   1.288  -7.750   9.782
  756    HD2  ARG 102           HD3      ARG 102   2.564 -10.117   8.383
  757    HD3  ARG 102           HD2      ARG 102   2.561  -9.792  10.117
  758    HE   ARG 102           HE       ARG 102  -0.128  -9.878   9.463
  759   HH11  ARG 102          HH22      ARG 102   2.624 -11.902   8.995
  760   HH12  ARG 102          HH21      ARG 102   1.714 -13.375   9.035
  761   HH21  ARG 102          HH11      ARG 102  -1.333 -11.790   9.517
  762   HH22  ARG 102          HH12      ARG 102  -0.527 -13.312   9.330
  763    H    ARG 103           H        ARG 103   3.855  -6.593   7.280
  764    HA   ARG 103           HA       ARG 103   5.300  -7.245   5.037
  765    HB2  ARG 103           HB3      ARG 103   7.153  -7.856   6.545
  766    HB3  ARG 103           HB2      ARG 103   6.331  -6.404   7.094
  767    HG2  ARG 103           HG3      ARG 103   4.904  -8.420   8.339
  768    HG3  ARG 103           HG2      ARG 103   6.561  -9.023   8.395
  769    HD2  ARG 103           HD3      ARG 103   5.639  -6.290   9.338
  770    HD3  ARG 103           HD2      ARG 103   6.079  -7.644  10.378
  771    HE   ARG 103           HE       ARG 103   7.934  -5.853   9.063
  772   HH11  ARG 103          HH22      ARG 103   7.363  -9.097  10.084
  773   HH12  ARG 103          HH21      ARG 103   9.044  -9.475  10.267
  774   HH21  ARG 103          HH11      ARG 103  10.130  -6.329   9.296
  775   HH22  ARG 103          HH12      ARG 103  10.610  -7.908   9.822
  776    H    ALA 104           H        ALA 104   5.381  -9.036   3.787
  777    HA   ALA 104           HA       ALA 104   4.056 -11.451   4.273
  778    HB1  ALA 104           HB1      ALA 104   4.971 -12.150   2.298
  779    HB2  ALA 104           HB2      ALA 104   6.604 -11.679   2.771
  780    HB3  ALA 104           HB3      ALA 104   5.471 -10.462   2.180
  781    H    THR 105           H        THR 105   4.365 -12.544   6.179
  782    HA   THR 105           HA       THR 105   6.916 -12.758   7.500
  783    HB   THR 105           HB       THR 105   5.192 -14.927   8.240
  784    HG1  THR 105           HG1      THR 105   3.963 -12.609   7.396
  785   HG21  THR 105          HG21      THR 105   5.813 -12.254   9.529
  786   HG22  THR 105          HG22      THR 105   6.729 -13.746   9.739
  787   HG23  THR 105          HG23      THR 105   5.079 -13.631  10.353
  788    HA   PRO 106           HA       PRO 106   7.174 -17.038   5.459
  789    HB2  PRO 106           HB2      PRO 106   5.298 -17.804   3.650
  790    HB3  PRO 106           HB3      PRO 106   5.068 -17.977   5.399
  791    HG2  PRO 106           HG3      PRO 106   3.835 -16.083   3.523
  792    HG3  PRO 106           HG2      PRO 106   3.258 -16.662   5.093
  793    HD2  PRO 106           HD3      PRO 106   4.543 -14.164   4.523
  794    HD3  PRO 106           HD2      PRO 106   4.035 -14.781   6.109
  Start of MODEL   17
    1    H1   SER   1           H        SER   1  18.601  25.778  -2.098
    2    H2   SER   1           H2       SER   1  19.925  26.160  -1.103
    3    H3   SER   1           1HT      SER   1  19.116  27.387  -1.954
    4    HA   SER   1           HA       SER   1  19.936  26.679  -4.017
    5    HB2  SER   1           HB3      SER   1  21.630  27.908  -2.868
    6    HB3  SER   1           HB2      SER   1  22.010  26.544  -1.819
    7    HG   SER   1           HG       SER   1  22.491  26.834  -4.599
    8    H    SER   2           H        SER   2  18.898  24.251  -2.380
    9    HA   SER   2           HA       SER   2  20.211  22.249  -4.097
   10    HB2  SER   2           HB3      SER   2  20.556  22.386  -1.132
   11    HB3  SER   2           HB2      SER   2  20.355  20.797  -1.863
   12    HG   SER   2           HG       SER   2  22.567  21.941  -1.689
   13    H    LEU   3           H        LEU   3  18.829  20.515  -4.531
   14    HA   LEU   3           HA       LEU   3  16.027  20.892  -3.850
   15    HB2  LEU   3           HB3      LEU   3  17.524  18.713  -5.327
   16    HB3  LEU   3           HB2      LEU   3  15.777  18.674  -5.079
   17    HG   LEU   3           HG       LEU   3  16.731  21.258  -6.085
   18   HD11  LEU   3          HD11      LEU   3  17.014  20.288  -8.436
   19   HD12  LEU   3          HD12      LEU   3  17.211  18.719  -7.657
   20   HD13  LEU   3          HD13      LEU   3  18.354  20.019  -7.323
   21   HD21  LEU   3          HD21      LEU   3  14.719  19.252  -7.154
   22   HD22  LEU   3          HD22      LEU   3  14.823  20.959  -7.580
   23   HD23  LEU   3          HD23      LEU   3  14.354  20.486  -5.948
   24    H    ILE   4           H        ILE   4  15.090  20.171  -2.006
   25    HA   ILE   4           HA       ILE   4  16.531  18.187  -0.347
   26    HB   ILE   4           HB       ILE   4  13.960  19.650   0.306
   27   HG12  ILE   4          HG13      ILE   4  16.831  20.465   0.866
   28   HG13  ILE   4          HG12      ILE   4  15.738  21.272  -0.258
   29   HG21  ILE   4          HG21      ILE   4  16.114  18.497   2.099
   30   HG22  ILE   4          HG22      ILE   4  14.634  17.640   1.670
   31   HG23  ILE   4          HG23      ILE   4  14.548  19.137   2.597
   32   HD11  ILE   4          HD11      ILE   4  15.031  22.543   1.461
   33   HD12  ILE   4          HD12      ILE   4  15.938  21.569   2.619
   34   HD13  ILE   4          HD13      ILE   4  14.306  21.091   2.152
   35    H    LEU   5           H        LEU   5  15.780  16.113  -0.017
   36    HA   LEU   5           HA       LEU   5  13.034  15.362  -0.671
   37    HB2  LEU   5           HB3      LEU   5  14.533  15.436  -2.861
   38    HB3  LEU   5           HB2      LEU   5  15.098  13.878  -2.256
   39    HG   LEU   5           HG       LEU   5  12.505  13.432  -1.935
   40   HD11  LEU   5          HD11      LEU   5  12.325  15.110  -4.406
   41   HD12  LEU   5          HD12      LEU   5  12.233  15.922  -2.843
   42   HD13  LEU   5          HD13      LEU   5  11.063  14.670  -3.256
   43   HD21  LEU   5          HD21      LEU   5  12.472  12.486  -4.253
   44   HD22  LEU   5          HD22      LEU   5  13.954  12.099  -3.378
   45   HD23  LEU   5          HD23      LEU   5  13.959  13.370  -4.599
   46    H    LEU   6           H        LEU   6  12.550  13.914   0.899
   47    HA   LEU   6           HA       LEU   6  14.750  12.406   2.191
   48    HB2  LEU   6           HB3      LEU   6  11.813  12.704   2.894
   49    HB3  LEU   6           HB2      LEU   6  12.977  11.778   3.841
   50    HG   LEU   6           HG       LEU   6  13.827  14.531   3.187
   51   HD11  LEU   6          HD11      LEU   6  11.385  13.933   4.857
   52   HD12  LEU   6          HD12      LEU   6  11.583  15.158   3.605
   53   HD13  LEU   6          HD13      LEU   6  12.381  15.356   5.165
   54   HD21  LEU   6          HD21      LEU   6  13.662  12.992   5.797
   55   HD22  LEU   6          HD22      LEU   6  14.618  14.442   5.489
   56   HD23  LEU   6          HD23      LEU   6  15.034  12.925   4.692
   57    H    SER   7           H        SER   7  15.205  10.401   1.439
   58    HA   SER   7           HA       SER   7  13.163   8.953  -0.146
   59    HB2  SER   7           HB3      SER   7  15.871   7.807   0.374
   60    HB3  SER   7           HB2      SER   7  14.906   7.781  -1.100
   61    HG   SER   7           HG       SER   7  15.333  10.255  -0.812
   62    H    ALA   8           H        ALA   8  11.898   7.461   0.841
   63    HA   ALA   8           HA       ALA   8  12.674   6.477   3.525
   64    HB1  ALA   8           HB1      ALA   8  10.122   5.952   1.974
   65    HB2  ALA   8           HB2      ALA   8  10.349   7.329   3.052
   66    HB3  ALA   8           HB3      ALA   8  10.391   5.687   3.696
   67    H    SER   9           H        SER   9  14.388   5.043   2.827
   68    HA   SER   9           HA       SER   9  13.600   2.777   1.083
   69    HB2  SER   9           HB3      SER   9  16.222   2.393   2.045
   70    HB3  SER   9           HB2      SER   9  15.749   2.963   0.447
   71    HG   SER   9           HG       SER   9  15.577   5.091   1.520
   72    H    ASP  10           H        ASP  10  13.863   3.568   4.410
   73    HA   ASP  10           HA       ASP  10  14.383   0.851   5.349
   74    HB2  ASP  10           HB3      ASP  10  13.515   3.412   6.700
   75    HB3  ASP  10           HB2      ASP  10  13.615   1.885   7.576
   76    H    LEU  11           H        LEU  11  11.588   2.711   4.438
   77    HA   LEU  11           HA       LEU  11   9.719   0.890   5.805
   78    HB2  LEU  11           HB3      LEU  11   9.587   3.521   4.675
   79    HB3  LEU  11           HB2      LEU  11   8.377   2.512   3.884
   80    HG   LEU  11           HG       LEU  11   8.726   2.729   6.888
   81   HD11  LEU  11          HD11      LEU  11   6.491   3.946   6.686
   82   HD12  LEU  11          HD12      LEU  11   6.825   4.080   4.960
   83   HD13  LEU  11          HD13      LEU  11   7.902   4.843   6.127
   84   HD21  LEU  11          HD21      LEU  11   6.149   1.828   5.988
   85   HD22  LEU  11          HD22      LEU  11   7.324   0.969   6.985
   86   HD23  LEU  11          HD23      LEU  11   7.394   0.840   5.228
   87    H    ALA  12           H        ALA  12  11.647   0.148   3.483
   88    HA   ALA  12           HA       ALA  12   9.664  -0.800   1.485
   89    HB1  ALA  12           HB1      ALA  12  12.236   0.152   1.210
   90    HB2  ALA  12           HB2      ALA  12  11.380  -0.802  -0.002
   91    HB3  ALA  12           HB3      ALA  12  12.475  -1.593   1.132
   92    H    GLY  13           H        GLY  13  10.163  -3.164   0.704
   93    HA2  GLY  13           HA3      GLY  13  11.323  -5.242   1.910
   94    HA3  GLY  13           HA2      GLY  13  10.115  -4.864   3.133
   95    H    GLN  14           H        GLN  14   9.138  -6.955   2.736
   96    HA   GLN  14           HA       GLN  14   7.599  -7.100   0.172
   97    HB2  GLN  14           HB3      GLN  14   8.058  -9.471   1.962
   98    HB3  GLN  14           HB2      GLN  14   7.760  -9.433   0.224
   99    HG2  GLN  14           HG3      GLN  14  10.032  -8.199   0.066
  100    HG3  GLN  14           HG2      GLN  14  10.308  -8.791   1.705
  101   HE21  GLN  14          HE22      GLN  14  11.937  -9.702  -0.453
  102   HE22  GLN  14          HE21      GLN  14  11.602 -11.344  -0.730
  103    H    TRP  15           H        TRP  15   5.351  -7.627   0.395
  104    HA   TRP  15           HA       TRP  15   4.280  -7.852   3.141
  105    HB2  TRP  15           HB3      TRP  15   3.425  -5.662   1.227
  106    HB3  TRP  15           HB2      TRP  15   2.637  -6.039   2.748
  107    HD1  TRP  15           HD1      TRP  15   6.166  -4.957   1.499
  108    HE1  TRP  15           HE1      TRP  15   7.227  -3.499   3.334
  109    HE3  TRP  15           HE3      TRP  15   2.518  -5.226   5.078
  110    HZ2  TRP  15           HZ2      TRP  15   6.620  -2.561   5.964
  111    HZ3  TRP  15           HZ3      TRP  15   2.791  -4.034   7.235
  112    HH2  TRP  15           HH2      TRP  15   4.834  -2.703   7.680
  113    H    THR  16           H        THR  16   1.758  -8.042   2.910
  114    HA   THR  16           HA       THR  16   0.988  -9.350   0.353
  115    HB   THR  16           HB       THR  16  -0.041 -11.143   2.130
  116    HG1  THR  16           HG1      THR  16   2.592 -10.795   3.019
  117   HG21  THR  16          HG21      THR  16   1.007 -11.963   0.199
  118   HG22  THR  16          HG22      THR  16   2.065 -12.530   1.491
  119   HG23  THR  16          HG23      THR  16   2.514 -11.113   0.543
  120    H    LEU  17           H        LEU  17  -1.401  -9.851   0.385
  121    HA   LEU  17           HA       LEU  17  -2.868  -7.912   2.143
  122    HB2  LEU  17           HB3      LEU  17  -2.733  -7.995  -0.663
  123    HB3  LEU  17           HB2      LEU  17  -4.299  -8.700  -0.263
  124    HG   LEU  17           HG       LEU  17  -4.741  -6.728   1.227
  125   HD11  LEU  17          HD11      LEU  17  -3.074  -5.303   1.720
  126   HD12  LEU  17          HD12      LEU  17  -2.870  -4.925   0.008
  127   HD13  LEU  17          HD13      LEU  17  -1.976  -6.264   0.728
  128   HD21  LEU  17          HD21      LEU  17  -4.534  -5.111  -1.003
  129   HD22  LEU  17          HD22      LEU  17  -5.861  -6.229  -0.686
  130   HD23  LEU  17          HD23      LEU  17  -4.510  -6.730  -1.702
  131    H    GLN  18           H        GLN  18  -4.851  -8.645   3.017
  132    HA   GLN  18           HA       GLN  18  -5.581 -11.491   2.518
  133    HB2  GLN  18           HB3      GLN  18  -4.149 -10.756   4.755
  134    HB3  GLN  18           HB2      GLN  18  -5.813 -10.657   5.332
  135    HG2  GLN  18           HG3      GLN  18  -6.221 -12.951   4.443
  136    HG3  GLN  18           HG2      GLN  18  -4.518 -13.048   3.989
  137   HE21  GLN  18          HE22      GLN  18  -3.456 -11.667   6.325
  138   HE22  GLN  18          HE21      GLN  18  -3.687 -12.687   7.662
  139    H    GLN  19           H        GLN  19  -7.697 -11.499   1.984
  140    HA   GLN  19           HA       GLN  19  -9.416  -9.254   2.913
  141    HB2  GLN  19           HB3      GLN  19 -10.953  -9.917   1.176
  142    HB3  GLN  19           HB2      GLN  19  -9.337  -9.893   0.470
  143    HG2  GLN  19           HG3      GLN  19 -10.065 -11.956  -0.280
  144    HG3  GLN  19           HG2      GLN  19  -9.335 -12.434   1.253
  145   HE21  GLN  19          HE22      GLN  19 -12.504 -10.877   0.491
  146   HE22  GLN  19          HE21      GLN  19 -13.434 -12.036   1.309
  147    H    ASP  20           H        ASP  20 -10.940  -9.600   4.443
  148    HA   ASP  20           HA       ASP  20 -11.969 -10.704   6.245
  149    HB2  ASP  20           HB3      ASP  20 -13.515 -11.071   4.326
  150    HB3  ASP  20           HB2      ASP  20 -12.681 -12.583   3.979
  151    H    GLU  21           H        GLU  21 -12.203 -13.834   5.378
  152    HA   GLU  21           HA       GLU  21  -9.515 -14.629   6.363
  153    HB2  GLU  21           HB3      GLU  21 -11.219 -14.474   8.279
  154    HB3  GLU  21           HB2      GLU  21 -12.044 -15.829   7.509
  155    HG2  GLU  21           HG3      GLU  21  -9.446 -16.709   7.518
  156    HG3  GLU  21           HG2      GLU  21  -9.512 -15.787   9.020
  157    H    ALA  22           H        ALA  22 -10.602 -14.742   3.732
  158    HA   ALA  22           HA       ALA  22 -10.906 -17.705   3.409
  159    HB1  ALA  22           HB1      ALA  22 -12.763 -15.737   2.701
  160    HB2  ALA  22           HB2      ALA  22 -12.759 -17.413   2.155
  161    HB3  ALA  22           HB3      ALA  22 -11.975 -16.166   1.184
  162    HA   PRO  23           HA       PRO  23  -7.596 -17.844   0.478
  163    HB2  PRO  23           HB2      PRO  23  -9.360 -18.377  -1.850
  164    HB3  PRO  23           HB3      PRO  23  -8.040 -19.355  -1.185
  165    HG2  PRO  23           HG3      PRO  23 -10.621 -20.018  -0.895
  166    HG3  PRO  23           HG2      PRO  23  -9.389 -20.397   0.319
  167    HD2  PRO  23           HD3      PRO  23 -11.523 -18.319   0.388
  168    HD3  PRO  23           HD2      PRO  23 -10.769 -19.222   1.717
  169    H    ALA  24           H        ALA  24  -7.881 -17.256  -2.444
  170    HA   ALA  24           HA       ALA  24  -7.544 -15.414  -3.844
  171    HB1  ALA  24           HB1      ALA  24  -9.179 -13.418  -3.134
  172    HB2  ALA  24           HB2      ALA  24  -9.921 -14.705  -2.183
  173    HB3  ALA  24           HB3      ALA  24  -9.779 -14.870  -3.933
  174    H    ILE  25           H        ILE  25  -5.397 -15.242  -2.768
  175    HA   ILE  25           HA       ILE  25  -5.162 -12.794  -1.057
  176    HB   ILE  25           HB       ILE  25  -4.281 -14.679   0.125
  177   HG12  ILE  25          HG13      ILE  25  -1.840 -13.513  -1.223
  178   HG13  ILE  25          HG12      ILE  25  -2.821 -12.565  -0.108
  179   HG21  ILE  25          HG21      ILE  25  -4.133 -16.326  -1.601
  180   HG22  ILE  25          HG22      ILE  25  -2.488 -16.105  -1.006
  181   HG23  ILE  25          HG23      ILE  25  -2.984 -15.355  -2.523
  182   HD11  ILE  25          HD11      ILE  25  -2.128 -13.749   1.719
  183   HD12  ILE  25          HD12      ILE  25  -0.745 -14.124   0.690
  184   HD13  ILE  25          HD13      ILE  25  -2.074 -15.273   0.834
  185    H    CYS  26           H        CYS  26  -3.167 -11.483  -1.512
  186    HA   CYS  26           HA       CYS  26  -2.115 -11.794  -4.277
  187    HB2  CYS  26           HB3      CYS  26  -3.476  -9.319  -3.182
  188    HB3  CYS  26           HB2      CYS  26  -2.435  -9.299  -4.603
  189    H    HIS  27           H        HIS  27   0.062 -11.701  -4.117
  190    HA   HIS  27           HA       HIS  27   1.387 -10.709  -1.739
  191    HB2  HIS  27           HB3      HIS  27   2.121 -12.159  -4.149
  192    HB3  HIS  27           HB2      HIS  27   3.292 -10.889  -3.796
  193    HD1  HIS  27           HD1      HIS  27   5.103 -11.666  -2.279
  194    HD2  HIS  27           HD2      HIS  27   1.511 -13.635  -1.492
  195    HE1  HIS  27           HE1      HIS  27   5.572 -13.283  -0.385
  196    HE2  HIS  27           HE2      HIS  27   3.391 -14.485   0.103
  197    H    LEU  28           H        LEU  28   2.405  -8.717  -1.470
  198    HA   LEU  28           HA       LEU  28   2.155  -6.766  -3.729
  199    HB2  LEU  28           HB3      LEU  28   1.051  -6.697  -1.031
  200    HB3  LEU  28           HB2      LEU  28   2.077  -5.304  -1.344
  201    HG   LEU  28           HG       LEU  28  -0.305  -4.906  -1.976
  202   HD11  LEU  28          HD11      LEU  28   0.552  -3.479  -3.484
  203   HD12  LEU  28          HD12      LEU  28   0.725  -4.795  -4.645
  204   HD13  LEU  28          HD13      LEU  28   2.036  -4.430  -3.524
  205   HD21  LEU  28          HD21      LEU  28  -0.063  -6.605  -4.392
  206   HD22  LEU  28          HD22      LEU  28  -1.469  -6.269  -3.382
  207   HD23  LEU  28          HD23      LEU  28  -0.289  -7.473  -2.871
  208    H    GLU  29           H        GLU  29   3.806  -5.029  -3.646
  209    HA   GLU  29           HA       GLU  29   6.159  -5.647  -1.930
  210    HB2  GLU  29           HB3      GLU  29   5.963  -6.214  -4.746
  211    HB3  GLU  29           HB2      GLU  29   7.167  -4.950  -4.490
  212    HG2  GLU  29           HG3      GLU  29   8.235  -6.369  -2.741
  213    HG3  GLU  29           HG2      GLU  29   7.073  -7.646  -3.105
  214    H    LEU  30           H        LEU  30   6.638  -3.802  -0.924
  215    HA   LEU  30           HA       LEU  30   5.846  -1.211  -2.071
  216    HB2  LEU  30           HB3      LEU  30   6.809  -2.228   0.560
  217    HB3  LEU  30           HB2      LEU  30   7.188  -0.553   0.170
  218    HG   LEU  30           HG       LEU  30   4.837  -0.055  -0.208
  219   HD11  LEU  30          HD11      LEU  30   4.627  -3.028  -0.064
  220   HD12  LEU  30          HD12      LEU  30   3.802  -1.898  -1.135
  221   HD13  LEU  30          HD13      LEU  30   3.267  -2.079   0.536
  222   HD21  LEU  30          HD21      LEU  30   4.168  -0.058   2.023
  223   HD22  LEU  30          HD22      LEU  30   5.898  -0.345   2.198
  224   HD23  LEU  30          HD23      LEU  30   4.767  -1.693   2.304
  225    H    ARG  31           H        ARG  31   7.229  -0.693  -3.769
  226    HA   ARG  31           HA       ARG  31  10.071  -1.279  -3.672
  227    HB2  ARG  31           HB3      ARG  31   8.201  -0.022  -5.577
  228    HB3  ARG  31           HB2      ARG  31   9.840   0.628  -5.623
  229    HG2  ARG  31           HG3      ARG  31  10.783  -1.549  -6.008
  230    HG3  ARG  31           HG2      ARG  31   9.243  -2.339  -5.682
  231    HD2  ARG  31           HD3      ARG  31   8.507  -2.004  -7.792
  232    HD3  ARG  31           HD2      ARG  31   9.043  -0.325  -7.796
  233    HE   ARG  31           HE       ARG  31  10.459  -2.522  -8.987
  234   HH11  ARG  31          HH22      ARG  31  10.856   0.340  -7.105
  235   HH12  ARG  31          HH21      ARG  31  12.463   0.650  -7.673
  236   HH21  ARG  31          HH11      ARG  31  12.553  -2.133  -9.738
  237   HH22  ARG  31          HH12      ARG  31  13.423  -0.749  -9.165
  238    H    ASP  32           H        ASP  32  11.721   0.539  -3.922
  239    HA   ASP  32           HA       ASP  32  11.079   2.711  -1.969
  240    HB2  ASP  32           HB3      ASP  32  13.551   2.818  -1.639
  241    HB3  ASP  32           HB2      ASP  32  12.879   1.241  -1.222
  242    H    SER  33           H        SER  33  11.041   2.338  -5.152
  243    HA   SER  33           HA       SER  33  12.801   4.483  -6.037
  244    HB2  SER  33           HB3      SER  33  10.856   4.174  -7.996
  245    HB3  SER  33           HB2      SER  33  12.392   3.314  -7.934
  246    HG   SER  33           HG       SER  33  11.306   1.723  -6.652
  247    H    GLU  34           H        GLU  34  12.332   6.651  -5.999
  248    HA   GLU  34           HA       GLU  34   9.903   7.586  -4.752
  249    HB2  GLU  34           HB3      GLU  34  10.818   9.856  -5.711
  250    HB3  GLU  34           HB2      GLU  34  11.702   9.039  -4.422
  251    HG2  GLU  34           HG3      GLU  34  13.346   8.223  -5.895
  252    HG3  GLU  34           HG2      GLU  34  12.323   8.461  -7.312
  253    H    VAL  35           H        VAL  35   8.202   8.818  -5.747
  254    HA   VAL  35           HA       VAL  35   8.033   8.642  -8.722
  255    HB   VAL  35           HB       VAL  35   5.932   7.719  -6.741
  256   HG11  VAL  35          HG11      VAL  35   4.946   7.131  -9.213
  257   HG12  VAL  35          HG12      VAL  35   5.752   8.665  -9.538
  258   HG13  VAL  35          HG13      VAL  35   4.501   8.572  -8.298
  259   HG21  VAL  35          HG21      VAL  35   7.530   6.343  -8.920
  260   HG22  VAL  35          HG22      VAL  35   6.140   5.610  -8.119
  261   HG23  VAL  35          HG23      VAL  35   7.582   6.010  -7.187
  262    H    ALA  36           H        ALA  36   8.022  10.811  -9.191
  263    HA   ALA  36           HA       ALA  36   6.711  12.751  -7.453
  264    HB1  ALA  36           HB1      ALA  36   7.763  13.105 -10.277
  265    HB2  ALA  36           HB2      ALA  36   8.733  13.294  -8.816
  266    HB3  ALA  36           HB3      ALA  36   7.389  14.391  -9.130
  267    H    GLU  37           H        GLU  37   5.896  11.013 -10.409
  268    HA   GLU  37           HA       GLU  37   3.730  12.536 -11.345
  269    HB2  GLU  37           HB3      GLU  37   4.662  10.439 -12.406
  270    HB3  GLU  37           HB2      GLU  37   3.777   9.508 -11.197
  271    HG2  GLU  37           HG3      GLU  37   2.399   9.616 -13.175
  272    HG3  GLU  37           HG2      GLU  37   1.670  10.675 -11.967
  273    H    ALA  38           H        ALA  38   3.931  10.384  -8.574
  274    HA   ALA  38           HA       ALA  38   1.129  11.150  -7.841
  275    HB1  ALA  38           HB1      ALA  38   2.417   8.663  -6.778
  276    HB2  ALA  38           HB2      ALA  38   1.749   8.646  -8.409
  277    HB3  ALA  38           HB3      ALA  38   0.707   9.011  -7.035
  278    H    SER  39           H        SER  39   4.297  11.649  -7.124
  279    HA   SER  39           HA       SER  39   5.366  12.569  -5.264
  280    HB2  SER  39           HB3      SER  39   4.108  14.002  -3.939
  281    HB3  SER  39           HB2      SER  39   3.039  13.829  -5.326
  282    HG   SER  39           HG       SER  39   1.685  12.725  -4.138
  283    H    GLY  40           H        GLY  40   5.159   9.768  -5.342
  284    HA2  GLY  40           HA3      GLY  40   5.349   9.172  -2.467
  285    HA3  GLY  40           HA2      GLY  40   4.099   8.280  -3.334
  286    H    TYR  41           H        TYR  41   5.265   6.296  -2.920
  287    HA   TYR  41           HA       TYR  41   7.774   5.981  -4.514
  288    HB2  TYR  41           HB3      TYR  41   6.738   4.359  -2.171
  289    HB3  TYR  41           HB2      TYR  41   8.247   4.060  -3.034
  290    HD1  TYR  41           HD1      TYR  41   6.411   6.734  -1.157
  291    HD2  TYR  41           HD2      TYR  41  10.209   5.163  -2.390
  292    HE1  TYR  41           HE1      TYR  41   7.564   8.420   0.247
  293    HE2  TYR  41           HE2      TYR  41  11.366   6.845  -0.981
  294    HH   TYR  41           HH       TYR  41   9.684   8.773   1.324
  295    H    ASP  42           H        ASP  42   7.946   4.034  -5.796
  296    HA   ASP  42           HA       ASP  42   5.601   3.360  -7.239
  297    HB2  ASP  42           HB3      ASP  42   7.678   3.032  -8.330
  298    HB3  ASP  42           HB2      ASP  42   8.297   2.027  -7.019
  299    H    LEU  43           H        LEU  43   4.603   1.251  -7.457
  300    HA   LEU  43           HA       LEU  43   4.588  -0.386  -4.950
  301    HB2  LEU  43           HB3      LEU  43   2.557   1.090  -5.026
  302    HB3  LEU  43           HB2      LEU  43   2.130   0.363  -6.573
  303    HG   LEU  43           HG       LEU  43   2.002  -1.862  -5.494
  304   HD11  LEU  43          HD11      LEU  43   3.029  -0.285  -3.178
  305   HD12  LEU  43          HD12      LEU  43   3.384  -1.946  -3.651
  306   HD13  LEU  43          HD13      LEU  43   1.867  -1.567  -2.836
  307   HD21  LEU  43          HD21      LEU  43  -0.154  -1.247  -5.295
  308   HD22  LEU  43          HD22      LEU  43   0.294   0.418  -4.926
  309   HD23  LEU  43          HD23      LEU  43   0.208  -0.780  -3.635
  310    H    GLY  44           H        GLY  44   5.945  -1.907  -6.104
  311    HA2  GLY  44           HA3      GLY  44   4.879  -3.116  -8.565
  312    HA3  GLY  44           HA2      GLY  44   6.401  -3.538  -7.781
  313    H    GLY  45           H        GLY  45   4.301  -5.380  -8.693
  314    HA2  GLY  45           HA3      GLY  45   4.258  -7.482  -7.120
  315    HA3  GLY  45           HA2      GLY  45   3.244  -6.447  -6.126
  316    H    ASP  46           H        ASP  46   1.770  -8.372  -6.602
  317    HA   ASP  46           HA       ASP  46   0.610  -8.670  -9.223
  318    HB2  ASP  46           HB3      ASP  46   0.515 -10.156  -6.969
  319    HB3  ASP  46           HB2      ASP  46  -1.042  -9.336  -6.845
  320    H    THR  47           H        THR  47   0.671  -5.906  -7.916
  321    HA   THR  47           HA       THR  47  -1.671  -4.800  -7.083
  322    HB   THR  47           HB       THR  47  -1.164  -2.792  -8.437
  323    HG1  THR  47           HG1      THR  47   0.498  -2.924  -9.953
  324   HG21  THR  47          HG21      THR  47   1.064  -2.400  -7.572
  325   HG22  THR  47          HG22      THR  47   1.362  -4.134  -7.439
  326   HG23  THR  47          HG23      THR  47   0.169  -3.360  -6.396
  327    H    ALA  48           H        ALA  48  -1.212  -6.348 -10.174
  328    HA   ALA  48           HA       ALA  48  -3.556  -5.234 -11.460
  329    HB1  ALA  48           HB1      ALA  48  -1.467  -6.625 -12.401
  330    HB2  ALA  48           HB2      ALA  48  -3.024  -6.612 -13.229
  331    HB3  ALA  48           HB3      ALA  48  -2.594  -7.965 -12.183
  332    H    CYS  49           H        CYS  49  -3.607  -6.716  -8.677
  333    HA   CYS  49           HA       CYS  49  -5.963  -8.469  -9.302
  334    HB2  CYS  49           HB3      CYS  49  -5.018 -10.054  -7.997
  335    HB3  CYS  49           HB2      CYS  49  -3.601  -9.027  -7.809
  336    H    LEU  50           H        LEU  50  -4.688  -5.822  -7.433
  337    HA   LEU  50           HA       LEU  50  -6.710  -5.647  -5.431
  338    HB2  LEU  50           HB3      LEU  50  -5.175  -3.372  -6.721
  339    HB3  LEU  50           HB2      LEU  50  -5.955  -3.344  -5.141
  340    HG   LEU  50           HG       LEU  50  -3.760  -5.297  -5.888
  341   HD11  LEU  50          HD11      LEU  50  -2.302  -3.836  -4.467
  342   HD12  LEU  50          HD12      LEU  50  -3.596  -2.638  -4.454
  343   HD13  LEU  50          HD13      LEU  50  -2.813  -3.075  -5.973
  344   HD21  LEU  50          HD21      LEU  50  -3.599  -5.271  -3.289
  345   HD22  LEU  50          HD22      LEU  50  -4.904  -6.186  -4.040
  346   HD23  LEU  50          HD23      LEU  50  -5.226  -4.597  -3.349
  347    H    THR  51           H        THR  51  -7.126  -5.504  -8.712
  348    HA   THR  51           HA       THR  51  -8.910  -3.271  -9.005
  349    HB   THR  51           HB       THR  51  -9.543  -5.580 -10.696
  350    HG1  THR  51           HG1      THR  51  -6.895  -4.805 -10.215
  351   HG21  THR  51          HG21      THR  51 -10.080  -3.205 -11.198
  352   HG22  THR  51          HG22      THR  51  -9.091  -3.943 -12.458
  353   HG23  THR  51          HG23      THR  51  -8.353  -2.854 -11.283
  354    H    ARG  52           H        ARG  52  -9.245  -5.744  -6.938
  355    HA   ARG  52           HA       ARG  52 -12.202  -6.001  -7.326
  356    HB2  ARG  52           HB3      ARG  52 -12.062  -8.033  -5.993
  357    HB3  ARG  52           HB2      ARG  52 -10.886  -8.127  -7.304
  358    HG2  ARG  52           HG3      ARG  52  -9.233  -7.083  -5.583
  359    HG3  ARG  52           HG2      ARG  52 -10.406  -7.619  -4.379
  360    HD2  ARG  52           HD3      ARG  52  -8.717  -9.358  -4.699
  361    HD3  ARG  52           HD2      ARG  52 -10.269  -9.923  -5.319
  362    HE   ARG  52           HE       ARG  52  -9.042  -8.794  -7.533
  363   HH11  ARG  52          HH22      ARG  52  -8.232 -11.143  -5.143
  364   HH12  ARG  52          HH21      ARG  52  -7.217 -12.064  -6.202
  365   HH21  ARG  52          HH11      ARG  52  -7.719  -9.982  -8.929
  366   HH22  ARG  52          HH12      ARG  52  -6.926 -11.406  -8.344
  367    H    TRP  53           H        TRP  53  -9.689  -4.842  -5.216
  368    HA   TRP  53           HA       TRP  53 -11.726  -4.224  -3.103
  369    HB2  TRP  53           HB3      TRP  53  -8.699  -4.308  -2.921
  370    HB3  TRP  53           HB2      TRP  53  -9.797  -3.958  -1.588
  371    HD1  TRP  53           HD1      TRP  53 -11.922  -6.077  -1.681
  372    HE1  TRP  53           HE1      TRP  53 -11.410  -8.595  -1.464
  373    HE3  TRP  53           HE3      TRP  53  -6.995  -6.092  -3.007
  374    HZ2  TRP  53           HZ2      TRP  53  -9.197 -10.382  -1.812
  375    HZ3  TRP  53           HZ3      TRP  53  -5.709  -8.210  -3.058
  376    HH2  TRP  53           HH2      TRP  53  -6.800 -10.351  -2.460
  377    H    LEU  54           H        LEU  54  -9.393  -2.938  -5.324
  378    HA   LEU  54           HA       LEU  54  -9.918  -0.168  -4.347
  379    HB2  LEU  54           HB3      LEU  54  -7.743  -1.324  -6.111
  380    HB3  LEU  54           HB2      LEU  54  -7.928   0.403  -5.826
  381    HG   LEU  54           HG       LEU  54  -7.572  -1.656  -3.621
  382   HD11  LEU  54          HD11      LEU  54  -5.599  -1.045  -5.331
  383   HD12  LEU  54          HD12      LEU  54  -5.307  -1.281  -3.611
  384   HD13  LEU  54          HD13      LEU  54  -5.465   0.348  -4.262
  385   HD21  LEU  54          HD21      LEU  54  -6.792   0.817  -2.678
  386   HD22  LEU  54          HD22      LEU  54  -8.352   0.061  -2.367
  387   HD23  LEU  54          HD23      LEU  54  -8.180   1.220  -3.683
  388    HA   PRO  55           HA       PRO  55 -12.403   0.428  -7.986
  389    HB2  PRO  55           HB2      PRO  55 -12.249   3.116  -8.357
  390    HB3  PRO  55           HB3      PRO  55 -13.140   2.388  -7.005
  391    HG2  PRO  55           HG3      PRO  55 -10.453   3.652  -7.041
  392    HG3  PRO  55           HG2      PRO  55 -11.717   3.724  -5.804
  393    HD2  PRO  55           HD3      PRO  55  -9.493   2.092  -5.648
  394    HD3  PRO  55           HD2      PRO  55 -11.018   1.782  -4.798
  395    H    SER  56           H        SER  56  -9.069   1.262  -8.007
  396    HA   SER  56           HA       SER  56  -8.978   0.884 -10.938
  397    HB2  SER  56           HB3      SER  56  -8.298   2.985 -11.478
  398    HB3  SER  56           HB2      SER  56  -9.001   3.457  -9.934
  399    HG   SER  56           HG       SER  56  -6.878   4.146  -9.985
  400    H    GLU  57           H        GLU  57  -6.779   0.334 -11.648
  401    HA   GLU  57           HA       GLU  57  -5.367  -1.225  -9.684
  402    HB2  GLU  57           HB3      GLU  57  -5.440  -1.691 -12.168
  403    HB3  GLU  57           HB2      GLU  57  -4.330  -0.341 -12.385
  404    HG2  GLU  57           HG3      GLU  57  -2.824  -1.516 -10.665
  405    HG3  GLU  57           HG2      GLU  57  -3.845  -2.933 -10.917
  406    HA   PRO  58           HA       PRO  58  -3.028   2.357  -8.198
  407    HB2  PRO  58           HB2      PRO  58  -1.301   1.023  -6.533
  408    HB3  PRO  58           HB3      PRO  58  -2.958   1.461  -6.093
  409    HG2  PRO  58           HG3      PRO  58  -1.842  -1.152  -6.900
  410    HG3  PRO  58           HG2      PRO  58  -3.179  -0.777  -5.801
  411    HD2  PRO  58           HD3      PRO  58  -3.487  -1.695  -8.401
  412    HD3  PRO  58           HD2      PRO  58  -4.730  -0.817  -7.485
  413    H    ARG  59           H        ARG  59  -0.544   2.717  -7.734
  414    HA   ARG  59           HA       ARG  59   1.323   1.278  -9.433
  415    HB2  ARG  59           HB3      ARG  59  -0.142   3.505 -10.537
  416    HB3  ARG  59           HB2      ARG  59   1.570   3.917 -10.424
  417    HG2  ARG  59           HG3      ARG  59   0.524   1.348 -11.647
  418    HG3  ARG  59           HG2      ARG  59   0.954   2.782 -12.580
  419    HD2  ARG  59           HD3      ARG  59   3.126   2.203 -12.526
  420    HD3  ARG  59           HD2      ARG  59   3.097   2.173 -10.764
  421    HE   ARG  59           HE       ARG  59   2.889  -0.182 -10.856
  422   HH11  ARG  59          HH22      ARG  59   2.249   1.323 -13.891
  423   HH12  ARG  59          HH21      ARG  59   2.183  -0.169 -14.768
  424   HH21  ARG  59          HH11      ARG  59   2.807  -2.139 -11.983
  425   HH22  ARG  59          HH12      ARG  59   2.498  -2.130 -13.686
  426    H    ALA  60           H        ALA  60   0.506   3.590  -7.040
  427    HA   ALA  60           HA       ALA  60   3.300   3.651  -6.146
  428    HB1  ALA  60           HB1      ALA  60   2.896   5.645  -7.716
  429    HB2  ALA  60           HB2      ALA  60   3.526   6.021  -6.112
  430    HB3  ALA  60           HB3      ALA  60   1.816   6.264  -6.467
  431    H    TRP  61           H        TRP  61   3.424   4.623  -3.932
  432    HA   TRP  61           HA       TRP  61   0.826   4.749  -2.491
  433    HB2  TRP  61           HB3      TRP  61   1.736   3.263  -0.698
  434    HB3  TRP  61           HB2      TRP  61   1.508   2.419  -2.225
  435    HD1  TRP  61           HD1      TRP  61   3.899   2.579  -3.833
  436    HE1  TRP  61           HE1      TRP  61   6.283   1.996  -3.050
  437    HE3  TRP  61           HE3      TRP  61   3.279   2.975   1.216
  438    HZ2  TRP  61           HZ2      TRP  61   7.731   1.718  -0.602
  439    HZ3  TRP  61           HZ3      TRP  61   5.173   2.528   2.751
  440    HH2  TRP  61           HH2      TRP  61   7.396   1.903   1.848
  441    H    ARG  62           H        ARG  62   1.011   5.991  -0.524
  442    HA   ARG  62           HA       ARG  62   3.614   7.431  -0.188
  443    HB2  ARG  62           HB3      ARG  62   2.248   8.980  -1.339
  444    HB3  ARG  62           HB2      ARG  62   0.829   8.555  -0.383
  445    HG2  ARG  62           HG3      ARG  62   1.523   9.778   1.452
  446    HG3  ARG  62           HG2      ARG  62   3.233   9.582   1.065
  447    HD2  ARG  62           HD3      ARG  62   3.095  11.198  -0.715
  448    HD3  ARG  62           HD2      ARG  62   1.338  11.265  -0.592
  449    HE   ARG  62           HE       ARG  62   2.458  11.986   1.933
  450   HH11  ARG  62          HH22      ARG  62   2.159  13.057  -1.330
  451   HH12  ARG  62          HH21      ARG  62   2.221  14.739  -0.923
  452   HH21  ARG  62          HH11      ARG  62   2.539  14.176   2.484
  453   HH22  ARG  62          HH12      ARG  62   2.436  15.372   1.236
  454    HA   PRO  63           HA       PRO  63   2.527   5.825   3.981
  455    HB2  PRO  63           HB2      PRO  63   5.109   6.835   4.854
  456    HB3  PRO  63           HB3      PRO  63   4.542   5.162   4.774
  457    HG2  PRO  63           HG3      PRO  63   6.439   6.332   3.128
  458    HG3  PRO  63           HG2      PRO  63   5.604   4.805   2.840
  459    HD2  PRO  63           HD3      PRO  63   5.246   7.385   1.495
  460    HD3  PRO  63           HD2      PRO  63   4.706   5.769   0.996
  461    H    THR  64           H        THR  64   1.249   7.136   5.259
  462    HA   THR  64           HA       THR  64   1.957  10.018   5.473
  463    HB   THR  64           HB       THR  64  -0.463   9.750   6.722
  464    HG1  THR  64           HG1      THR  64  -0.808   8.092   4.528
  465   HG21  THR  64          HG21      THR  64  -1.438  10.522   4.593
  466   HG22  THR  64          HG22      THR  64   0.018  10.012   3.740
  467   HG23  THR  64          HG23      THR  64   0.096  11.331   4.909
  468    HA   PRO  65           HA       PRO  65   3.251   9.524   9.671
  469    HB2  PRO  65           HB2      PRO  65   2.326  11.825  10.851
  470    HB3  PRO  65           HB3      PRO  65   3.709  11.778   9.748
  471    HG2  PRO  65           HG3      PRO  65   0.895  12.575   9.212
  472    HG3  PRO  65           HG2      PRO  65   2.405  13.290   8.623
  473    HD2  PRO  65           HD3      PRO  65   0.861  11.627   7.099
  474    HD3  PRO  65           HD2      PRO  65   2.623  11.754   6.906
  475    H    ALA  66           H        ALA  66   1.163   7.864   9.378
  476    HA   ALA  66           HA       ALA  66   0.060   7.472  11.898
  477    HB1  ALA  66           HB1      ALA  66  -1.303   9.308  12.064
  478    HB2  ALA  66           HB2      ALA  66  -2.397   8.293  11.125
  479    HB3  ALA  66           HB3      ALA  66  -1.413   9.512  10.316
  480    H    GLY  67           H        GLY  67  -0.105   7.124   8.474
  481    HA2  GLY  67           HA3      GLY  67  -0.855   4.352   8.664
  482    HA3  GLY  67           HA2      GLY  67  -2.223   5.318   8.112
  483    H    ILE  68           H        ILE  68  -1.558   3.632   6.233
  484    HA   ILE  68           HA       ILE  68   0.394   4.990   4.422
  485    HB   ILE  68           HB       ILE  68  -0.689   2.160   4.327
  486   HG12  ILE  68          HG13      ILE  68   2.073   3.139   5.108
  487   HG13  ILE  68          HG12      ILE  68   0.829   2.692   6.271
  488   HG21  ILE  68          HG21      ILE  68   1.185   1.864   2.685
  489   HG22  ILE  68          HG22      ILE  68   1.449   3.607   2.740
  490   HG23  ILE  68          HG23      ILE  68  -0.072   2.965   2.121
  491   HD11  ILE  68          HD11      ILE  68   2.119   0.904   4.198
  492   HD12  ILE  68          HD12      ILE  68   0.699   0.439   5.132
  493   HD13  ILE  68          HD13      ILE  68   2.228   0.758   5.952
  494    H    ALA  69           H        ALA  69  -0.231   5.319   2.215
  495    HA   ALA  69           HA       ALA  69  -3.157   5.042   1.652
  496    HB1  ALA  69           HB1      ALA  69  -1.805   7.384   0.466
  497    HB2  ALA  69           HB2      ALA  69  -1.981   7.449   2.220
  498    HB3  ALA  69           HB3      ALA  69  -3.405   7.260   1.198
  499    H    LEU  70           H        LEU  70  -3.666   4.700  -0.560
  500    HA   LEU  70           HA       LEU  70  -1.322   3.950  -2.272
  501    HB2  LEU  70           HB3      LEU  70  -4.122   2.867  -2.111
  502    HB3  LEU  70           HB2      LEU  70  -3.049   2.499  -3.455
  503    HG   LEU  70           HG       LEU  70  -1.902   2.135  -0.744
  504   HD11  LEU  70          HD11      LEU  70  -4.077   1.216  -0.286
  505   HD12  LEU  70          HD12      LEU  70  -3.003  -0.147  -0.602
  506   HD13  LEU  70          HD13      LEU  70  -4.124   0.398  -1.849
  507   HD21  LEU  70          HD21      LEU  70  -0.797   0.298  -1.812
  508   HD22  LEU  70          HD22      LEU  70  -0.819   1.605  -2.997
  509   HD23  LEU  70          HD23      LEU  70  -1.968   0.273  -3.130
  510    H    LEU  71           H        LEU  71  -1.155   4.953  -4.255
  511    HA   LEU  71           HA       LEU  71  -3.296   6.923  -4.944
  512    HB2  LEU  71           HB3      LEU  71  -0.427   6.836  -5.920
  513    HB3  LEU  71           HB2      LEU  71  -1.572   8.160  -6.111
  514    HG   LEU  71           HG       LEU  71  -0.522   7.119  -3.460
  515   HD11  LEU  71          HD11      LEU  71   0.054   9.723  -4.902
  516   HD12  LEU  71          HD12      LEU  71   1.159   8.352  -4.828
  517   HD13  LEU  71          HD13      LEU  71   0.724   9.214  -3.352
  518   HD21  LEU  71          HD21      LEU  71  -2.504   8.055  -2.788
  519   HD22  LEU  71          HD22      LEU  71  -2.649   9.049  -4.238
  520   HD23  LEU  71          HD23      LEU  71  -1.582   9.550  -2.929
  521    H    GLU  72           H        GLU  72  -3.521   7.295  -7.367
  522    HA   GLU  72           HA       GLU  72  -3.486   4.658  -8.777
  523    HB2  GLU  72           HB3      GLU  72  -5.300   5.567 -10.159
  524    HB3  GLU  72           HB2      GLU  72  -5.717   5.673  -8.450
  525    HG2  GLU  72           HG3      GLU  72  -6.274   7.811  -9.155
  526    HG3  GLU  72           HG2      GLU  72  -4.606   8.059  -8.640
  527    H    ARG  73           H        ARG  73  -1.421   7.058  -8.597
  528    HA   ARG  73           HA       ARG  73   0.320   7.618 -10.090
  529    HB2  ARG  73           HB3      ARG  73  -0.705   5.561 -11.477
  530    HB3  ARG  73           HB2      ARG  73  -1.230   6.877 -12.526
  531    HG2  ARG  73           HG3      ARG  73   1.137   7.734 -12.507
  532    HG3  ARG  73           HG2      ARG  73   1.603   6.268 -11.645
  533    HD2  ARG  73           HD3      ARG  73   1.996   5.931 -14.021
  534    HD3  ARG  73           HD2      ARG  73   0.639   4.921 -13.523
  535    HE   ARG  73           HE       ARG  73  -0.774   6.235 -14.888
  536   HH11  ARG  73          HH22      ARG  73   2.275   7.739 -14.313
  537   HH12  ARG  73          HH21      ARG  73   2.009   9.018 -15.449
  538   HH21  ARG  73          HH11      ARG  73  -1.138   7.897 -16.377
  539   HH22  ARG  73          HH12      ARG  73   0.075   9.108 -16.618
  540    H    GLY  74           H        GLY  74  -1.932   9.256  -9.224
  541    HA2  GLY  74           HA3      GLY  74  -1.590  11.430 -11.165
  542    HA3  GLY  74           HA2      GLY  74  -3.247  10.848 -11.004
  543    H    GLY  75           H        GLY  75  -2.263  10.210  -8.065
  544    HA2  GLY  75           HA3      GLY  75  -1.807  11.635  -6.120
  545    HA3  GLY  75           HA2      GLY  75  -2.504  12.994  -7.001
  546    H    LEU  76           H        LEU  76  -4.376  10.316  -7.638
  547    HA   LEU  76           HA       LEU  76  -6.459  11.273  -5.780
  548    HB2  LEU  76           HB3      LEU  76  -6.418  10.017  -8.357
  549    HB3  LEU  76           HB2      LEU  76  -7.312   8.974  -7.255
  550    HG   LEU  76           HG       LEU  76  -8.811  10.602  -8.335
  551   HD11  LEU  76          HD11      LEU  76  -8.602  10.063  -5.597
  552   HD12  LEU  76          HD12      LEU  76 -10.016  10.700  -6.434
  553   HD13  LEU  76          HD13      LEU  76  -8.863  11.804  -5.686
  554   HD21  LEU  76          HD21      LEU  76  -8.311  12.805  -8.543
  555   HD22  LEU  76          HD22      LEU  76  -6.669  12.338  -8.096
  556   HD23  LEU  76          HD23      LEU  76  -7.784  12.928  -6.863
  557    H    THR  77           H        THR  77  -5.943  10.512  -3.730
  558    HA   THR  77           HA       THR  77  -4.811   8.000  -3.095
  559    HB   THR  77           HB       THR  77  -6.842   9.036  -1.207
  560    HG1  THR  77           HG1      THR  77  -5.812  10.931  -0.869
  561   HG21  THR  77          HG21      THR  77  -4.960   7.318  -0.811
  562   HG22  THR  77          HG22      THR  77  -5.152   8.599   0.386
  563   HG23  THR  77          HG23      THR  77  -3.871   8.705  -0.821
  564    H    LEU  78           H        LEU  78  -5.613   5.982  -3.290
  565    HA   LEU  78           HA       LEU  78  -8.482   5.655  -3.932
  566    HB2  LEU  78           HB3      LEU  78  -6.290   3.566  -3.854
  567    HB3  LEU  78           HB2      LEU  78  -7.893   3.364  -4.538
  568    HG   LEU  78           HG       LEU  78  -6.093   5.562  -5.537
  569   HD11  LEU  78          HD11      LEU  78  -4.609   3.928  -6.110
  570   HD12  LEU  78          HD12      LEU  78  -5.768   3.601  -7.398
  571   HD13  LEU  78          HD13      LEU  78  -5.799   2.639  -5.923
  572   HD21  LEU  78          HD21      LEU  78  -7.822   4.023  -7.364
  573   HD22  LEU  78          HD22      LEU  78  -7.659   5.768  -7.178
  574   HD23  LEU  78          HD23      LEU  78  -8.704   4.864  -6.091
  575    H    MET  79           H        MET  79  -6.126   4.454  -1.526
  576    HA   MET  79           HA       MET  79  -8.409   4.017   0.325
  577    HB2  MET  79           HB3      MET  79  -7.918   1.879  -0.936
  578    HB3  MET  79           HB2      MET  79  -6.337   1.864  -0.166
  579    HG2  MET  79           HG3      MET  79  -7.718   0.509   1.224
  580    HG3  MET  79           HG2      MET  79  -7.592   2.053   2.065
  581    HE1  MET  79           HE1      MET  79  -9.543  -0.135  -0.350
  582    HE2  MET  79           HE2      MET  79 -11.197   0.014   0.258
  583    HE3  MET  79           HE3      MET  79  -9.933  -0.651   1.288
  584    H    LEU  80           H        LEU  80  -7.900   4.535   2.392
  585    HA   LEU  80           HA       LEU  80  -5.079   5.294   2.970
  586    HB2  LEU  80           HB3      LEU  80  -6.846   7.004   3.350
  587    HB3  LEU  80           HB2      LEU  80  -7.637   5.915   4.486
  588    HG   LEU  80           HG       LEU  80  -5.605   5.928   5.908
  589   HD11  LEU  80          HD11      LEU  80  -4.060   8.010   5.210
  590   HD12  LEU  80          HD12      LEU  80  -4.579   7.518   3.599
  591   HD13  LEU  80          HD13      LEU  80  -3.733   6.375   4.642
  592   HD21  LEU  80          HD21      LEU  80  -5.797   8.301   6.650
  593   HD22  LEU  80          HD22      LEU  80  -7.370   7.552   6.372
  594   HD23  LEU  80          HD23      LEU  80  -6.698   8.662   5.178
  595    H    LEU  81           H        LEU  81  -4.191   3.272   3.485
  596    HA   LEU  81           HA       LEU  81  -5.502   1.412   5.293
  597    HB2  LEU  81           HB3      LEU  81  -3.025   1.543   3.744
  598    HB3  LEU  81           HB2      LEU  81  -2.771   0.838   5.338
  599    HG   LEU  81           HG       LEU  81  -4.601  -0.756   4.941
  600   HD11  LEU  81          HD11      LEU  81  -6.187  -0.080   3.477
  601   HD12  LEU  81          HD12      LEU  81  -5.086  -0.619   2.210
  602   HD13  LEU  81          HD13      LEU  81  -5.094   1.072   2.708
  603   HD21  LEU  81          HD21      LEU  81  -2.571  -0.627   2.687
  604   HD22  LEU  81          HD22      LEU  81  -3.520  -2.052   3.106
  605   HD23  LEU  81          HD23      LEU  81  -2.339  -1.412   4.249
  606    H    GLY  82           H        GLY  82  -5.731   1.855   7.459
  607    HA2  GLY  82           HA3      GLY  82  -3.829   3.756   8.712
  608    HA3  GLY  82           HA2      GLY  82  -5.380   3.265   9.377
  609    H    ARG  83           H        ARG  83  -2.440   3.167  10.323
  610    HA   ARG  83           HA       ARG  83  -1.847   0.355  10.719
  611    HB2  ARG  83           HB3      ARG  83  -0.134   2.177  10.795
  612    HB3  ARG  83           HB2      ARG  83  -0.881   2.779  12.269
  613    HG2  ARG  83           HG3      ARG  83  -0.267  -0.100  12.353
  614    HG3  ARG  83           HG2      ARG  83   1.156   0.926  12.178
  615    HD2  ARG  83           HD3      ARG  83  -0.976   1.210  14.315
  616    HD3  ARG  83           HD2      ARG  83   0.653   0.582  14.557
  617    HE   ARG  83           HE       ARG  83   0.786   3.209  13.400
  618   HH11  ARG  83          HH22      ARG  83   0.065   1.467  16.288
  619   HH12  ARG  83          HH21      ARG  83   0.506   2.768  17.341
  620   HH21  ARG  83          HH11      ARG  83   1.365   4.918  14.760
  621   HH22  ARG  83          HH12      ARG  83   1.242   4.723  16.477
  622    H    GLN  84           H        GLN  84  -2.807  -0.977  12.247
  623    HA   GLN  84           HA       GLN  84  -4.370   0.343  14.433
  624    HB2  GLN  84           HB3      GLN  84  -4.804  -2.318  13.052
  625    HB3  GLN  84           HB2      GLN  84  -5.751  -1.726  14.417
  626    HG2  GLN  84           HG3      GLN  84  -5.459  -0.228  11.799
  627    HG3  GLN  84           HG2      GLN  84  -6.816  -1.291  12.175
  628   HE21  GLN  84          HE22      GLN  84  -7.293   1.462  11.710
  629   HE22  GLN  84          HE21      GLN  84  -7.750   2.201  13.168
  630    H    GLY  85           H        GLY  85  -2.092  -2.251  13.643
  631    HA2  GLY  85           HA3      GLY  85  -1.456  -2.445  16.546
  632    HA3  GLY  85           HA2      GLY  85  -1.823  -3.925  15.663
  633    H    GLU  86           H        GLU  86   0.040  -1.099  14.561
  634    HA   GLU  86           HA       GLU  86   2.239  -0.955  13.759
  635    HB2  GLU  86           HB3      GLU  86   2.465  -1.833  16.246
  636    HB3  GLU  86           HB2      GLU  86   3.005  -3.308  15.447
  637    HG2  GLU  86           HG3      GLU  86   4.537  -1.696  14.068
  638    HG3  GLU  86           HG2      GLU  86   4.250  -0.572  15.398
  639    H    GLY  87           H        GLY  87   2.724  -1.619  11.733
  640    HA2  GLY  87           HA3      GLY  87   3.298  -3.064   9.970
  641    HA3  GLY  87           HA2      GLY  87   3.441  -4.355  11.157
  642    H    ASP  88           H        ASP  88   0.533  -3.502  11.951
  643    HA   ASP  88           HA       ASP  88  -0.789  -5.150   9.827
  644    HB2  ASP  88           HB3      ASP  88  -0.918  -5.165  12.757
  645    HB3  ASP  88           HB2      ASP  88  -2.508  -5.115  11.994
  646    H    TYR  89           H        TYR  89  -1.589  -3.600   8.442
  647    HA   TYR  89           HA       TYR  89  -3.060  -1.289   9.594
  648    HB2  TYR  89           HB3      TYR  89  -2.255  -1.869   6.745
  649    HB3  TYR  89           HB2      TYR  89  -3.014  -0.400   7.288
  650    HD1  TYR  89           HD1      TYR  89  -0.025  -2.556   7.917
  651    HD2  TYR  89           HD2      TYR  89  -1.682   1.406   7.991
  652    HE1  TYR  89           HE1      TYR  89   2.203  -1.631   8.487
  653    HE2  TYR  89           HE2      TYR  89   0.547   2.329   8.563
  654    HH   TYR  89           HH       TYR  89   2.633   1.798   9.248
  655    H    ARG  90           H        ARG  90  -5.279  -1.035   9.203
  656    HA   ARG  90           HA       ARG  90  -6.603  -3.129   7.558
  657    HB2  ARG  90           HB3      ARG  90  -7.712  -2.248  10.230
  658    HB3  ARG  90           HB2      ARG  90  -8.181  -3.645   9.263
  659    HG2  ARG  90           HG3      ARG  90  -6.051  -4.736   9.712
  660    HG3  ARG  90           HG2      ARG  90  -5.459  -3.309  10.559
  661    HD2  ARG  90           HD3      ARG  90  -6.165  -4.738  12.296
  662    HD3  ARG  90           HD2      ARG  90  -7.506  -3.609  12.108
  663    HE   ARG  90           HE       ARG  90  -8.834  -5.425  11.407
  664   HH11  ARG  90          HH22      ARG  90  -5.466  -6.090  11.099
  665   HH12  ARG  90          HH21      ARG  90  -5.698  -7.746  10.646
  666   HH21  ARG  90          HH11      ARG  90  -9.157  -7.585  10.821
  667   HH22  ARG  90          HH12      ARG  90  -7.788  -8.591  10.487
  668    H    VAL  91           H        VAL  91  -8.617  -2.418   6.675
  669    HA   VAL  91           HA       VAL  91  -9.318   0.448   7.124
  670    HB   VAL  91           HB       VAL  91  -7.874   0.289   5.101
  671   HG11  VAL  91          HG11      VAL  91  -9.053  -2.116   4.686
  672   HG12  VAL  91          HG12      VAL  91  -8.259  -1.201   3.405
  673   HG13  VAL  91          HG13      VAL  91 -10.011  -1.118   3.593
  674   HG21  VAL  91          HG21      VAL  91 -10.464   1.452   5.332
  675   HG22  VAL  91          HG22      VAL  91 -10.307   0.855   3.681
  676   HG23  VAL  91          HG23      VAL  91  -9.123   1.994   4.322
  677    H    GLN  92           H        GLN  92 -11.470   0.643   7.474
  678    HA   GLN  92           HA       GLN  92 -13.255  -1.563   7.468
  679    HB2  GLN  92           HB3      GLN  92 -15.041   0.109   7.719
  680    HB3  GLN  92           HB2      GLN  92 -13.659   0.535   8.730
  681    HG2  GLN  92           HG3      GLN  92 -12.966   1.827   6.460
  682    HG3  GLN  92           HG2      GLN  92 -14.723   1.893   6.313
  683   HE21  GLN  92          HE22      GLN  92 -15.849   2.592   8.506
  684   HE22  GLN  92          HE21      GLN  92 -15.096   3.860   9.346
  685    H    LYS  93           H        LYS  93 -13.773  -2.693   5.655
  686    HA   LYS  93           HA       LYS  93 -13.757  -1.451   3.016
  687    HB2  LYS  93           HB3      LYS  93 -13.095  -3.749   3.123
  688    HB3  LYS  93           HB2      LYS  93 -14.545  -4.192   4.021
  689    HG2  LYS  93           HG3      LYS  93 -15.864  -4.214   2.147
  690    HG3  LYS  93           HG2      LYS  93 -14.983  -2.888   1.389
  691    HD2  LYS  93           HD3      LYS  93 -13.270  -4.305   0.612
  692    HD3  LYS  93           HD2      LYS  93 -13.697  -5.589   1.744
  693    HE2  LYS  93           HE3      LYS  93 -15.754  -4.728  -0.247
  694    HE3  LYS  93           HE2      LYS  93 -14.416  -5.727  -0.813
  695    HZ1  LYS  93           HZ1      LYS  93 -15.721  -6.557   1.654
  696    HZ2  LYS  93           HZ2      LYS  93 -15.105  -7.495   0.383
  697    HZ3  LYS  93           HZ3      LYS  93 -16.620  -6.742   0.224
  698    H    GLY  94           H        GLY  94 -16.393  -3.331   4.556
  699    HA2  GLY  94           HA3      GLY  94 -18.421  -1.585   4.881
  700    HA3  GLY  94           HA2      GLY  94 -18.348  -1.645   3.120
  701    H    ASP  95           H        ASP  95 -18.230  -4.049   2.282
  702    HA   ASP  95           HA       ASP  95 -20.667  -5.337   3.011
  703    HB2  ASP  95           HB3      ASP  95 -18.233  -6.328   1.505
  704    HB3  ASP  95           HB2      ASP  95 -19.703  -7.287   1.692
  705    H    GLY  96           H        GLY  96 -17.945  -5.094   4.836
  706    HA2  GLY  96           HA3      GLY  96 -17.821  -6.164   7.023
  707    HA3  GLY  96           HA2      GLY  96 -18.613  -7.583   6.338
  708    H    GLY  97           H        GLY  97 -16.436  -6.508   4.093
  709    HA2  GLY  97           HA3      GLY  97 -14.717  -8.756   4.299
  710    HA3  GLY  97           HA2      GLY  97 -14.333  -7.290   3.396
  711    H    GLN  98           H        GLN  98 -12.109  -7.536   4.150
  712    HA   GLN  98           HA       GLN  98 -11.430  -5.880   6.325
  713    HB2  GLN  98           HB3      GLN  98 -12.303  -8.212   7.446
  714    HB3  GLN  98           HB2      GLN  98 -10.612  -8.609   7.190
  715    HG2  GLN  98           HG3      GLN  98  -9.929  -6.548   8.355
  716    HG3  GLN  98           HG2      GLN  98 -11.629  -6.156   8.640
  717   HE21  GLN  98          HE22      GLN  98 -11.829  -6.483  10.890
  718   HE22  GLN  98          HE21      GLN  98 -11.444  -7.939  11.674
  719    H    LEU  99           H        LEU  99  -9.926  -5.128   4.870
  720    HA   LEU  99           HA       LEU  99  -7.996  -6.961   3.655
  721    HB2  LEU  99           HB3      LEU  99  -7.912  -3.941   3.753
  722    HB3  LEU  99           HB2      LEU  99  -7.098  -4.997   2.609
  723    HG   LEU  99           HG       LEU  99 -10.091  -4.704   2.903
  724   HD11  LEU  99          HD11      LEU  99  -8.579  -4.019   0.416
  725   HD12  LEU  99          HD12      LEU  99  -8.525  -2.876   1.757
  726   HD13  LEU  99          HD13      LEU  99 -10.074  -3.326   1.044
  727   HD21  LEU  99          HD21      LEU  99  -8.320  -6.547   1.350
  728   HD22  LEU  99          HD22      LEU  99  -9.805  -5.987   0.585
  729   HD23  LEU  99          HD23      LEU  99  -9.877  -6.869   2.110
  730    H    VAL 100           H        VAL 100  -5.945  -7.349   4.420
  731    HA   VAL 100           HA       VAL 100  -5.020  -5.781   6.793
  732    HB   VAL 100           HB       VAL 100  -4.966  -8.797   6.492
  733   HG11  VAL 100          HG11      VAL 100  -4.163  -8.516   8.959
  734   HG12  VAL 100          HG12      VAL 100  -3.727  -6.882   8.460
  735   HG13  VAL 100          HG13      VAL 100  -2.995  -8.273   7.661
  736   HG21  VAL 100          HG21      VAL 100  -6.349  -8.565   8.652
  737   HG22  VAL 100          HG22      VAL 100  -7.162  -8.155   7.142
  738   HG23  VAL 100          HG23      VAL 100  -6.559  -6.875   8.197
  739    H    LEU 101           H        LEU 101  -3.235  -4.747   5.900
  740    HA   LEU 101           HA       LEU 101  -1.429  -6.276   4.090
  741    HB2  LEU 101           HB3      LEU 101  -2.117  -3.903   3.557
  742    HB3  LEU 101           HB2      LEU 101  -1.268  -3.403   4.998
  743    HG   LEU 101           HG       LEU 101   0.457  -5.079   3.440
  744   HD11  LEU 101          HD11      LEU 101  -0.788  -2.684   2.060
  745   HD12  LEU 101          HD12      LEU 101  -0.817  -4.357   1.499
  746   HD13  LEU 101          HD13      LEU 101   0.702  -3.461   1.523
  747   HD21  LEU 101          HD21      LEU 101   0.586  -2.116   4.070
  748   HD22  LEU 101          HD22      LEU 101   1.945  -3.171   3.678
  749   HD23  LEU 101          HD23      LEU 101   1.069  -3.389   5.192
  750    H    ARG 102           H        ARG 102   0.233  -7.429   5.122
  751    HA   ARG 102           HA       ARG 102   1.621  -6.061   7.355
  752    HB2  ARG 102           HB3      ARG 102  -0.188  -7.789   8.119
  753    HB3  ARG 102           HB2      ARG 102   0.979  -8.992   7.566
  754    HG2  ARG 102           HG3      ARG 102   2.639  -7.431   8.994
  755    HG3  ARG 102           HG2      ARG 102   1.142  -7.115   9.872
  756    HD2  ARG 102           HD3      ARG 102   2.188  -9.014  10.918
  757    HD3  ARG 102           HD2      ARG 102   0.802  -9.617  10.010
  758    HE   ARG 102           HE       ARG 102   3.292  -9.667   8.484
  759   HH11  ARG 102          HH22      ARG 102   1.230 -11.254  10.744
  760   HH12  ARG 102          HH21      ARG 102   1.814 -12.840  10.366
  761   HH21  ARG 102          HH11      ARG 102   4.065 -11.730   7.975
  762   HH22  ARG 102          HH12      ARG 102   3.419 -13.109   8.798
  763    H    ARG 103           H        ARG 103   3.793  -6.419   7.330
  764    HA   ARG 103           HA       ARG 103   5.241  -7.074   5.111
  765    HB2  ARG 103           HB3      ARG 103   6.638  -8.212   7.364
  766    HB3  ARG 103           HB2      ARG 103   6.984  -6.723   6.487
  767    HG2  ARG 103           HG3      ARG 103   5.283  -5.537   7.836
  768    HG3  ARG 103           HG2      ARG 103   4.959  -7.026   8.725
  769    HD2  ARG 103           HD3      ARG 103   7.540  -5.445   8.667
  770    HD3  ARG 103           HD2      ARG 103   6.495  -5.742  10.056
  771    HE   ARG 103           HE       ARG 103   7.182  -8.282   9.310
  772   HH11  ARG 103          HH22      ARG 103   8.947  -5.361   9.803
  773   HH12  ARG 103          HH21      ARG 103  10.394  -6.166  10.311
  774   HH21  ARG 103          HH11      ARG 103   9.062  -9.348   9.968
  775   HH22  ARG 103          HH12      ARG 103  10.459  -8.423  10.405
  776    H    ALA 104           H        ALA 104   5.563  -8.880   3.904
  777    HA   ALA 104           HA       ALA 104   4.253 -11.337   4.392
  778    HB1  ALA 104           HB1      ALA 104   5.093 -11.894   2.365
  779    HB2  ALA 104           HB2      ALA 104   6.754 -11.646   2.902
  780    HB3  ALA 104           HB3      ALA 104   5.796 -10.276   2.339
  781    H    THR 105           H        THR 105   4.890 -13.240   5.424
  782    HA   THR 105           HA       THR 105   6.954 -12.987   7.452
  783    HB   THR 105           HB       THR 105   6.108 -15.716   7.065
  784    HG1  THR 105           HG1      THR 105   3.913 -14.083   7.555
  785   HG21  THR 105          HG21      THR 105   5.440 -13.617   9.148
  786   HG22  THR 105          HG22      THR 105   6.813 -14.721   9.197
  787   HG23  THR 105          HG23      THR 105   5.171 -15.351   9.326
  788    HA   PRO 106           HA       PRO 106   9.018 -16.375   4.557
  789    HB2  PRO 106           HB2      PRO 106   8.107 -15.359   1.923
  790    HB3  PRO 106           HB3      PRO 106   8.244 -17.030   2.502
  791    HG2  PRO 106           HG3      PRO 106   5.875 -15.835   2.189
  792    HG3  PRO 106           HG2      PRO 106   6.177 -17.002   3.489
  793    HD2  PRO 106           HD3      PRO 106   6.000 -14.016   3.638
  794    HD3  PRO 106           HD2      PRO 106   5.469 -15.239   4.814
  Start of MODEL   18
    1    H1   SER   1           H        SER   1  12.402  24.906  -1.730
    2    H2   SER   1           H2       SER   1  11.941  25.138  -3.349
    3    H3   SER   1           1HT      SER   1  12.255  23.573  -2.769
    4    HA   SER   1           HA       SER   1  14.080  24.483  -4.140
    5    HB2  SER   1           HB3      SER   1  15.077  26.473  -3.632
    6    HB3  SER   1           HB2      SER   1  13.552  26.806  -2.817
    7    HG   SER   1           HG       SER   1  16.022  26.459  -1.782
    8    H    SER   2           H        SER   2  13.388  23.551  -0.897
    9    HA   SER   2           HA       SER   2  15.745  21.772  -0.923
   10    HB2  SER   2           HB3      SER   2  16.472  22.482   1.323
   11    HB3  SER   2           HB2      SER   2  16.560  23.826   0.188
   12    HG   SER   2           HG       SER   2  15.455  24.704   1.803
   13    H    LEU   3           H        LEU   3  13.072  21.063  -1.213
   14    HA   LEU   3           HA       LEU   3  12.082  20.233   1.445
   15    HB2  LEU   3           HB3      LEU   3  10.981  19.921  -1.361
   16    HB3  LEU   3           HB2      LEU   3  10.194  19.252   0.070
   17    HG   LEU   3           HG       LEU   3  10.973  22.107   0.248
   18   HD11  LEU   3          HD11      LEU   3  10.153  22.300  -1.952
   19   HD12  LEU   3          HD12      LEU   3   8.733  22.634  -0.962
   20   HD13  LEU   3          HD13      LEU   3   8.934  21.048  -1.705
   21   HD21  LEU   3          HD21      LEU   3   9.737  20.852   2.018
   22   HD22  LEU   3          HD22      LEU   3   8.416  20.598   0.879
   23   HD23  LEU   3          HD23      LEU   3   8.821  22.230   1.410
   24    H    ILE   4           H        ILE   4  11.352  17.858   1.607
   25    HA   ILE   4           HA       ILE   4  13.654  16.172   0.881
   26    HB   ILE   4           HB       ILE   4  12.691  16.017   3.148
   27   HG12  ILE   4          HG13      ILE   4  11.946  13.442   1.786
   28   HG13  ILE   4          HG12      ILE   4  13.624  13.989   1.751
   29   HG21  ILE   4          HG21      ILE   4  10.282  14.571   2.275
   30   HG22  ILE   4          HG22      ILE   4  10.269  16.286   1.863
   31   HG23  ILE   4          HG23      ILE   4  10.468  15.783   3.542
   32   HD11  ILE   4          HD11      ILE   4  13.156  12.491   3.688
   33   HD12  ILE   4          HD12      ILE   4  11.972  13.660   4.272
   34   HD13  ILE   4          HD13      ILE   4  13.679  14.098   4.190
   35    H    LEU   5           H        LEU   5  13.162  13.928  -0.017
   36    HA   LEU   5           HA       LEU   5  10.711  13.665  -1.601
   37    HB2  LEU   5           HB3      LEU   5  12.042  13.423  -3.756
   38    HB3  LEU   5           HB2      LEU   5  11.905  15.069  -3.138
   39    HG   LEU   5           HG       LEU   5  14.203  13.660  -2.015
   40   HD11  LEU   5          HD11      LEU   5  14.255  12.523  -4.166
   41   HD12  LEU   5          HD12      LEU   5  15.527  13.743  -4.139
   42   HD13  LEU   5          HD13      LEU   5  14.030  14.050  -5.017
   43   HD21  LEU   5          HD21      LEU   5  13.962  16.181  -3.687
   44   HD22  LEU   5          HD22      LEU   5  15.322  15.737  -2.656
   45   HD23  LEU   5          HD23      LEU   5  13.758  16.119  -1.936
   46    H    LEU   6           H        LEU   6  13.023  12.339   0.251
   47    HA   LEU   6           HA       LEU   6  12.359   9.625  -0.637
   48    HB2  LEU   6           HB3      LEU   6  14.465  10.575  -1.934
   49    HB3  LEU   6           HB2      LEU   6  15.297  10.184  -0.430
   50    HG   LEU   6           HG       LEU   6  13.632   8.266  -2.086
   51   HD11  LEU   6          HD11      LEU   6  16.360   9.093  -2.272
   52   HD12  LEU   6          HD12      LEU   6  15.543   7.826  -3.187
   53   HD13  LEU   6          HD13      LEU   6  16.337   7.439  -1.661
   54   HD21  LEU   6          HD21      LEU   6  15.032   8.039   0.579
   55   HD22  LEU   6          HD22      LEU   6  14.747   6.617  -0.424
   56   HD23  LEU   6          HD23      LEU   6  13.383   7.569   0.160
   57    H    SER   7           H        SER   7  11.530   9.262   1.436
   58    HA   SER   7           HA       SER   7  13.562   9.166   3.628
   59    HB2  SER   7           HB3      SER   7  10.923   9.671   4.673
   60    HB3  SER   7           HB2      SER   7  12.396  10.611   4.895
   61    HG   SER   7           HG       SER   7  10.291  11.281   3.510
   62    H    ALA   8           H        ALA   8  11.157   7.598   1.819
   63    HA   ALA   8           HA       ALA   8  10.515   5.645   3.944
   64    HB1  ALA   8           HB1      ALA   8   9.670   5.145   1.142
   65    HB2  ALA   8           HB2      ALA   8   9.015   6.594   1.903
   66    HB3  ALA   8           HB3      ALA   8   8.745   5.015   2.637
   67    H    SER   9           H        SER   9  11.993   4.066   4.306
   68    HA   SER   9           HA       SER   9  13.127   2.634   1.965
   69    HB2  SER   9           HB3      SER   9  15.278   2.701   3.697
   70    HB3  SER   9           HB2      SER   9  15.108   3.697   2.254
   71    HG   SER   9           HG       SER   9  14.774   5.373   3.480
   72    H    ASP  10           H        ASP  10  13.167   2.750   5.546
   73    HA   ASP  10           HA       ASP  10  13.605  -0.051   5.897
   74    HB2  ASP  10           HB3      ASP  10  13.847   1.748   7.665
   75    HB3  ASP  10           HB2      ASP  10  12.088   1.768   7.785
   76    H    LEU  11           H        LEU  11  10.847   1.658   4.822
   77    HA   LEU  11           HA       LEU  11   8.900  -0.327   5.767
   78    HB2  LEU  11           HB3      LEU  11   8.455   1.767   3.631
   79    HB3  LEU  11           HB2      LEU  11   7.255   1.017   4.684
   80    HG   LEU  11           HG       LEU  11   9.471   2.900   5.539
   81   HD11  LEU  11          HD11      LEU  11   6.448   3.161   5.534
   82   HD12  LEU  11          HD12      LEU  11   7.559   4.011   4.461
   83   HD13  LEU  11          HD13      LEU  11   7.571   4.351   6.192
   84   HD21  LEU  11          HD21      LEU  11   7.563   1.140   7.057
   85   HD22  LEU  11          HD22      LEU  11   8.052   2.686   7.750
   86   HD23  LEU  11          HD23      LEU  11   9.268   1.464   7.374
   87    H    ALA  12           H        ALA  12  10.562   0.487   2.746
   88    HA   ALA  12           HA       ALA  12   9.260  -1.087   0.879
   89    HB1  ALA  12           HB1      ALA  12  12.199  -1.444   0.869
   90    HB2  ALA  12           HB2      ALA  12  11.644   0.229   0.905
   91    HB3  ALA  12           HB3      ALA  12  11.134  -0.842  -0.400
   92    H    GLY  13           H        GLY  13   9.890  -3.299   0.045
   93    HA2  GLY  13           HA3      GLY  13  11.190  -5.395   0.951
   94    HA3  GLY  13           HA2      GLY  13  10.135  -5.178   2.345
   95    H    GLN  14           H        GLN  14   8.986  -7.147   2.027
   96    HA   GLN  14           HA       GLN  14   7.266  -7.211  -0.421
   97    HB2  GLN  14           HB3      GLN  14   9.043  -9.186   0.573
   98    HB3  GLN  14           HB2      GLN  14   7.412  -9.755   0.931
   99    HG2  GLN  14           HG3      GLN  14   6.789  -9.261  -1.456
  100    HG3  GLN  14           HG2      GLN  14   8.487  -8.904  -1.772
  101   HE21  GLN  14          HE22      GLN  14   6.838 -11.159  -2.877
  102   HE22  GLN  14          HE21      GLN  14   7.646 -12.579  -2.418
  103    H    TRP  15           H        TRP  15   5.045  -7.573  -0.032
  104    HA   TRP  15           HA       TRP  15   4.184  -7.982   2.778
  105    HB2  TRP  15           HB3      TRP  15   3.295  -5.644   1.070
  106    HB3  TRP  15           HB2      TRP  15   2.619  -6.064   2.635
  107    HD1  TRP  15           HD1      TRP  15   6.068  -5.097   1.117
  108    HE1  TRP  15           HE1      TRP  15   7.375  -3.793   2.909
  109    HE3  TRP  15           HE3      TRP  15   2.760  -5.365   5.007
  110    HZ2  TRP  15           HZ2      TRP  15   7.065  -2.961   5.626
  111    HZ3  TRP  15           HZ3      TRP  15   3.294  -4.300   7.181
  112    HH2  TRP  15           HH2      TRP  15   5.439  -3.099   7.495
  113    H    THR  16           H        THR  16   1.678  -8.148   2.789
  114    HA   THR  16           HA       THR  16   0.626  -9.225   0.209
  115    HB   THR  16           HB       THR  16  -0.407 -11.080   1.796
  116    HG1  THR  16           HG1      THR  16   2.095 -10.580   3.012
  117   HG21  THR  16          HG21      THR  16   1.802 -12.419   1.348
  118   HG22  THR  16          HG22      THR  16   2.289 -10.964   0.480
  119   HG23  THR  16          HG23      THR  16   0.844 -11.846  -0.018
  120    H    LEU  17           H        LEU  17  -1.768  -9.454   0.298
  121    HA   LEU  17           HA       LEU  17  -3.002  -7.584   2.300
  122    HB2  LEU  17           HB3      LEU  17  -3.061  -7.592  -0.580
  123    HB3  LEU  17           HB2      LEU  17  -4.686  -7.883   0.030
  124    HG   LEU  17           HG       LEU  17  -4.487  -5.895   1.491
  125   HD11  LEU  17          HD11      LEU  17  -1.713  -6.175   0.763
  126   HD12  LEU  17          HD12      LEU  17  -2.432  -5.116   1.975
  127   HD13  LEU  17          HD13      LEU  17  -2.284  -4.570   0.305
  128   HD21  LEU  17          HD21      LEU  17  -3.675  -4.689  -1.062
  129   HD22  LEU  17          HD22      LEU  17  -5.204  -4.555  -0.197
  130   HD23  LEU  17          HD23      LEU  17  -4.903  -5.942  -1.244
  131    H    GLN  18           H        GLN  18  -5.160  -8.200   3.044
  132    HA   GLN  18           HA       GLN  18  -6.121 -10.885   2.270
  133    HB2  GLN  18           HB3      GLN  18  -4.521 -10.570   4.540
  134    HB3  GLN  18           HB2      GLN  18  -6.169 -10.567   5.172
  135    HG2  GLN  18           HG3      GLN  18  -6.606 -12.644   3.803
  136    HG3  GLN  18           HG2      GLN  18  -4.881 -12.687   3.435
  137   HE21  GLN  18          HE22      GLN  18  -4.101 -11.661   6.129
  138   HE22  GLN  18          HE21      GLN  18  -4.354 -12.948   7.207
  139    H    GLN  19           H        GLN  19  -8.312 -10.739   2.069
  140    HA   GLN  19           HA       GLN  19  -9.696  -8.308   2.849
  141    HB2  GLN  19           HB3      GLN  19 -11.739  -9.870   2.184
  142    HB3  GLN  19           HB2      GLN  19 -10.658  -9.226   0.949
  143    HG2  GLN  19           HG3      GLN  19  -9.496 -11.262   0.729
  144    HG3  GLN  19           HG2      GLN  19 -10.085 -11.869   2.277
  145   HE21  GLN  19          HE22      GLN  19 -11.536 -10.671  -0.818
  146   HE22  GLN  19          HE21      GLN  19 -12.721 -11.882  -0.894
  147    H    ASP  20           H        ASP  20  -9.212 -11.443   4.289
  148    HA   ASP  20           HA       ASP  20 -10.183 -10.593   6.844
  149    HB2  ASP  20           HB3      ASP  20 -12.124 -12.328   6.854
  150    HB3  ASP  20           HB2      ASP  20 -12.412 -10.762   6.099
  151    H    GLU  21           H        GLU  21 -11.144 -13.794   6.102
  152    HA   GLU  21           HA       GLU  21  -8.467 -14.893   6.824
  153    HB2  GLU  21           HB3      GLU  21 -10.096 -14.624   8.832
  154    HB3  GLU  21           HB2      GLU  21 -10.987 -15.958   8.095
  155    HG2  GLU  21           HG3      GLU  21  -9.547 -17.180   9.417
  156    HG3  GLU  21           HG2      GLU  21  -8.535 -17.025   7.982
  157    H    ALA  22           H        ALA  22 -10.039 -14.778   4.322
  158    HA   ALA  22           HA       ALA  22 -10.390 -17.719   3.881
  159    HB1  ALA  22           HB1      ALA  22 -12.353 -15.773   3.654
  160    HB2  ALA  22           HB2      ALA  22 -12.402 -17.361   2.892
  161    HB3  ALA  22           HB3      ALA  22 -11.796 -15.967   1.994
  162    HA   PRO  23           HA       PRO  23  -7.632 -17.598   0.426
  163    HB2  PRO  23           HB2      PRO  23  -9.739 -17.878  -1.644
  164    HB3  PRO  23           HB3      PRO  23  -8.363 -18.938  -1.282
  165    HG2  PRO  23           HG3      PRO  23 -10.874 -19.616  -0.665
  166    HG3  PRO  23           HG2      PRO  23  -9.494 -20.078   0.347
  167    HD2  PRO  23           HD3      PRO  23 -11.541 -17.949   0.810
  168    HD3  PRO  23           HD2      PRO  23 -10.713 -18.996   1.982
  169    H    ALA  24           H        ALA  24  -8.264 -16.706  -2.335
  170    HA   ALA  24           HA       ALA  24  -8.153 -14.723  -3.576
  171    HB1  ALA  24           HB1      ALA  24 -10.510 -14.589  -2.538
  172    HB2  ALA  24           HB2      ALA  24  -9.801 -13.083  -3.120
  173    HB3  ALA  24           HB3      ALA  24  -9.804 -13.448  -1.394
  174    H    ILE  25           H        ILE  25  -5.846 -14.957  -2.464
  175    HA   ILE  25           HA       ILE  25  -5.290 -12.592  -0.733
  176    HB   ILE  25           HB       ILE  25  -4.435 -14.824  -0.015
  177   HG12  ILE  25          HG13      ILE  25  -2.113 -13.082  -0.855
  178   HG13  ILE  25          HG12      ILE  25  -3.238 -12.579   0.409
  179   HG21  ILE  25          HG21      ILE  25  -3.077 -16.134  -1.337
  180   HG22  ILE  25          HG22      ILE  25  -2.395 -14.749  -2.191
  181   HG23  ILE  25          HG23      ILE  25  -4.005 -15.339  -2.608
  182   HD11  ILE  25          HD11      ILE  25  -1.006 -14.104   0.852
  183   HD12  ILE  25          HD12      ILE  25  -2.249 -15.343   0.687
  184   HD13  ILE  25          HD13      ILE  25  -2.420 -14.082   1.906
  185    H    CYS  26           H        CYS  26  -3.225 -11.368  -1.325
  186    HA   CYS  26           HA       CYS  26  -2.586 -11.451  -4.222
  187    HB2  CYS  26           HB3      CYS  26  -3.989  -9.218  -2.822
  188    HB3  CYS  26           HB2      CYS  26  -2.752  -8.793  -4.000
  189    H    HIS  27           H        HIS  27  -0.411 -11.600  -4.227
  190    HA   HIS  27           HA       HIS  27   1.262 -10.738  -2.040
  191    HB2  HIS  27           HB3      HIS  27   1.610 -12.057  -4.619
  192    HB3  HIS  27           HB2      HIS  27   2.883 -10.871  -4.325
  193    HD1  HIS  27           HD1      HIS  27   4.832 -11.966  -3.238
  194    HD2  HIS  27           HD2      HIS  27   1.231 -13.576  -1.880
  195    HE1  HIS  27           HE1      HIS  27   5.435 -13.711  -1.502
  196    HE2  HIS  27           HE2      HIS  27   3.252 -14.698  -0.669
  197    H    LEU  28           H        LEU  28   2.229  -8.743  -1.740
  198    HA   LEU  28           HA       LEU  28   1.858  -6.700  -3.897
  199    HB2  LEU  28           HB3      LEU  28   1.061  -6.702  -1.075
  200    HB3  LEU  28           HB2      LEU  28   2.033  -5.304  -1.506
  201    HG   LEU  28           HG       LEU  28  -0.445  -4.968  -1.796
  202   HD11  LEU  28          HD11      LEU  28   0.176  -4.546  -4.514
  203   HD12  LEU  28          HD12      LEU  28   1.699  -4.386  -3.638
  204   HD13  LEU  28          HD13      LEU  28   0.317  -3.390  -3.190
  205   HD21  LEU  28          HD21      LEU  28  -0.485  -7.455  -2.855
  206   HD22  LEU  28          HD22      LEU  28  -0.395  -6.504  -4.336
  207   HD23  LEU  28          HD23      LEU  28  -1.713  -6.242  -3.198
  208    H    GLU  29           H        GLU  29   3.510  -4.924  -3.757
  209    HA   GLU  29           HA       GLU  29   5.987  -5.622  -2.305
  210    HB2  GLU  29           HB3      GLU  29   5.582  -6.185  -5.111
  211    HB3  GLU  29           HB2      GLU  29   6.863  -4.990  -4.911
  212    HG2  GLU  29           HG3      GLU  29   8.063  -6.439  -3.388
  213    HG3  GLU  29           HG2      GLU  29   6.729  -7.592  -3.362
  214    H    LEU  30           H        LEU  30   6.677  -3.793  -1.423
  215    HA   LEU  30           HA       LEU  30   5.828  -1.186  -2.534
  216    HB2  LEU  30           HB3      LEU  30   7.059  -2.133   0.044
  217    HB3  LEU  30           HB2      LEU  30   7.119  -0.432  -0.388
  218    HG   LEU  30           HG       LEU  30   4.735  -0.257  -0.429
  219   HD11  LEU  30          HD11      LEU  30   3.362  -2.370   0.074
  220   HD12  LEU  30          HD12      LEU  30   4.813  -3.277  -0.341
  221   HD13  LEU  30          HD13      LEU  30   4.040  -2.247  -1.546
  222   HD21  LEU  30          HD21      LEU  30   5.505  -2.072   1.879
  223   HD22  LEU  30          HD22      LEU  30   4.131  -0.969   1.846
  224   HD23  LEU  30          HD23      LEU  30   5.777  -0.333   1.833
  225    H    ARG  31           H        ARG  31   7.150  -0.768  -4.309
  226    HA   ARG  31           HA       ARG  31   9.878  -1.443  -4.597
  227    HB2  ARG  31           HB3      ARG  31   8.525   1.046  -5.660
  228    HB3  ARG  31           HB2      ARG  31   9.970   0.290  -6.314
  229    HG2  ARG  31           HG3      ARG  31   7.858  -1.667  -6.091
  230    HG3  ARG  31           HG2      ARG  31   7.295  -0.275  -7.014
  231    HD2  ARG  31           HD3      ARG  31   9.855  -1.812  -7.547
  232    HD3  ARG  31           HD2      ARG  31   8.368  -1.946  -8.486
  233    HE   ARG  31           HE       ARG  31   9.430   0.781  -8.287
  234   HH11  ARG  31          HH22      ARG  31   9.364  -2.232  -9.965
  235   HH12  ARG  31          HH21      ARG  31   9.852  -1.550 -11.480
  236   HH21  ARG  31          HH11      ARG  31  10.067   1.687 -10.255
  237   HH22  ARG  31          HH12      ARG  31  10.250   0.668 -11.644
  238    H    ASP  32           H        ASP  32  11.725   0.156  -4.607
  239    HA   ASP  32           HA       ASP  32  11.581   1.920  -2.190
  240    HB2  ASP  32           HB3      ASP  32  14.253   1.522  -2.624
  241    HB3  ASP  32           HB2      ASP  32  13.274   0.539  -1.535
  242    H    SER  33           H        SER  33  11.454   2.125  -5.438
  243    HA   SER  33           HA       SER  33  13.439   4.252  -5.840
  244    HB2  SER  33           HB3      SER  33  12.959   2.781  -7.713
  245    HB3  SER  33           HB2      SER  33  11.241   3.151  -7.614
  246    HG   SER  33           HG       SER  33  13.270   4.536  -8.790
  247    H    GLU  34           H        GLU  34  12.913   6.455  -6.219
  248    HA   GLU  34           HA       GLU  34  10.470   7.346  -4.825
  249    HB2  GLU  34           HB3      GLU  34  11.462   9.608  -5.078
  250    HB3  GLU  34           HB2      GLU  34  12.590   8.479  -4.327
  251    HG2  GLU  34           HG3      GLU  34  12.977   8.226  -7.115
  252    HG3  GLU  34           HG2      GLU  34  12.889   9.958  -6.788
  253    H    VAL  35           H        VAL  35   8.950   8.824  -5.825
  254    HA   VAL  35           HA       VAL  35   9.061   9.018  -8.790
  255    HB   VAL  35           HB       VAL  35   6.762   7.831  -7.208
  256   HG11  VAL  35          HG11      VAL  35   6.076   7.605  -9.840
  257   HG12  VAL  35          HG12      VAL  35   6.891   9.168  -9.844
  258   HG13  VAL  35          HG13      VAL  35   5.507   8.898  -8.785
  259   HG21  VAL  35          HG21      VAL  35   8.565   6.757  -9.402
  260   HG22  VAL  35          HG22      VAL  35   7.146   5.915  -8.778
  261   HG23  VAL  35          HG23      VAL  35   8.525   6.223  -7.722
  262    H    ALA  36           H        ALA  36   8.781  11.149  -9.218
  263    HA   ALA  36           HA       ALA  36   7.504  12.903  -7.247
  264    HB1  ALA  36           HB1      ALA  36   9.511  13.304  -9.030
  265    HB2  ALA  36           HB2      ALA  36   8.541  14.612  -8.355
  266    HB3  ALA  36           HB3      ALA  36   8.150  13.953  -9.945
  267    H    GLU  37           H        GLU  37   6.690  11.445 -10.348
  268    HA   GLU  37           HA       GLU  37   4.519  13.030 -11.146
  269    HB2  GLU  37           HB3      GLU  37   5.427  11.040 -12.392
  270    HB3  GLU  37           HB2      GLU  37   4.590   9.999 -11.241
  271    HG2  GLU  37           HG3      GLU  37   3.179  10.250 -13.195
  272    HG3  GLU  37           HG2      GLU  37   2.437  11.147 -11.870
  273    H    ALA  38           H        ALA  38   4.749  10.741  -8.505
  274    HA   ALA  38           HA       ALA  38   1.931  11.409  -7.744
  275    HB1  ALA  38           HB1      ALA  38   2.805   8.975  -6.511
  276    HB2  ALA  38           HB2      ALA  38   3.094   8.861  -8.246
  277    HB3  ALA  38           HB3      ALA  38   1.474   9.208  -7.645
  278    H    SER  39           H        SER  39   5.111  11.855  -6.957
  279    HA   SER  39           HA       SER  39   6.147  12.650  -5.020
  280    HB2  SER  39           HB3      SER  39   3.517  12.936  -3.636
  281    HB3  SER  39           HB2      SER  39   4.890  14.039  -3.667
  282    HG   SER  39           HG       SER  39   4.242  14.814  -5.564
  283    H    GLY  40           H        GLY  40   5.940   9.878  -5.261
  284    HA2  GLY  40           HA3      GLY  40   6.143   9.084  -2.456
  285    HA3  GLY  40           HA2      GLY  40   4.795   8.324  -3.303
  286    H    TYR  41           H        TYR  41   5.713   6.212  -3.278
  287    HA   TYR  41           HA       TYR  41   8.143   5.878  -4.984
  288    HB2  TYR  41           HB3      TYR  41   7.221   4.107  -2.710
  289    HB3  TYR  41           HB2      TYR  41   8.692   3.922  -3.654
  290    HD1  TYR  41           HD1      TYR  41   6.899   6.354  -1.448
  291    HD2  TYR  41           HD2      TYR  41  10.666   5.001  -2.992
  292    HE1  TYR  41           HE1      TYR  41   8.082   7.913   0.073
  293    HE2  TYR  41           HE2      TYR  41  11.854   6.556  -1.468
  294    HH   TYR  41           HH       TYR  41  11.528   7.787   0.516
  295    H    ASP  42           H        ASP  42   8.091   4.075  -6.406
  296    HA   ASP  42           HA       ASP  42   5.583   3.537  -7.600
  297    HB2  ASP  42           HB3      ASP  42   7.672   3.340  -8.837
  298    HB3  ASP  42           HB2      ASP  42   8.164   1.984  -7.829
  299    H    LEU  43           H        LEU  43   4.545   1.497  -7.852
  300    HA   LEU  43           HA       LEU  43   4.759  -0.338  -5.481
  301    HB2  LEU  43           HB3      LEU  43   2.669   1.033  -5.326
  302    HB3  LEU  43           HB2      LEU  43   2.174   0.406  -6.885
  303    HG   LEU  43           HG       LEU  43   2.541  -1.955  -5.768
  304   HD11  LEU  43          HD11      LEU  43   1.652  -0.749  -3.245
  305   HD12  LEU  43          HD12      LEU  43   3.340  -0.419  -3.635
  306   HD13  LEU  43          HD13      LEU  43   2.769  -2.084  -3.528
  307   HD21  LEU  43          HD21      LEU  43   0.384  -1.039  -6.508
  308   HD22  LEU  43          HD22      LEU  43   0.230  -0.177  -4.982
  309   HD23  LEU  43          HD23      LEU  43   0.220  -1.936  -5.005
  310    H    GLY  44           H        GLY  44   4.887  -2.468  -5.998
  311    HA2  GLY  44           HA3      GLY  44   4.336  -3.285  -8.826
  312    HA3  GLY  44           HA2      GLY  44   5.762  -3.854  -7.958
  313    H    GLY  45           H        GLY  45   5.019  -6.053  -8.158
  314    HA2  GLY  45           HA3      GLY  45   4.183  -7.868  -6.815
  315    HA3  GLY  45           HA2      GLY  45   3.066  -6.756  -6.046
  316    H    ASP  46           H        ASP  46   1.245  -8.063  -6.438
  317    HA   ASP  46           HA       ASP  46   0.532  -8.597  -9.278
  318    HB2  ASP  46           HB3      ASP  46   0.343 -10.256  -7.170
  319    HB3  ASP  46           HB2      ASP  46  -1.232  -9.472  -7.042
  320    H    THR  47           H        THR  47   0.466  -5.919  -7.992
  321    HA   THR  47           HA       THR  47  -1.918  -4.889  -7.140
  322    HB   THR  47           HB       THR  47  -1.229  -2.832  -7.956
  323    HG1  THR  47           HG1      THR  47  -0.957  -4.276 -10.255
  324   HG21  THR  47          HG21      THR  47   1.153  -2.761  -7.886
  325   HG22  THR  47          HG22      THR  47   1.292  -4.403  -8.513
  326   HG23  THR  47          HG23      THR  47   0.690  -4.132  -6.879
  327    H    ALA  48           H        ALA  48  -1.367  -6.354 -10.257
  328    HA   ALA  48           HA       ALA  48  -3.669  -5.265 -11.601
  329    HB1  ALA  48           HB1      ALA  48  -2.362  -7.955 -12.094
  330    HB2  ALA  48           HB2      ALA  48  -1.733  -6.432 -12.722
  331    HB3  ALA  48           HB3      ALA  48  -3.318  -7.010 -13.236
  332    H    CYS  49           H        CYS  49  -3.752  -6.830  -8.812
  333    HA   CYS  49           HA       CYS  49  -6.181  -8.447  -9.499
  334    HB2  CYS  49           HB3      CYS  49  -5.680  -9.891  -7.654
  335    HB3  CYS  49           HB2      CYS  49  -4.167  -9.688  -8.538
  336    H    LEU  50           H        LEU  50  -4.879  -5.820  -7.668
  337    HA   LEU  50           HA       LEU  50  -6.870  -5.696  -5.602
  338    HB2  LEU  50           HB3      LEU  50  -5.291  -3.435  -6.858
  339    HB3  LEU  50           HB2      LEU  50  -6.129  -3.373  -5.313
  340    HG   LEU  50           HG       LEU  50  -3.990  -5.422  -5.911
  341   HD11  LEU  50          HD11      LEU  50  -3.628  -2.761  -4.507
  342   HD12  LEU  50          HD12      LEU  50  -3.083  -3.105  -6.148
  343   HD13  LEU  50          HD13      LEU  50  -2.385  -3.980  -4.785
  344   HD21  LEU  50          HD21      LEU  50  -5.392  -4.435  -3.421
  345   HD22  LEU  50          HD22      LEU  50  -3.833  -5.248  -3.332
  346   HD23  LEU  50          HD23      LEU  50  -5.223  -6.089  -4.006
  347    H    THR  51           H        THR  51  -7.262  -5.432  -8.894
  348    HA   THR  51           HA       THR  51  -9.049  -3.208  -9.130
  349    HB   THR  51           HB       THR  51  -9.962  -4.672 -11.104
  350    HG1  THR  51           HG1      THR  51  -8.320  -6.352  -9.839
  351   HG21  THR  51          HG21      THR  51  -7.747  -4.234 -12.347
  352   HG22  THR  51          HG22      THR  51  -7.164  -3.583 -10.816
  353   HG23  THR  51          HG23      THR  51  -8.551  -2.844 -11.617
  354    H    ARG  52           H        ARG  52  -9.394  -5.658  -7.073
  355    HA   ARG  52           HA       ARG  52 -12.338  -5.972  -7.472
  356    HB2  ARG  52           HB3      ARG  52 -12.192  -7.947  -6.096
  357    HB3  ARG  52           HB2      ARG  52 -10.905  -8.051  -7.297
  358    HG2  ARG  52           HG3      ARG  52  -9.390  -6.955  -5.543
  359    HG3  ARG  52           HG2      ARG  52 -10.672  -7.292  -4.382
  360    HD2  ARG  52           HD3      ARG  52  -9.371  -9.390  -6.140
  361    HD3  ARG  52           HD2      ARG  52  -8.931  -9.087  -4.459
  362    HE   ARG  52           HE       ARG  52 -11.697  -9.509  -4.431
  363   HH11  ARG  52          HH22      ARG  52  -8.844 -11.164  -5.435
  364   HH12  ARG  52          HH21      ARG  52  -9.493 -12.741  -5.131
  365   HH21  ARG  52          HH11      ARG  52 -12.561 -11.560  -4.028
  366   HH22  ARG  52          HH12      ARG  52 -11.598 -12.966  -4.336
  367    H    TRP  53           H        TRP  53  -9.908  -4.530  -5.497
  368    HA   TRP  53           HA       TRP  53 -11.977  -3.810  -3.444
  369    HB2  TRP  53           HB3      TRP  53  -8.963  -3.976  -3.121
  370    HB3  TRP  53           HB2      TRP  53 -10.109  -3.517  -1.862
  371    HD1  TRP  53           HD1      TRP  53 -12.295  -5.618  -2.003
  372    HE1  TRP  53           HE1      TRP  53 -11.834  -8.114  -1.554
  373    HE3  TRP  53           HE3      TRP  53  -7.267  -5.760  -2.885
  374    HZ2  TRP  53           HZ2      TRP  53  -9.624  -9.931  -1.563
  375    HZ3  TRP  53           HZ3      TRP  53  -6.010  -7.883  -2.655
  376    HH2  TRP  53           HH2      TRP  53  -7.179  -9.967  -1.996
  377    H    LEU  54           H        LEU  54  -9.234  -2.703  -5.381
  378    HA   LEU  54           HA       LEU  54  -9.776   0.099  -4.612
  379    HB2  LEU  54           HB3      LEU  54  -7.622  -1.216  -6.278
  380    HB3  LEU  54           HB2      LEU  54  -7.702   0.519  -6.021
  381    HG   LEU  54           HG       LEU  54  -7.585  -1.504  -3.762
  382   HD11  LEU  54          HD11      LEU  54  -5.295  -1.332  -3.679
  383   HD12  LEU  54          HD12      LEU  54  -5.288   0.277  -4.399
  384   HD13  LEU  54          HD13      LEU  54  -5.513  -1.144  -5.417
  385   HD21  LEU  54          HD21      LEU  54  -7.992   1.377  -3.911
  386   HD22  LEU  54          HD22      LEU  54  -6.575   0.960  -2.954
  387   HD23  LEU  54          HD23      LEU  54  -8.152   0.291  -2.533
  388    HA   PRO  55           HA       PRO  55 -11.986   0.748  -8.419
  389    HB2  PRO  55           HB2      PRO  55 -11.666   3.416  -8.842
  390    HB3  PRO  55           HB3      PRO  55 -12.691   2.763  -7.552
  391    HG2  PRO  55           HG3      PRO  55 -10.005   3.984  -7.397
  392    HG3  PRO  55           HG2      PRO  55 -11.327   3.997  -6.221
  393    HD2  PRO  55           HD3      PRO  55  -9.058   2.360  -6.102
  394    HD3  PRO  55           HD2      PRO  55 -10.551   2.130  -5.178
  395    H    SER  56           H        SER  56  -8.613   1.286  -8.281
  396    HA   SER  56           HA       SER  56  -8.372   0.827 -11.170
  397    HB2  SER  56           HB3      SER  56  -7.829   2.927 -11.783
  398    HB3  SER  56           HB2      SER  56  -8.296   3.471 -10.173
  399    HG   SER  56           HG       SER  56  -6.263   3.737  -9.738
  400    H    GLU  57           H        GLU  57  -6.084   0.347 -11.744
  401    HA   GLU  57           HA       GLU  57  -4.808  -1.212  -9.680
  402    HB2  GLU  57           HB3      GLU  57  -4.697  -1.809 -12.077
  403    HB3  GLU  57           HB2      GLU  57  -3.741  -0.358 -12.384
  404    HG2  GLU  57           HG3      GLU  57  -1.923  -1.157 -11.062
  405    HG3  GLU  57           HG2      GLU  57  -2.899  -2.454 -10.375
  406    HA   PRO  58           HA       PRO  58  -2.517   2.438  -8.201
  407    HB2  PRO  58           HB2      PRO  58  -1.220   1.220  -6.123
  408    HB3  PRO  58           HB3      PRO  58  -2.875   1.821  -6.024
  409    HG2  PRO  58           HG3      PRO  58  -1.892  -0.938  -6.280
  410    HG3  PRO  58           HG2      PRO  58  -3.358  -0.319  -5.536
  411    HD2  PRO  58           HD3      PRO  58  -3.223  -1.567  -8.028
  412    HD3  PRO  58           HD2      PRO  58  -4.573  -0.566  -7.454
  413    H    ARG  59           H        ARG  59  -0.713   3.095  -9.226
  414    HA   ARG  59           HA       ARG  59   1.494   1.133  -9.647
  415    HB2  ARG  59           HB3      ARG  59   0.365   3.329 -11.255
  416    HB3  ARG  59           HB2      ARG  59   2.127   3.295 -11.192
  417    HG2  ARG  59           HG3      ARG  59   2.220   1.070 -12.040
  418    HG3  ARG  59           HG2      ARG  59   0.491   0.826 -11.786
  419    HD2  ARG  59           HD3      ARG  59   1.408   3.045 -13.587
  420    HD3  ARG  59           HD2      ARG  59   1.386   1.390 -14.198
  421    HE   ARG  59           HE       ARG  59  -1.121   1.820 -12.989
  422   HH11  ARG  59          HH22      ARG  59   0.821   3.094 -15.539
  423   HH12  ARG  59          HH21      ARG  59  -0.532   3.567 -16.511
  424   HH21  ARG  59          HH11      ARG  59  -2.898   2.431 -14.242
  425   HH22  ARG  59          HH12      ARG  59  -2.639   3.192 -15.777
  426    H    ALA  60           H        ALA  60   0.608   3.668  -7.619
  427    HA   ALA  60           HA       ALA  60   3.483   4.303  -7.114
  428    HB1  ALA  60           HB1      ALA  60   3.041   6.468  -7.401
  429    HB2  ALA  60           HB2      ALA  60   1.884   6.388  -6.078
  430    HB3  ALA  60           HB3      ALA  60   1.354   6.092  -7.736
  431    H    TRP  61           H        TRP  61   3.386   5.536  -4.735
  432    HA   TRP  61           HA       TRP  61   1.709   4.203  -2.769
  433    HB2  TRP  61           HB3      TRP  61   3.359   2.424  -3.618
  434    HB3  TRP  61           HB2      TRP  61   4.625   3.417  -2.942
  435    HD1  TRP  61           HD1      TRP  61   1.553   1.448  -1.902
  436    HE1  TRP  61           HE1      TRP  61   1.848   0.726   0.576
  437    HE3  TRP  61           HE3      TRP  61   5.902   3.843  -0.823
  438    HZ2  TRP  61           HZ2      TRP  61   3.736   1.130   2.722
  439    HZ3  TRP  61           HZ3      TRP  61   6.954   3.645   1.404
  440    HH2  TRP  61           HH2      TRP  61   5.875   2.296   3.181
  441    H    ARG  62           H        ARG  62   1.750   5.748  -1.105
  442    HA   ARG  62           HA       ARG  62   4.275   7.292  -0.671
  443    HB2  ARG  62           HB3      ARG  62   2.700   8.557  -2.141
  444    HB3  ARG  62           HB2      ARG  62   1.537   8.554  -0.816
  445    HG2  ARG  62           HG3      ARG  62   3.186   9.704   0.628
  446    HG3  ARG  62           HG2      ARG  62   4.332   9.727  -0.711
  447    HD2  ARG  62           HD3      ARG  62   3.383  11.815  -0.992
  448    HD3  ARG  62           HD2      ARG  62   2.277  10.859  -1.977
  449    HE   ARG  62           HE       ARG  62   0.597  11.175  -0.330
  450   HH11  ARG  62          HH22      ARG  62   3.728  12.153   0.742
  451   HH12  ARG  62          HH21      ARG  62   3.137  12.941   2.166
  452   HH21  ARG  62          HH11      ARG  62  -0.188  12.197   1.525
  453   HH22  ARG  62          HH12      ARG  62   0.922  12.967   2.609
  454    HA   PRO  63           HA       PRO  63   3.004   5.986   3.550
  455    HB2  PRO  63           HB2      PRO  63   5.343   7.587   4.357
  456    HB3  PRO  63           HB3      PRO  63   4.973   5.888   4.695
  457    HG2  PRO  63           HG3      PRO  63   6.882   6.705   2.954
  458    HG3  PRO  63           HG2      PRO  63   6.031   5.161   2.851
  459    HD2  PRO  63           HD3      PRO  63   5.747   7.563   1.146
  460    HD3  PRO  63           HD2      PRO  63   5.367   5.867   0.784
  461    H    THR  64           H        THR  64   1.653   7.164   4.958
  462    HA   THR  64           HA       THR  64   1.690  10.132   4.657
  463    HB   THR  64           HB       THR  64  -0.613   9.582   6.005
  464    HG1  THR  64           HG1      THR  64   0.234   7.255   5.411
  465   HG21  THR  64          HG21      THR  64  -1.740   9.763   3.823
  466   HG22  THR  64          HG22      THR  64  -0.220   9.406   3.004
  467   HG23  THR  64          HG23      THR  64  -0.394  10.899   3.924
  468    HA   PRO  65           HA       PRO  65   3.145  10.613   8.799
  469    HB2  PRO  65           HB2      PRO  65   1.491  12.633   9.752
  470    HB3  PRO  65           HB3      PRO  65   2.905  12.887   8.718
  471    HG2  PRO  65           HG3      PRO  65   0.026  12.796   7.998
  472    HG3  PRO  65           HG2      PRO  65   1.320  13.827   7.366
  473    HD2  PRO  65           HD3      PRO  65   0.383  11.685   5.988
  474    HD3  PRO  65           HD2      PRO  65   2.078  12.206   5.887
  475    H    ALA  66           H        ALA  66   1.104   8.524   8.450
  476    HA   ALA  66           HA       ALA  66   0.475   8.027  11.184
  477    HB1  ALA  66           HB1      ALA  66  -1.341   9.342  11.450
  478    HB2  ALA  66           HB2      ALA  66  -2.176   8.219  10.376
  479    HB3  ALA  66           HB3      ALA  66  -1.439   9.681   9.722
  480    H    GLY  67           H        GLY  67   0.396   7.220   7.874
  481    HA2  GLY  67           HA3      GLY  67   0.067   4.416   8.473
  482    HA3  GLY  67           HA2      GLY  67  -1.388   5.065   7.728
  483    H    ILE  68           H        ILE  68  -1.271   4.124   5.713
  484    HA   ILE  68           HA       ILE  68   1.004   4.978   3.997
  485    HB   ILE  68           HB       ILE  68  -0.203   2.199   3.943
  486   HG12  ILE  68          HG13      ILE  68   2.560   3.033   4.872
  487   HG13  ILE  68          HG12      ILE  68   1.230   2.668   5.964
  488   HG21  ILE  68          HG21      ILE  68   1.537   1.710   2.325
  489   HG22  ILE  68          HG22      ILE  68   2.238   3.315   2.530
  490   HG23  ILE  68          HG23      ILE  68   0.662   3.131   1.767
  491   HD11  ILE  68          HD11      ILE  68   3.032   0.820   4.937
  492   HD12  ILE  68          HD12      ILE  68   1.590   0.586   3.950
  493   HD13  ILE  68          HD13      ILE  68   1.491   0.443   5.704
  494    H    ALA  69           H        ALA  69   0.384   5.561   1.921
  495    HA   ALA  69           HA       ALA  69  -2.522   5.262   1.268
  496    HB1  ALA  69           HB1      ALA  69  -1.497   7.444  -0.180
  497    HB2  ALA  69           HB2      ALA  69  -0.845   7.626   1.449
  498    HB3  ALA  69           HB3      ALA  69  -2.588   7.518   1.205
  499    H    LEU  70           H        LEU  70  -2.983   4.598  -0.819
  500    HA   LEU  70           HA       LEU  70  -0.624   3.784  -2.504
  501    HB2  LEU  70           HB3      LEU  70  -3.454   2.760  -2.245
  502    HB3  LEU  70           HB2      LEU  70  -2.406   2.260  -3.558
  503    HG   LEU  70           HG       LEU  70  -1.162   2.071  -0.893
  504   HD11  LEU  70          HD11      LEU  70  -2.446  -0.019  -0.330
  505   HD12  LEU  70          HD12      LEU  70  -3.599   0.410  -1.594
  506   HD13  LEU  70          HD13      LEU  70  -3.397   1.461  -0.192
  507   HD21  LEU  70          HD21      LEU  70  -0.302   0.039  -1.800
  508   HD22  LEU  70          HD22      LEU  70  -0.377   1.151  -3.167
  509   HD23  LEU  70          HD23      LEU  70  -1.618  -0.085  -2.968
  510    H    LEU  71           H        LEU  71  -0.486   4.736  -4.560
  511    HA   LEU  71           HA       LEU  71  -2.827   6.436  -5.391
  512    HB2  LEU  71           HB3      LEU  71  -0.227   7.182  -6.511
  513    HB3  LEU  71           HB2      LEU  71  -1.467   8.181  -5.798
  514    HG   LEU  71           HG       LEU  71   0.512   6.505  -4.223
  515   HD11  LEU  71          HD11      LEU  71   1.923   8.231  -4.474
  516   HD12  LEU  71          HD12      LEU  71   0.744   9.271  -3.675
  517   HD13  LEU  71          HD13      LEU  71   0.727   9.108  -5.430
  518   HD21  LEU  71          HD21      LEU  71  -0.839   6.861  -2.457
  519   HD22  LEU  71          HD22      LEU  71  -2.010   7.634  -3.524
  520   HD23  LEU  71          HD23      LEU  71  -0.764   8.600  -2.740
  521    H    GLU  72           H        GLU  72  -2.519   6.986  -7.885
  522    HA   GLU  72           HA       GLU  72  -1.941   4.405  -9.292
  523    HB2  GLU  72           HB3      GLU  72  -3.755   4.976 -10.846
  524    HB3  GLU  72           HB2      GLU  72  -4.353   4.903  -9.189
  525    HG2  GLU  72           HG3      GLU  72  -5.210   6.962  -9.593
  526    HG3  GLU  72           HG2      GLU  72  -3.552   7.535  -9.413
  527    H    ARG  73           H        ARG  73  -0.276   6.986  -8.877
  528    HA   ARG  73           HA       ARG  73   1.411   7.928 -10.217
  529    HB2  ARG  73           HB3      ARG  73   0.748   5.801 -11.760
  530    HB3  ARG  73           HB2      ARG  73   0.208   7.115 -12.804
  531    HG2  ARG  73           HG3      ARG  73   2.518   8.184 -12.277
  532    HG3  ARG  73           HG2      ARG  73   2.976   6.564 -11.750
  533    HD2  ARG  73           HD3      ARG  73   2.221   5.687 -13.975
  534    HD3  ARG  73           HD2      ARG  73   1.945   7.352 -14.490
  535    HE   ARG  73           HE       ARG  73   4.634   6.982 -13.474
  536   HH11  ARG  73          HH22      ARG  73   2.504   6.522 -16.143
  537   HH12  ARG  73          HH21      ARG  73   3.765   6.565 -17.331
  538   HH21  ARG  73          HH11      ARG  73   6.296   7.040 -15.005
  539   HH22  ARG  73          HH12      ARG  73   5.914   6.859 -16.685
  540    H    GLY  74           H        GLY  74  -1.057   9.217  -9.438
  541    HA2  GLY  74           HA3      GLY  74  -0.972  11.433 -11.371
  542    HA3  GLY  74           HA2      GLY  74  -2.541  10.645 -11.206
  543    H    GLY  75           H        GLY  75  -1.358  10.178  -8.266
  544    HA2  GLY  75           HA3      GLY  75  -1.197  11.555  -6.292
  545    HA3  GLY  75           HA2      GLY  75  -1.875  12.903  -7.205
  546    H    LEU  76           H        LEU  76  -3.704  10.316  -8.063
  547    HA   LEU  76           HA       LEU  76  -5.903  11.158  -6.317
  548    HB2  LEU  76           HB3      LEU  76  -5.586   9.412  -8.713
  549    HB3  LEU  76           HB2      LEU  76  -6.930   9.043  -7.631
  550    HG   LEU  76           HG       LEU  76  -7.713  11.372  -7.793
  551   HD11  LEU  76          HD11      LEU  76  -6.548  12.678  -9.760
  552   HD12  LEU  76          HD12      LEU  76  -5.177  11.634  -9.380
  553   HD13  LEU  76          HD13      LEU  76  -5.836  12.711  -8.148
  554   HD21  LEU  76          HD21      LEU  76  -8.280  11.338 -10.261
  555   HD22  LEU  76          HD22      LEU  76  -8.640   9.837  -9.408
  556   HD23  LEU  76          HD23      LEU  76  -7.201   9.952 -10.421
  557    H    THR  77           H        THR  77  -5.499  10.451  -4.220
  558    HA   THR  77           HA       THR  77  -4.298   7.983  -3.508
  559    HB   THR  77           HB       THR  77  -6.268   8.724  -1.560
  560    HG1  THR  77           HG1      THR  77  -4.697  10.826  -2.628
  561   HG21  THR  77          HG21      THR  77  -4.019   7.687  -1.193
  562   HG22  THR  77          HG22      THR  77  -4.309   9.107  -0.189
  563   HG23  THR  77          HG23      THR  77  -3.287   9.233  -1.621
  564    H    LEU  78           H        LEU  78  -5.036   5.969  -3.824
  565    HA   LEU  78           HA       LEU  78  -7.870   5.534  -4.496
  566    HB2  LEU  78           HB3      LEU  78  -5.650   3.492  -4.228
  567    HB3  LEU  78           HB2      LEU  78  -7.191   3.261  -5.029
  568    HG   LEU  78           HG       LEU  78  -5.194   5.367  -5.901
  569   HD11  LEU  78          HD11      LEU  78  -5.334   3.288  -7.803
  570   HD12  LEU  78          HD12      LEU  78  -5.093   2.499  -6.246
  571   HD13  LEU  78          HD13      LEU  78  -3.952   3.726  -6.800
  572   HD21  LEU  78          HD21      LEU  78  -7.704   4.169  -7.096
  573   HD22  LEU  78          HD22      LEU  78  -6.538   5.071  -8.060
  574   HD23  LEU  78          HD23      LEU  78  -7.381   5.865  -6.733
  575    H    MET  79           H        MET  79  -5.594   4.681  -1.889
  576    HA   MET  79           HA       MET  79  -7.890   4.318  -0.084
  577    HB2  MET  79           HB3      MET  79  -7.519   2.109  -1.226
  578    HB3  MET  79           HB2      MET  79  -5.933   2.041  -0.478
  579    HG2  MET  79           HG3      MET  79  -7.415   0.818   0.962
  580    HG3  MET  79           HG2      MET  79  -7.109   2.360   1.759
  581    HE1  MET  79           HE1      MET  79 -10.891   0.697  -0.085
  582    HE2  MET  79           HE2      MET  79  -9.909  -0.074   1.169
  583    HE3  MET  79           HE3      MET  79  -9.222   0.244  -0.422
  584    H    LEU  80           H        LEU  80  -7.336   4.686   2.037
  585    HA   LEU  80           HA       LEU  80  -4.480   5.388   2.558
  586    HB2  LEU  80           HB3      LEU  80  -5.905   7.289   2.901
  587    HB3  LEU  80           HB2      LEU  80  -7.075   6.330   3.803
  588    HG   LEU  80           HG       LEU  80  -5.556   6.072   5.656
  589   HD11  LEU  80          HD11      LEU  80  -3.440   5.717   4.662
  590   HD12  LEU  80          HD12      LEU  80  -3.271   7.284   5.451
  591   HD13  LEU  80          HD13      LEU  80  -3.543   7.199   3.711
  592   HD21  LEU  80          HD21      LEU  80  -6.755   8.265   5.429
  593   HD22  LEU  80          HD22      LEU  80  -5.314   8.925   4.656
  594   HD23  LEU  80          HD23      LEU  80  -5.245   8.386   6.334
  595    H    LEU  81           H        LEU  81  -3.569   3.541   3.381
  596    HA   LEU  81           HA       LEU  81  -5.065   1.770   5.182
  597    HB2  LEU  81           HB3      LEU  81  -2.481   1.737   3.759
  598    HB3  LEU  81           HB2      LEU  81  -2.441   0.971   5.346
  599    HG   LEU  81           HG       LEU  81  -4.365  -0.433   4.731
  600   HD11  LEU  81          HD11      LEU  81  -4.380   1.426   2.422
  601   HD12  LEU  81          HD12      LEU  81  -5.721   0.579   3.194
  602   HD13  LEU  81          HD13      LEU  81  -4.693  -0.266   2.035
  603   HD21  LEU  81          HD21      LEU  81  -3.240  -1.814   3.029
  604   HD22  LEU  81          HD22      LEU  81  -2.072  -1.223   4.212
  605   HD23  LEU  81          HD23      LEU  81  -2.179  -0.464   2.624
  606    H    GLY  82           H        GLY  82  -5.193   2.122   7.365
  607    HA2  GLY  82           HA3      GLY  82  -3.327   4.096   8.576
  608    HA3  GLY  82           HA2      GLY  82  -4.860   3.585   9.266
  609    H    ARG  83           H        ARG  83  -1.956   3.546  10.248
  610    HA   ARG  83           HA       ARG  83  -1.252   0.754  10.577
  611    HB2  ARG  83           HB3      ARG  83   0.421   2.536  10.727
  612    HB3  ARG  83           HB2      ARG  83  -0.399   3.229  12.116
  613    HG2  ARG  83           HG3      ARG  83   0.548   0.356  12.125
  614    HG3  ARG  83           HG2      ARG  83   1.647   1.669  12.537
  615    HD2  ARG  83           HD3      ARG  83  -0.549   2.263  14.110
  616    HD3  ARG  83           HD2      ARG  83  -0.554   0.505  14.112
  617    HE   ARG  83           HE       ARG  83   2.091   1.587  14.613
  618   HH11  ARG  83          HH22      ARG  83  -1.001   0.831  15.936
  619   HH12  ARG  83          HH21      ARG  83  -0.406   0.610  17.547
  620   HH21  ARG  83          HH11      ARG  83   2.886   1.302  16.711
  621   HH22  ARG  83          HH12      ARG  83   1.793   0.876  17.985
  622    H    GLN  84           H        GLN  84  -2.301  -0.661  11.917
  623    HA   GLN  84           HA       GLN  84  -3.957   0.458  14.131
  624    HB2  GLN  84           HB3      GLN  84  -4.056  -2.064  12.504
  625    HB3  GLN  84           HB2      GLN  84  -4.815  -2.013  14.096
  626    HG2  GLN  84           HG3      GLN  84  -5.354   0.070  11.971
  627    HG3  GLN  84           HG2      GLN  84  -6.325  -1.390  12.140
  628   HE21  GLN  84          HE22      GLN  84  -6.354  -1.597  14.995
  629   HE22  GLN  84          HE21      GLN  84  -7.219  -0.276  15.620
  630    H    GLY  85           H        GLY  85  -1.276  -1.748  13.455
  631    HA2  GLY  85           HA3      GLY  85  -0.646  -1.747  16.339
  632    HA3  GLY  85           HA2      GLY  85  -0.977  -3.326  15.629
  633    H    GLU  86           H        GLU  86   0.891  -0.448  14.591
  634    HA   GLU  86           HA       GLU  86   2.993  -0.356  13.525
  635    HB2  GLU  86           HB3      GLU  86   3.409  -0.754  16.037
  636    HB3  GLU  86           HB2      GLU  86   3.783  -2.417  15.583
  637    HG2  GLU  86           HG3      GLU  86   5.891  -1.609  15.276
  638    HG3  GLU  86           HG2      GLU  86   5.247  -1.035  13.737
  639    H    GLY  87           H        GLY  87   2.754  -1.321  11.494
  640    HA2  GLY  87           HA3      GLY  87   3.765  -2.942   9.993
  641    HA3  GLY  87           HA2      GLY  87   3.754  -4.119  11.299
  642    H    ASP  88           H        ASP  88   0.968  -3.393  12.046
  643    HA   ASP  88           HA       ASP  88  -0.404  -4.916   9.872
  644    HB2  ASP  88           HB3      ASP  88  -1.862  -4.540  12.391
  645    HB3  ASP  88           HB2      ASP  88  -1.532  -6.024  11.494
  646    H    TYR  89           H        TYR  89  -1.269  -3.413   8.488
  647    HA   TYR  89           HA       TYR  89  -2.672  -1.054   9.657
  648    HB2  TYR  89           HB3      TYR  89  -1.912  -1.561   6.781
  649    HB3  TYR  89           HB2      TYR  89  -2.555  -0.077   7.422
  650    HD1  TYR  89           HD1      TYR  89   0.319  -2.442   7.931
  651    HD2  TYR  89           HD2      TYR  89  -1.075   1.622   8.052
  652    HE1  TYR  89           HE1      TYR  89   2.613  -1.665   8.430
  653    HE2  TYR  89           HE2      TYR  89   1.228   2.391   8.550
  654    HH   TYR  89           HH       TYR  89   3.963   0.207   8.428
  655    H    ARG  90           H        ARG  90  -4.892  -0.820   9.305
  656    HA   ARG  90           HA       ARG  90  -6.206  -2.824   7.539
  657    HB2  ARG  90           HB3      ARG  90  -7.419  -2.057  10.187
  658    HB3  ARG  90           HB2      ARG  90  -7.776  -3.455   9.175
  659    HG2  ARG  90           HG3      ARG  90  -5.549  -4.390   9.670
  660    HG3  ARG  90           HG2      ARG  90  -5.184  -2.993  10.676
  661    HD2  ARG  90           HD3      ARG  90  -5.908  -4.782  12.131
  662    HD3  ARG  90           HD2      ARG  90  -7.183  -3.564  12.088
  663    HE   ARG  90           HE       ARG  90  -7.938  -5.303  10.095
  664   HH11  ARG  90          HH22      ARG  90  -6.956  -5.630  13.384
  665   HH12  ARG  90          HH21      ARG  90  -7.918  -7.042  13.670
  666   HH21  ARG  90          HH11      ARG  90  -9.197  -7.147  10.450
  667   HH22  ARG  90          HH12      ARG  90  -9.187  -7.901  12.009
  668    H    VAL  91           H        VAL  91  -8.180  -2.097   6.642
  669    HA   VAL  91           HA       VAL  91  -8.971   0.715   7.202
  670    HB   VAL  91           HB       VAL  91  -7.354   0.669   5.250
  671   HG11  VAL  91          HG11      VAL  91  -8.608  -1.615   4.537
  672   HG12  VAL  91          HG12      VAL  91  -7.755  -0.596   3.379
  673   HG13  VAL  91          HG13      VAL  91  -9.507  -0.471   3.542
  674   HG21  VAL  91          HG21      VAL  91  -8.758   2.091   3.832
  675   HG22  VAL  91          HG22      VAL  91  -9.109   2.424   5.530
  676   HG23  VAL  91          HG23      VAL  91 -10.216   1.435   4.578
  677    H    GLN  92           H        GLN  92 -11.186   1.041   6.975
  678    HA   GLN  92           HA       GLN  92 -12.831  -1.368   6.733
  679    HB2  GLN  92           HB3      GLN  92 -13.573   1.550   7.105
  680    HB3  GLN  92           HB2      GLN  92 -14.718   0.208   7.165
  681    HG2  GLN  92           HG3      GLN  92 -14.074  -0.395   9.251
  682    HG3  GLN  92           HG2      GLN  92 -12.362  -0.191   8.875
  683   HE21  GLN  92          HE22      GLN  92 -11.616   1.229  10.484
  684   HE22  GLN  92          HE21      GLN  92 -12.330   2.725  10.846
  685    H    LYS  93           H        LYS  93 -13.345  -2.138   4.736
  686    HA   LYS  93           HA       LYS  93 -13.326  -0.351   2.404
  687    HB2  LYS  93           HB3      LYS  93 -12.522  -2.810   2.483
  688    HB3  LYS  93           HB2      LYS  93 -14.234  -3.229   2.416
  689    HG2  LYS  93           HG3      LYS  93 -14.471  -1.898   0.342
  690    HG3  LYS  93           HG2      LYS  93 -12.749  -1.518   0.399
  691    HD2  LYS  93           HD3      LYS  93 -12.551  -3.372  -0.914
  692    HD3  LYS  93           HD2      LYS  93 -12.668  -4.232   0.622
  693    HE2  LYS  93           HE3      LYS  93 -14.873  -3.689  -1.375
  694    HE3  LYS  93           HE2      LYS  93 -14.288  -5.252  -0.802
  695    HZ1  LYS  93           HZ1      LYS  93 -15.188  -4.852   1.333
  696    HZ2  LYS  93           HZ2      LYS  93 -16.411  -4.473   0.221
  697    HZ3  LYS  93           HZ3      LYS  93 -15.532  -3.228   0.973
  698    H    GLY  94           H        GLY  94 -15.620  -1.505   4.681
  699    HA2  GLY  94           HA3      GLY  94 -17.762   0.016   4.250
  700    HA3  GLY  94           HA2      GLY  94 -17.907  -1.049   2.849
  701    H    ASP  95           H        ASP  95 -16.809  -3.370   4.295
  702    HA   ASP  95           HA       ASP  95 -18.720  -3.845   6.487
  703    HB2  ASP  95           HB3      ASP  95 -19.897  -4.355   4.272
  704    HB3  ASP  95           HB2      ASP  95 -18.750  -5.682   4.086
  705    H    GLY  96           H        GLY  96 -18.245  -6.832   5.705
  706    HA2  GLY  96           HA3      GLY  96 -16.075  -7.293   7.503
  707    HA3  GLY  96           HA2      GLY  96 -16.738  -8.494   6.393
  708    H    GLY  97           H        GLY  97 -16.101  -6.338   4.208
  709    HA2  GLY  97           HA3      GLY  97 -13.705  -7.540   3.262
  710    HA3  GLY  97           HA2      GLY  97 -14.349  -6.004   2.678
  711    H    GLN  98           H        GLN  98 -12.277  -7.510   5.090
  712    HA   GLN  98           HA       GLN  98 -11.181  -4.827   5.803
  713    HB2  GLN  98           HB3      GLN  98 -11.953  -6.862   7.451
  714    HB3  GLN  98           HB2      GLN  98 -10.234  -7.215   7.264
  715    HG2  GLN  98           HG3      GLN  98  -9.688  -4.895   7.901
  716    HG3  GLN  98           HG2      GLN  98 -11.409  -4.553   8.106
  717   HE21  GLN  98          HE22      GLN  98 -11.339  -7.637   9.094
  718   HE22  GLN  98          HE21      GLN  98 -10.965  -7.443  10.738
  719    H    LEU  99           H        LEU  99  -9.388  -4.251   4.791
  720    HA   LEU  99           HA       LEU  99  -7.706  -6.313   3.495
  721    HB2  LEU  99           HB3      LEU  99  -7.423  -3.298   3.433
  722    HB3  LEU  99           HB2      LEU  99  -6.663  -4.456   2.351
  723    HG   LEU  99           HG       LEU  99  -9.645  -4.034   2.622
  724   HD11  LEU  99          HD11      LEU  99  -8.578  -3.472   0.014
  725   HD12  LEU  99          HD12      LEU  99  -7.695  -2.528   1.213
  726   HD13  LEU  99          HD13      LEU  99  -9.449  -2.390   1.099
  727   HD21  LEU  99          HD21      LEU  99  -7.935  -5.992   1.162
  728   HD22  LEU  99          HD22      LEU  99  -9.335  -5.355   0.301
  729   HD23  LEU  99          HD23      LEU  99  -9.550  -6.194   1.837
  730    H    VAL 100           H        VAL 100  -5.964  -7.075   4.552
  731    HA   VAL 100           HA       VAL 100  -4.781  -5.411   6.746
  732    HB   VAL 100           HB       VAL 100  -4.922  -8.422   6.438
  733   HG11  VAL 100          HG11      VAL 100  -3.310  -6.622   8.189
  734   HG12  VAL 100          HG12      VAL 100  -2.918  -8.221   7.558
  735   HG13  VAL 100          HG13      VAL 100  -4.009  -8.059   8.934
  736   HG21  VAL 100          HG21      VAL 100  -6.369  -8.331   8.374
  737   HG22  VAL 100          HG22      VAL 100  -6.999  -7.187   7.189
  738   HG23  VAL 100          HG23      VAL 100  -6.076  -6.603   8.573
  739    H    LEU 101           H        LEU 101  -2.932  -4.501   5.968
  740    HA   LEU 101           HA       LEU 101  -1.248  -6.014   4.043
  741    HB2  LEU 101           HB3      LEU 101  -1.769  -3.582   3.647
  742    HB3  LEU 101           HB2      LEU 101  -0.914  -3.219   5.127
  743    HG   LEU 101           HG       LEU 101   0.729  -4.896   3.470
  744   HD11  LEU 101          HD11      LEU 101   1.131  -3.113   1.716
  745   HD12  LEU 101          HD12      LEU 101  -0.356  -2.337   2.261
  746   HD13  LEU 101          HD13      LEU 101  -0.411  -3.954   1.560
  747   HD21  LEU 101          HD21      LEU 101   1.004  -2.022   4.402
  748   HD22  LEU 101          HD22      LEU 101   2.317  -3.056   3.840
  749   HD23  LEU 101          HD23      LEU 101   1.473  -3.439   5.341
  750    H    ARG 102           H        ARG 102   0.409  -7.285   4.934
  751    HA   ARG 102           HA       ARG 102   1.886  -6.173   7.231
  752    HB2  ARG 102           HB3      ARG 102  -0.010  -7.628   8.108
  753    HB3  ARG 102           HB2      ARG 102   0.778  -8.989   7.308
  754    HG2  ARG 102           HG3      ARG 102   2.880  -8.411   8.586
  755    HG3  ARG 102           HG2      ARG 102   1.925  -7.244   9.503
  756    HD2  ARG 102           HD3      ARG 102   2.102  -9.433  10.672
  757    HD3  ARG 102           HD2      ARG 102   0.433  -9.025  10.275
  758    HE   ARG 102           HE       ARG 102   0.387 -10.895   8.841
  759   HH11  ARG 102          HH22      ARG 102   3.608  -9.910   9.581
  760   HH12  ARG 102          HH21      ARG 102   4.345 -11.256   8.780
  761   HH21  ARG 102          HH11      ARG 102   1.332 -12.658   7.791
  762   HH22  ARG 102          HH12      ARG 102   3.057 -12.812   7.767
  763    H    ARG 103           H        ARG 103   4.018  -6.705   7.105
  764    HA   ARG 103           HA       ARG 103   5.274  -7.581   4.802
  765    HB2  ARG 103           HB3      ARG 103   6.798  -8.654   6.965
  766    HB3  ARG 103           HB2      ARG 103   7.085  -7.165   6.069
  767    HG2  ARG 103           HG3      ARG 103   5.576  -5.943   7.566
  768    HG3  ARG 103           HG2      ARG 103   5.212  -7.433   8.441
  769    HD2  ARG 103           HD3      ARG 103   7.938  -6.123   8.218
  770    HD3  ARG 103           HD2      ARG 103   6.910  -6.135   9.650
  771    HE   ARG 103           HE       ARG 103   7.202  -8.809   9.129
  772   HH11  ARG 103          HH22      ARG 103   9.376  -6.137   9.320
  773   HH12  ARG 103          HH21      ARG 103  10.708  -7.092   9.882
  774   HH21  ARG 103          HH11      ARG 103   8.930 -10.068   9.865
  775   HH22  ARG 103          HH12      ARG 103  10.455  -9.315  10.191
  776    H    ALA 104           H        ALA 104   5.213  -9.493   3.705
  777    HA   ALA 104           HA       ALA 104   3.791 -11.753   4.497
  778    HB1  ALA 104           HB1      ALA 104   5.593 -11.093   2.370
  779    HB2  ALA 104           HB2      ALA 104   4.361 -12.355   2.404
  780    HB3  ALA 104           HB3      ALA 104   5.995 -12.702   2.972
  781    H    THR 105           H        THR 105   6.908 -10.734   5.471
  782    HA   THR 105           HA       THR 105   7.862 -13.261   6.472
  783    HB   THR 105           HB       THR 105   9.166 -11.415   8.007
  784    HG1  THR 105           HG1      THR 105   9.184  -9.912   5.792
  785   HG21  THR 105          HG21      THR 105  10.201 -13.032   6.466
  786   HG22  THR 105          HG22      THR 105  10.883 -11.424   6.233
  787   HG23  THR 105          HG23      THR 105   9.695 -12.051   5.091
  788    HA   PRO 106           HA       PRO 106   5.566 -13.567  10.244
  789    HB2  PRO 106           HB2      PRO 106   7.427 -14.611  11.969
  790    HB3  PRO 106           HB3      PRO 106   6.624 -15.555  10.700
  791    HG2  PRO 106           HG3      PRO 106   9.343 -14.353  10.733
  792    HG3  PRO 106           HG2      PRO 106   8.797 -15.900  10.062
  793    HD2  PRO 106           HD3      PRO 106   9.275 -13.692   8.515
  794    HD3  PRO 106           HD2      PRO 106   8.096 -14.948   8.078
  Start of MODEL   19
    1    H1   SER   1           H        SER   1   8.149  22.527  -1.736
    2    H2   SER   1           H2       SER   1   7.866  24.051  -2.428
    3    H3   SER   1           1HT      SER   1   9.226  23.145  -2.890
    4    HA   SER   1           HA       SER   1   9.581  25.064  -1.265
    5    HB2  SER   1           HB3      SER   1   9.121  24.534   1.056
    6    HB3  SER   1           HB2      SER   1   7.620  24.375   0.147
    7    HG   SER   1           HG       SER   1   9.358  22.185   0.547
    8    H    SER   2           H        SER   2  11.261  24.444   0.676
    9    HA   SER   2           HA       SER   2  13.211  22.663  -0.642
   10    HB2  SER   2           HB3      SER   2  14.036  24.794   0.199
   11    HB3  SER   2           HB2      SER   2  13.407  24.443   1.807
   12    HG   SER   2           HG       SER   2  15.166  22.638   0.567
   13    H    LEU   3           H        LEU   3  14.566  21.867   1.787
   14    HA   LEU   3           HA       LEU   3  14.536  20.133   3.364
   15    HB2  LEU   3           HB3      LEU   3  12.193  21.595   3.816
   16    HB3  LEU   3           HB2      LEU   3  11.639  19.927   3.688
   17    HG   LEU   3           HG       LEU   3  12.191  20.398   6.009
   18   HD11  LEU   3          HD11      LEU   3  13.139  18.265   4.576
   19   HD12  LEU   3          HD12      LEU   3  13.238  18.408   6.331
   20   HD13  LEU   3          HD13      LEU   3  14.618  18.862   5.330
   21   HD21  LEU   3          HD21      LEU   3  13.848  21.826   6.538
   22   HD22  LEU   3          HD22      LEU   3  14.276  21.946   4.830
   23   HD23  LEU   3          HD23      LEU   3  15.037  20.721   5.846
   24    H    ILE   4           H        ILE   4  11.426  19.676   1.639
   25    HA   ILE   4           HA       ILE   4  10.601  17.756   0.558
   26    HB   ILE   4           HB       ILE   4  13.447  17.374  -0.378
   27   HG12  ILE   4          HG13      ILE   4  11.427  19.478  -1.206
   28   HG13  ILE   4          HG12      ILE   4  13.059  19.745  -0.591
   29   HG21  ILE   4          HG21      ILE   4  10.924  17.201  -2.009
   30   HG22  ILE   4          HG22      ILE   4  11.401  15.855  -0.973
   31   HG23  ILE   4          HG23      ILE   4  12.469  16.392  -2.270
   32   HD11  ILE   4          HD11      ILE   4  12.220  18.648  -3.271
   33   HD12  ILE   4          HD12      ILE   4  13.835  18.347  -2.631
   34   HD13  ILE   4          HD13      ILE   4  13.296  20.002  -2.926
   35    H    LEU   5           H        LEU   5  10.150  16.374   2.314
   36    HA   LEU   5           HA       LEU   5  12.108  14.920   3.794
   37    HB2  LEU   5           HB3      LEU   5   9.191  14.319   3.226
   38    HB3  LEU   5           HB2      LEU   5  10.173  13.404   4.369
   39    HG   LEU   5           HG       LEU   5  10.276  16.344   4.693
   40   HD11  LEU   5          HD11      LEU   5   8.078  16.247   5.986
   41   HD12  LEU   5          HD12      LEU   5   7.756  14.731   5.146
   42   HD13  LEU   5          HD13      LEU   5   7.932  16.228   4.230
   43   HD21  LEU   5          HD21      LEU   5  11.356  14.637   6.196
   44   HD22  LEU   5          HD22      LEU   5   9.742  14.086   6.648
   45   HD23  LEU   5          HD23      LEU   5  10.256  15.727   7.041
   46    H    LEU   6           H        LEU   6   9.814  12.865   2.191
   47    HA   LEU   6           HA       LEU   6  10.123  11.026   0.766
   48    HB2  LEU   6           HB3      LEU   6  11.096  13.072  -0.613
   49    HB3  LEU   6           HB2      LEU   6  12.632  12.256  -0.320
   50    HG   LEU   6           HG       LEU   6  11.236  10.124  -1.095
   51   HD11  LEU   6          HD11      LEU   6   9.165  11.607  -1.309
   52   HD12  LEU   6          HD12      LEU   6   9.551  10.617  -2.717
   53   HD13  LEU   6          HD13      LEU   6   9.950  12.335  -2.711
   54   HD21  LEU   6          HD21      LEU   6  12.462  12.259  -2.862
   55   HD22  LEU   6          HD22      LEU   6  11.998  10.666  -3.462
   56   HD23  LEU   6          HD23      LEU   6  13.245  10.812  -2.224
   57    H    SER   7           H        SER   7  11.383  11.077   3.415
   58    HA   SER   7           HA       SER   7  13.946   9.652   2.991
   59    HB2  SER   7           HB3      SER   7  12.501  10.472   5.527
   60    HB3  SER   7           HB2      SER   7  14.077   9.688   5.476
   61    HG   SER   7           HG       SER   7  13.857  12.145   5.525
   62    H    ALA   8           H        ALA   8  11.386   8.447   2.139
   63    HA   ALA   8           HA       ALA   8  10.978   6.272   4.108
   64    HB1  ALA   8           HB1      ALA   8   8.880   6.484   3.304
   65    HB2  ALA   8           HB2      ALA   8   9.462   5.711   1.829
   66    HB3  ALA   8           HB3      ALA   8   9.429   7.469   1.949
   67    H    SER   9           H        SER   9  12.451   4.642   3.985
   68    HA   SER   9           HA       SER   9  12.983   3.442   1.323
   69    HB2  SER   9           HB3      SER   9  14.922   4.939   2.907
   70    HB3  SER   9           HB2      SER   9  15.451   3.285   2.618
   71    HG   SER   9           HG       SER   9  15.891   3.913   0.671
   72    H    ASP  10           H        ASP  10  13.712   3.192   4.818
   73    HA   ASP  10           HA       ASP  10  14.176   0.387   4.841
   74    HB2  ASP  10           HB3      ASP  10  13.666   2.493   6.816
   75    HB3  ASP  10           HB2      ASP  10  13.034   0.921   7.307
   76    H    LEU  11           H        LEU  11  11.387   1.965   3.970
   77    HA   LEU  11           HA       LEU  11   9.505   0.045   5.171
   78    HB2  LEU  11           HB3      LEU  11   9.028   2.185   3.073
   79    HB3  LEU  11           HB2      LEU  11   7.785   1.310   3.967
   80    HG   LEU  11           HG       LEU  11   9.894   3.107   5.206
   81   HD11  LEU  11          HD11      LEU  11   8.243   4.760   5.424
   82   HD12  LEU  11          HD12      LEU  11   6.927   3.612   5.182
   83   HD13  LEU  11          HD13      LEU  11   7.922   4.113   3.815
   84   HD21  LEU  11          HD21      LEU  11   8.112   2.809   7.150
   85   HD22  LEU  11          HD22      LEU  11   9.385   1.613   6.912
   86   HD23  LEU  11          HD23      LEU  11   7.758   1.306   6.300
   87    H    ALA  12           H        ALA  12  11.719  -0.386   2.909
   88    HA   ALA  12           HA       ALA  12  10.088  -1.499   0.746
   89    HB1  ALA  12           HB1      ALA  12  12.876  -2.382   0.858
   90    HB2  ALA  12           HB2      ALA  12  12.717  -0.629   0.958
   91    HB3  ALA  12           HB3      ALA  12  12.031  -1.500  -0.414
   92    H    GLY  13           H        GLY  13  10.440  -3.852   0.119
   93    HA2  GLY  13           HA3      GLY  13  11.355  -6.012   1.333
   94    HA3  GLY  13           HA2      GLY  13  10.193  -5.529   2.565
   95    H    GLN  14           H        GLN  14   9.065  -7.564   2.143
   96    HA   GLN  14           HA       GLN  14   7.426  -7.484  -0.359
   97    HB2  GLN  14           HB3      GLN  14   8.243  -9.898   1.295
   98    HB3  GLN  14           HB2      GLN  14   7.259  -9.932  -0.170
   99    HG2  GLN  14           HG3      GLN  14   9.135 -10.039  -1.404
  100    HG3  GLN  14           HG2      GLN  14   9.615  -8.461  -0.779
  101   HE21  GLN  14          HE22      GLN  14   9.803 -11.968  -0.039
  102   HE22  GLN  14          HE21      GLN  14  11.211 -11.852   0.902
  103    H    TRP  15           H        TRP  15   5.175  -7.794  -0.041
  104    HA   TRP  15           HA       TRP  15   4.242  -8.214   2.741
  105    HB2  TRP  15           HB3      TRP  15   3.435  -5.835   1.046
  106    HB3  TRP  15           HB2      TRP  15   2.726  -6.265   2.596
  107    HD1  TRP  15           HD1      TRP  15   6.224  -5.357   1.154
  108    HE1  TRP  15           HE1      TRP  15   7.530  -4.119   2.992
  109    HE3  TRP  15           HE3      TRP  15   2.859  -5.651   4.994
  110    HZ2  TRP  15           HZ2      TRP  15   7.203  -3.347   5.724
  111    HZ3  TRP  15           HZ3      TRP  15   3.387  -4.652   7.201
  112    HH2  TRP  15           HH2      TRP  15   5.552  -3.501   7.570
  113    H    THR  16           H        THR  16   1.766  -8.353   2.728
  114    HA   THR  16           HA       THR  16   0.715  -9.394   0.133
  115    HB   THR  16           HB       THR  16  -0.342 -11.262   1.656
  116    HG1  THR  16           HG1      THR  16   1.826 -10.257   3.124
  117   HG21  THR  16          HG21      THR  16   1.006 -12.029  -0.082
  118   HG22  THR  16          HG22      THR  16   1.901 -12.586   1.332
  119   HG23  THR  16          HG23      THR  16   2.414 -11.130   0.480
  120    H    LEU  17           H        LEU  17  -1.668  -9.570   0.184
  121    HA   LEU  17           HA       LEU  17  -2.881  -7.672   2.165
  122    HB2  LEU  17           HB3      LEU  17  -2.942  -7.635  -0.650
  123    HB3  LEU  17           HB2      LEU  17  -4.530  -8.227  -0.162
  124    HG   LEU  17           HG       LEU  17  -4.677  -6.303   1.454
  125   HD11  LEU  17          HD11      LEU  17  -1.944  -6.051   0.751
  126   HD12  LEU  17          HD12      LEU  17  -2.875  -5.007   1.826
  127   HD13  LEU  17          HD13      LEU  17  -2.758  -4.625   0.109
  128   HD21  LEU  17          HD21      LEU  17  -5.733  -6.236  -0.796
  129   HD22  LEU  17          HD22      LEU  17  -4.251  -5.545  -1.453
  130   HD23  LEU  17          HD23      LEU  17  -5.198  -4.638  -0.276
  131    H    GLN  18           H        GLN  18  -4.943  -8.303   3.068
  132    HA   GLN  18           HA       GLN  18  -5.833 -11.081   2.498
  133    HB2  GLN  18           HB3      GLN  18  -4.218 -10.562   4.661
  134    HB3  GLN  18           HB2      GLN  18  -5.827 -10.391   5.360
  135    HG2  GLN  18           HG3      GLN  18  -5.251 -12.705   5.581
  136    HG3  GLN  18           HG2      GLN  18  -6.407 -12.612   4.251
  137   HE21  GLN  18          HE22      GLN  18  -2.921 -11.751   4.181
  138   HE22  GLN  18          HE21      GLN  18  -2.503 -12.901   3.006
  139    H    GLN  19           H        GLN  19  -7.953 -10.862   2.019
  140    HA   GLN  19           HA       GLN  19  -9.496  -8.630   3.227
  141    HB2  GLN  19           HB3      GLN  19  -9.837  -8.850   0.862
  142    HB3  GLN  19           HB2      GLN  19 -10.076 -10.592   0.992
  143    HG2  GLN  19           HG3      GLN  19 -12.219 -10.380   1.836
  144    HG3  GLN  19           HG2      GLN  19 -11.892  -8.802   2.554
  145   HE21  GLN  19          HE22      GLN  19 -12.404 -10.410  -0.614
  146   HE22  GLN  19          HE21      GLN  19 -12.971  -9.018  -1.403
  147    H    ASP  20           H        ASP  20 -10.623  -9.068   5.091
  148    HA   ASP  20           HA       ASP  20 -11.560 -10.314   6.819
  149    HB2  ASP  20           HB3      ASP  20 -12.894 -11.096   4.279
  150    HB3  ASP  20           HB2      ASP  20 -13.251 -12.066   5.708
  151    H    GLU  21           H        GLU  21 -12.221 -12.785   7.345
  152    HA   GLU  21           HA       GLU  21  -9.665 -14.226   7.278
  153    HB2  GLU  21           HB3      GLU  21 -11.401 -14.060   9.241
  154    HB3  GLU  21           HB2      GLU  21 -12.207 -15.379   8.394
  155    HG2  GLU  21           HG3      GLU  21 -10.777 -16.589   9.759
  156    HG3  GLU  21           HG2      GLU  21  -9.756 -16.393   8.333
  157    H    ALA  22           H        ALA  22 -10.954 -13.917   4.717
  158    HA   ALA  22           HA       ALA  22 -11.569 -16.777   4.094
  159    HB1  ALA  22           HB1      ALA  22 -13.446 -16.150   3.006
  160    HB2  ALA  22           HB2      ALA  22 -12.582 -14.886   2.129
  161    HB3  ALA  22           HB3      ALA  22 -13.236 -14.556   3.732
  162    HA   PRO  23           HA       PRO  23  -8.454 -16.867   0.948
  163    HB2  PRO  23           HB2      PRO  23 -10.398 -16.939  -1.298
  164    HB3  PRO  23           HB3      PRO  23  -9.141 -18.108  -0.854
  165    HG2  PRO  23           HG3      PRO  23 -11.750 -18.575  -0.463
  166    HG3  PRO  23           HG2      PRO  23 -10.492 -19.204   0.613
  167    HD2  PRO  23           HD3      PRO  23 -12.409 -16.966   1.068
  168    HD3  PRO  23           HD2      PRO  23 -11.676 -18.091   2.231
  169    H    ALA  24           H        ALA  24  -8.866 -15.878  -1.857
  170    HA   ALA  24           HA       ALA  24  -8.615 -13.898  -3.072
  171    HB1  ALA  24           HB1      ALA  24 -10.871 -13.479  -1.811
  172    HB2  ALA  24           HB2      ALA  24 -10.047 -12.119  -2.571
  173    HB3  ALA  24           HB3      ALA  24  -9.917 -12.368  -0.831
  174    H    ILE  25           H        ILE  25  -6.287 -14.371  -2.277
  175    HA   ILE  25           HA       ILE  25  -5.313 -12.156  -0.517
  176    HB   ILE  25           HB       ILE  25  -4.647 -14.291   0.364
  177   HG12  ILE  25          HG13      ILE  25  -2.269 -13.400  -1.285
  178   HG13  ILE  25          HG12      ILE  25  -2.866 -12.462   0.085
  179   HG21  ILE  25          HG21      ILE  25  -3.881 -14.905  -2.499
  180   HG22  ILE  25          HG22      ILE  25  -5.081 -15.730  -1.505
  181   HG23  ILE  25          HG23      ILE  25  -3.365 -15.896  -1.133
  182   HD11  ILE  25          HD11      ILE  25  -0.989 -14.307   0.423
  183   HD12  ILE  25          HD12      ILE  25  -2.377 -15.393   0.465
  184   HD13  ILE  25          HD13      ILE  25  -2.251 -14.076   1.633
  185    H    CYS  26           H        CYS  26  -3.157 -11.221  -1.264
  186    HA   CYS  26           HA       CYS  26  -2.625 -11.541  -4.153
  187    HB2  CYS  26           HB3      CYS  26  -3.908  -9.146  -2.941
  188    HB3  CYS  26           HB2      CYS  26  -2.634  -8.851  -4.117
  189    H    HIS  27           H        HIS  27  -0.468 -11.781  -4.232
  190    HA   HIS  27           HA       HIS  27   1.323 -10.956  -2.140
  191    HB2  HIS  27           HB3      HIS  27   2.870 -11.221  -4.454
  192    HB3  HIS  27           HB2      HIS  27   2.530 -12.496  -3.282
  193    HD1  HIS  27           HD1      HIS  27   1.745 -11.382  -6.730
  194    HD2  HIS  27           HD2      HIS  27   0.288 -14.202  -4.024
  195    HE1  HIS  27           HE1      HIS  27   0.263 -12.952  -8.059
  196    HE2  HIS  27           HE2      HIS  27  -0.628 -14.671  -6.421
  197    H    LEU  28           H        LEU  28   2.290  -8.994  -1.839
  198    HA   LEU  28           HA       LEU  28   2.107  -6.984  -4.054
  199    HB2  LEU  28           HB3      LEU  28   1.154  -6.910  -1.290
  200    HB3  LEU  28           HB2      LEU  28   2.218  -5.560  -1.660
  201    HG   LEU  28           HG       LEU  28  -0.184  -5.063  -2.140
  202   HD11  LEU  28          HD11      LEU  28   0.482  -3.704  -3.808
  203   HD12  LEU  28          HD12      LEU  28   0.823  -5.064  -4.877
  204   HD13  LEU  28          HD13      LEU  28   2.043  -4.519  -3.729
  205   HD21  LEU  28          HD21      LEU  28  -0.332  -7.617  -3.035
  206   HD22  LEU  28          HD22      LEU  28  -0.149  -6.765  -4.568
  207   HD23  LEU  28          HD23      LEU  28  -1.483  -6.363  -3.488
  208    H    GLU  29           H        GLU  29   3.894  -5.495  -4.179
  209    HA   GLU  29           HA       GLU  29   6.272  -6.206  -2.514
  210    HB2  GLU  29           HB3      GLU  29   5.918  -6.664  -5.342
  211    HB3  GLU  29           HB2      GLU  29   7.202  -5.482  -5.087
  212    HG2  GLU  29           HG3      GLU  29   7.033  -8.131  -3.626
  213    HG3  GLU  29           HG2      GLU  29   8.011  -7.863  -5.070
  214    H    LEU  30           H        LEU  30   6.897  -4.409  -1.495
  215    HA   LEU  30           HA       LEU  30   6.172  -1.764  -2.596
  216    HB2  LEU  30           HB3      LEU  30   6.990  -2.856   0.044
  217    HB3  LEU  30           HB2      LEU  30   7.493  -1.205  -0.307
  218    HG   LEU  30           HG       LEU  30   5.198  -0.544  -0.757
  219   HD11  LEU  30          HD11      LEU  30   4.791  -3.494  -0.705
  220   HD12  LEU  30          HD12      LEU  30   4.046  -2.275  -1.739
  221   HD13  LEU  30          HD13      LEU  30   3.482  -2.490  -0.083
  222   HD21  LEU  30          HD21      LEU  30   6.136  -0.892   1.669
  223   HD22  LEU  30          HD22      LEU  30   4.979  -2.221   1.731
  224   HD23  LEU  30          HD23      LEU  30   4.416  -0.574   1.451
  225    H    ARG  31           H        ARG  31   7.615  -1.271  -4.245
  226    HA   ARG  31           HA       ARG  31  10.428  -1.950  -4.117
  227    HB2  ARG  31           HB3      ARG  31   8.612  -0.588  -5.971
  228    HB3  ARG  31           HB2      ARG  31  10.231   0.114  -5.947
  229    HG2  ARG  31           HG3      ARG  31  11.242  -2.019  -6.447
  230    HG3  ARG  31           HG2      ARG  31   9.707  -2.857  -6.225
  231    HD2  ARG  31           HD3      ARG  31  10.066  -2.605  -8.602
  232    HD3  ARG  31           HD2      ARG  31   8.778  -1.496  -8.133
  233    HE   ARG  31           HE       ARG  31  11.035   0.069  -7.938
  234   HH11  ARG  31          HH22      ARG  31   9.707  -2.036 -10.325
  235   HH12  ARG  31          HH21      ARG  31  10.360  -1.148 -11.661
  236   HH21  ARG  31          HH11      ARG  31  11.892   1.241  -9.671
  237   HH22  ARG  31          HH12      ARG  31  11.596   0.706 -11.292
  238    H    ASP  32           H        ASP  32  12.162  -0.213  -4.179
  239    HA   ASP  32           HA       ASP  32  11.514   1.939  -2.201
  240    HB2  ASP  32           HB3      ASP  32  13.643   1.693  -1.290
  241    HB3  ASP  32           HB2      ASP  32  13.281   0.028  -1.752
  242    H    SER  33           H        SER  33  11.658   1.674  -5.375
  243    HA   SER  33           HA       SER  33  13.651   3.689  -6.064
  244    HB2  SER  33           HB3      SER  33  11.342   3.067  -7.863
  245    HB3  SER  33           HB2      SER  33  13.036   3.314  -8.268
  246    HG   SER  33           HG       SER  33  13.375   1.280  -7.064
  247    H    GLU  34           H        GLU  34  13.077   5.840  -6.927
  248    HA   GLU  34           HA       GLU  34  10.815   7.004  -5.413
  249    HB2  GLU  34           HB3      GLU  34  12.577   8.694  -7.123
  250    HB3  GLU  34           HB2      GLU  34  11.950   9.004  -5.504
  251    HG2  GLU  34           HG3      GLU  34  14.249   7.193  -6.276
  252    HG3  GLU  34           HG2      GLU  34  14.306   8.629  -5.254
  253    H    VAL  35           H        VAL  35   9.081   8.059  -6.411
  254    HA   VAL  35           HA       VAL  35   8.965   7.954  -9.400
  255    HB   VAL  35           HB       VAL  35   6.803   7.097  -7.453
  256   HG11  VAL  35          HG11      VAL  35   5.425   7.885  -9.080
  257   HG12  VAL  35          HG12      VAL  35   5.933   6.453  -9.975
  258   HG13  VAL  35          HG13      VAL  35   6.730   8.000 -10.259
  259   HG21  VAL  35          HG21      VAL  35   7.049   4.915  -8.520
  260   HG22  VAL  35          HG22      VAL  35   8.621   5.441  -7.917
  261   HG23  VAL  35          HG23      VAL  35   8.250   5.566  -9.636
  262    H    ALA  36           H        ALA  36   9.039  10.136  -9.829
  263    HA   ALA  36           HA       ALA  36   7.753  12.094  -8.106
  264    HB1  ALA  36           HB1      ALA  36   8.710  13.705  -9.495
  265    HB2  ALA  36           HB2      ALA  36   8.581  12.689 -10.930
  266    HB3  ALA  36           HB3      ALA  36   9.817  12.351  -9.718
  267    H    GLU  37           H        GLU  37   6.882  10.403 -11.081
  268    HA   GLU  37           HA       GLU  37   4.760  12.041 -11.963
  269    HB2  GLU  37           HB3      GLU  37   5.650   9.987 -13.136
  270    HB3  GLU  37           HB2      GLU  37   4.744   9.010 -11.981
  271    HG2  GLU  37           HG3      GLU  37   3.376   9.258 -13.956
  272    HG3  GLU  37           HG2      GLU  37   2.661  10.255 -12.687
  273    H    ALA  38           H        ALA  38   4.881   9.677  -9.353
  274    HA   ALA  38           HA       ALA  38   2.092  10.449  -8.586
  275    HB1  ALA  38           HB1      ALA  38   1.636   8.281  -8.061
  276    HB2  ALA  38           HB2      ALA  38   3.239   8.018  -7.374
  277    HB3  ALA  38           HB3      ALA  38   2.999   7.917  -9.118
  278    H    SER  39           H        SER  39   5.224  11.038  -7.885
  279    HA   SER  39           HA       SER  39   6.330  11.850  -5.992
  280    HB2  SER  39           HB3      SER  39   5.100  13.329  -4.665
  281    HB3  SER  39           HB2      SER  39   4.111  13.254  -6.120
  282    HG   SER  39           HG       SER  39   3.547  12.460  -3.591
  283    H    GLY  40           H        GLY  40   6.220   9.139  -5.997
  284    HA2  GLY  40           HA3      GLY  40   6.226   8.518  -3.146
  285    HA3  GLY  40           HA2      GLY  40   4.949   7.685  -4.030
  286    H    TYR  41           H        TYR  41   5.828   5.606  -3.862
  287    HA   TYR  41           HA       TYR  41   8.415   5.166  -5.292
  288    HB2  TYR  41           HB3      TYR  41   7.260   3.562  -2.995
  289    HB3  TYR  41           HB2      TYR  41   8.813   3.280  -3.787
  290    HD1  TYR  41           HD1      TYR  41   6.873   5.912  -1.949
  291    HD2  TYR  41           HD2      TYR  41  10.735   4.392  -3.046
  292    HE1  TYR  41           HE1      TYR  41   7.954   7.584  -0.473
  293    HE2  TYR  41           HE2      TYR  41  11.816   6.058  -1.560
  294    HH   TYR  41           HH       TYR  41  10.903   7.396   0.671
  295    H    ASP  42           H        ASP  42   8.520   3.255  -6.592
  296    HA   ASP  42           HA       ASP  42   6.172   2.668  -8.059
  297    HB2  ASP  42           HB3      ASP  42   8.440   2.324  -8.947
  298    HB3  ASP  42           HB2      ASP  42   8.687   1.000  -7.810
  299    H    LEU  43           H        LEU  43   5.020   0.710  -8.245
  300    HA   LEU  43           HA       LEU  43   4.895  -0.944  -5.741
  301    HB2  LEU  43           HB3      LEU  43   2.938   0.621  -5.879
  302    HB3  LEU  43           HB2      LEU  43   2.521  -0.097  -7.432
  303    HG   LEU  43           HG       LEU  43   2.253  -2.303  -6.350
  304   HD11  LEU  43          HD11      LEU  43   3.576  -2.461  -4.476
  305   HD12  LEU  43          HD12      LEU  43   2.069  -1.983  -3.695
  306   HD13  LEU  43          HD13      LEU  43   3.315  -0.777  -4.019
  307   HD21  LEU  43          HD21      LEU  43   0.277  -1.016  -6.536
  308   HD22  LEU  43          HD22      LEU  43   0.733   0.036  -5.200
  309   HD23  LEU  43          HD23      LEU  43   0.275  -1.640  -4.890
  310    H    GLY  44           H        GLY  44   6.191  -2.587  -6.838
  311    HA2  GLY  44           HA3      GLY  44   5.155  -3.736  -9.316
  312    HA3  GLY  44           HA2      GLY  44   6.527  -4.341  -8.387
  313    H    GLY  45           H        GLY  45   5.483  -6.464  -8.826
  314    HA2  GLY  45           HA3      GLY  45   4.551  -8.304  -7.584
  315    HA3  GLY  45           HA2      GLY  45   3.655  -7.154  -6.600
  316    H    ASP  46           H        ASP  46   1.620  -8.098  -6.920
  317    HA   ASP  46           HA       ASP  46   0.599  -8.170  -9.712
  318    HB2  ASP  46           HB3      ASP  46   0.327  -9.943  -7.450
  319    HB3  ASP  46           HB2      ASP  46  -1.261  -9.353  -7.939
  320    H    THR  47           H        THR  47   0.034  -6.010  -9.909
  321    HA   THR  47           HA       THR  47  -1.775  -4.816  -7.874
  322    HB   THR  47           HB       THR  47  -1.392  -2.727  -8.963
  323    HG1  THR  47           HG1      THR  47  -1.358  -4.232 -11.116
  324   HG21  THR  47          HG21      THR  47   0.603  -3.730  -7.785
  325   HG22  THR  47          HG22      THR  47   1.008  -2.533  -9.017
  326   HG23  THR  47          HG23      THR  47   1.191  -4.253  -9.364
  327    H    ALA  48           H        ALA  48  -1.773  -6.575 -10.720
  328    HA   ALA  48           HA       ALA  48  -4.281  -5.545 -11.838
  329    HB1  ALA  48           HB1      ALA  48  -2.546  -6.590 -13.274
  330    HB2  ALA  48           HB2      ALA  48  -4.094  -7.425 -13.410
  331    HB3  ALA  48           HB3      ALA  48  -2.797  -8.124 -12.441
  332    H    CYS  49           H        CYS  49  -4.108  -6.668  -9.008
  333    HA   CYS  49           HA       CYS  49  -6.476  -8.470  -9.252
  334    HB2  CYS  49           HB3      CYS  49  -5.617 -10.029  -7.689
  335    HB3  CYS  49           HB2      CYS  49  -4.254  -9.705  -8.761
  336    H    LEU  50           H        LEU  50  -5.677  -5.567  -8.414
  337    HA   LEU  50           HA       LEU  50  -6.961  -5.594  -5.713
  338    HB2  LEU  50           HB3      LEU  50  -5.315  -3.441  -7.069
  339    HB3  LEU  50           HB2      LEU  50  -5.998  -3.332  -5.452
  340    HG   LEU  50           HG       LEU  50  -4.132  -5.562  -6.271
  341   HD11  LEU  50          HD11      LEU  50  -2.304  -4.294  -5.268
  342   HD12  LEU  50          HD12      LEU  50  -3.400  -2.965  -4.890
  343   HD13  LEU  50          HD13      LEU  50  -3.026  -3.352  -6.567
  344   HD21  LEU  50          HD21      LEU  50  -3.715  -5.461  -3.724
  345   HD22  LEU  50          HD22      LEU  50  -5.245  -6.140  -4.266
  346   HD23  LEU  50          HD23      LEU  50  -5.182  -4.491  -3.646
  347    H    THR  51           H        THR  51  -7.674  -5.105  -8.933
  348    HA   THR  51           HA       THR  51  -9.306  -2.751  -8.845
  349    HB   THR  51           HB       THR  51 -10.197  -3.480 -10.934
  350    HG1  THR  51           HG1      THR  51 -10.649  -5.495 -11.291
  351   HG21  THR  51          HG21      THR  51  -8.247  -3.939 -12.180
  352   HG22  THR  51          HG22      THR  51  -7.534  -4.887 -10.876
  353   HG23  THR  51          HG23      THR  51  -7.644  -3.134 -10.732
  354    H    ARG  52           H        ARG  52  -9.588  -5.445  -7.029
  355    HA   ARG  52           HA       ARG  52 -12.559  -5.559  -7.098
  356    HB2  ARG  52           HB3      ARG  52 -12.358  -7.550  -5.741
  357    HB3  ARG  52           HB2      ARG  52 -11.191  -7.686  -7.057
  358    HG2  ARG  52           HG3      ARG  52  -9.508  -6.606  -5.420
  359    HG3  ARG  52           HG2      ARG  52 -10.677  -7.014  -4.164
  360    HD2  ARG  52           HD3      ARG  52  -9.406  -8.965  -6.106
  361    HD3  ARG  52           HD2      ARG  52  -9.022  -8.814  -4.392
  362    HE   ARG  52           HE       ARG  52 -11.798  -9.275  -4.553
  363   HH11  ARG  52          HH22      ARG  52  -8.818 -10.796  -5.389
  364   HH12  ARG  52          HH21      ARG  52  -9.432 -12.404  -5.200
  365   HH21  ARG  52          HH11      ARG  52 -12.615 -11.365  -4.299
  366   HH22  ARG  52          HH12      ARG  52 -11.582 -12.727  -4.582
  367    H    TRP  53           H        TRP  53  -9.899  -4.283  -5.292
  368    HA   TRP  53           HA       TRP  53 -11.764  -3.488  -3.082
  369    HB2  TRP  53           HB3      TRP  53  -8.741  -3.764  -3.027
  370    HB3  TRP  53           HB2      TRP  53  -9.751  -3.273  -1.667
  371    HD1  TRP  53           HD1      TRP  53 -12.037  -5.286  -1.654
  372    HE1  TRP  53           HE1      TRP  53 -11.649  -7.800  -1.262
  373    HE3  TRP  53           HE3      TRP  53  -7.096  -5.631  -2.920
  374    HZ2  TRP  53           HZ2      TRP  53  -9.530  -9.708  -1.450
  375    HZ3  TRP  53           HZ3      TRP  53  -5.921  -7.814  -2.797
  376    HH2  TRP  53           HH2      TRP  53  -7.129  -9.848  -2.068
  377    H    LEU  54           H        LEU  54  -9.265  -2.426  -5.335
  378    HA   LEU  54           HA       LEU  54  -9.749   0.404  -4.533
  379    HB2  LEU  54           HB3      LEU  54  -7.590  -0.792  -6.297
  380    HB3  LEU  54           HB2      LEU  54  -7.674   0.883  -5.774
  381    HG   LEU  54           HG       LEU  54  -7.390  -1.511  -3.937
  382   HD11  LEU  54          HD11      LEU  54  -5.217   0.134  -3.579
  383   HD12  LEU  54          HD12      LEU  54  -5.488   0.249  -5.315
  384   HD13  LEU  54          HD13      LEU  54  -5.220  -1.324  -4.567
  385   HD21  LEU  54          HD21      LEU  54  -7.806   1.423  -3.497
  386   HD22  LEU  54          HD22      LEU  54  -6.787   0.526  -2.370
  387   HD23  LEU  54          HD23      LEU  54  -8.470   0.055  -2.601
  388    HA   PRO  55           HA       PRO  55 -11.941   0.887  -8.387
  389    HB2  PRO  55           HB2      PRO  55 -11.722   3.541  -8.883
  390    HB3  PRO  55           HB3      PRO  55 -12.686   2.903  -7.539
  391    HG2  PRO  55           HG3      PRO  55 -10.028   4.198  -7.510
  392    HG3  PRO  55           HG2      PRO  55 -11.319   4.232  -6.300
  393    HD2  PRO  55           HD3      PRO  55  -9.015   2.642  -6.196
  394    HD3  PRO  55           HD2      PRO  55 -10.464   2.432  -5.201
  395    H    SER  56           H        SER  56  -8.587   1.339  -8.291
  396    HA   SER  56           HA       SER  56  -8.411   1.003 -11.211
  397    HB2  SER  56           HB3      SER  56  -7.788   3.111 -11.699
  398    HB3  SER  56           HB2      SER  56  -8.093   3.572 -10.027
  399    HG   SER  56           HG       SER  56  -5.899   3.917 -10.800
  400    H    GLU  57           H        GLU  57  -6.191   0.377 -11.856
  401    HA   GLU  57           HA       GLU  57  -4.975  -1.328  -9.864
  402    HB2  GLU  57           HB3      GLU  57  -4.964  -2.015 -12.189
  403    HB3  GLU  57           HB2      GLU  57  -4.093  -0.557 -12.655
  404    HG2  GLU  57           HG3      GLU  57  -2.124  -1.247 -11.483
  405    HG3  GLU  57           HG2      GLU  57  -2.989  -2.552 -10.672
  406    HA   PRO  58           HA       PRO  58  -2.381   2.145  -8.458
  407    HB2  PRO  58           HB2      PRO  58  -1.122   0.829  -6.409
  408    HB3  PRO  58           HB3      PRO  58  -2.714   1.575  -6.270
  409    HG2  PRO  58           HG3      PRO  58  -1.986  -1.263  -6.537
  410    HG3  PRO  58           HG2      PRO  58  -3.370  -0.520  -5.750
  411    HD2  PRO  58           HD3      PRO  58  -3.419  -1.782  -8.233
  412    HD3  PRO  58           HD2      PRO  58  -4.657  -0.658  -7.635
  413    H    ARG  59           H        ARG  59  -0.580   2.657  -9.553
  414    HA   ARG  59           HA       ARG  59   1.441   0.542 -10.114
  415    HB2  ARG  59           HB3      ARG  59   0.461   2.914 -11.524
  416    HB3  ARG  59           HB2      ARG  59   2.223   2.837 -11.457
  417    HG2  ARG  59           HG3      ARG  59   2.164   0.538 -12.347
  418    HG3  ARG  59           HG2      ARG  59   0.403   0.609 -12.413
  419    HD2  ARG  59           HD3      ARG  59   0.998   2.856 -13.799
  420    HD3  ARG  59           HD2      ARG  59   2.414   1.881 -14.188
  421    HE   ARG  59           HE       ARG  59   1.024   0.497 -15.494
  422   HH11  ARG  59          HH22      ARG  59  -0.778   2.413 -13.264
  423   HH12  ARG  59          HH21      ARG  59  -2.319   1.934 -13.893
  424   HH21  ARG  59          HH11      ARG  59  -0.978  -0.141 -16.327
  425   HH22  ARG  59          HH12      ARG  59  -2.432   0.489 -15.628
  426    H    ALA  60           H        ALA  60   0.811   2.958  -7.901
  427    HA   ALA  60           HA       ALA  60   3.593   2.925  -6.967
  428    HB1  ALA  60           HB1      ALA  60   2.306   5.603  -7.546
  429    HB2  ALA  60           HB2      ALA  60   3.409   4.815  -8.676
  430    HB3  ALA  60           HB3      ALA  60   3.975   5.284  -7.071
  431    H    TRP  61           H        TRP  61   3.756   4.168  -4.860
  432    HA   TRP  61           HA       TRP  61   1.179   4.563  -3.453
  433    HB2  TRP  61           HB3      TRP  61   1.925   3.117  -1.567
  434    HB3  TRP  61           HB2      TRP  61   1.681   2.198  -3.046
  435    HD1  TRP  61           HD1      TRP  61   4.156   2.129  -4.588
  436    HE1  TRP  61           HE1      TRP  61   6.453   1.413  -3.677
  437    HE3  TRP  61           HE3      TRP  61   3.362   2.788   0.409
  438    HZ2  TRP  61           HZ2      TRP  61   7.779   1.141  -1.157
  439    HZ3  TRP  61           HZ3      TRP  61   5.154   2.282   2.043
  440    HH2  TRP  61           HH2      TRP  61   7.360   1.460   1.268
  441    H    ARG  62           H        ARG  62   1.496   5.833  -1.471
  442    HA   ARG  62           HA       ARG  62   4.196   7.107  -1.263
  443    HB2  ARG  62           HB3      ARG  62   2.955   8.712  -2.453
  444    HB3  ARG  62           HB2      ARG  62   1.497   8.406  -1.511
  445    HG2  ARG  62           HG3      ARG  62   2.291   9.576   0.351
  446    HG3  ARG  62           HG2      ARG  62   3.978   9.392  -0.132
  447    HD2  ARG  62           HD3      ARG  62   3.903  11.174  -1.576
  448    HD3  ARG  62           HD2      ARG  62   2.215  10.890  -2.002
  449    HE   ARG  62           HE       ARG  62   1.570  12.280  -0.191
  450   HH11  ARG  62          HH22      ARG  62   4.903  11.397  -0.079
  451   HH12  ARG  62          HH21      ARG  62   5.289  12.503   1.197
  452   HH21  ARG  62          HH11      ARG  62   2.056  13.727   1.473
  453   HH22  ARG  62          HH12      ARG  62   3.677  13.824   2.075
  454    HA   PRO  63           HA       PRO  63   3.159   5.712   3.002
  455    HB2  PRO  63           HB2      PRO  63   5.792   6.895   3.617
  456    HB3  PRO  63           HB3      PRO  63   5.198   5.255   3.919
  457    HG2  PRO  63           HG3      PRO  63   7.021   5.877   2.010
  458    HG3  PRO  63           HG2      PRO  63   5.935   4.486   1.929
  459    HD2  PRO  63           HD3      PRO  63   5.855   7.010   0.388
  460    HD3  PRO  63           HD2      PRO  63   5.181   5.416  -0.014
  461    H    THR  64           H        THR  64   1.851   7.057   4.206
  462    HA   THR  64           HA       THR  64   2.498   9.961   4.283
  463    HB   THR  64           HB       THR  64   0.098   9.715   5.570
  464    HG1  THR  64           HG1      THR  64   0.491   7.516   3.878
  465   HG21  THR  64          HG21      THR  64   0.551   9.838   2.575
  466   HG22  THR  64          HG22      THR  64   0.604  11.211   3.679
  467   HG23  THR  64          HG23      THR  64  -0.913  10.355   3.411
  468    HA   PRO  65           HA       PRO  65   3.869   9.703   8.478
  469    HB2  PRO  65           HB2      PRO  65   2.855  12.016   9.564
  470    HB3  PRO  65           HB3      PRO  65   4.265  11.964   8.489
  471    HG2  PRO  65           HG3      PRO  65   1.449  12.696   7.886
  472    HG3  PRO  65           HG2      PRO  65   2.958  13.383   7.260
  473    HD2  PRO  65           HD3      PRO  65   1.412  11.629   5.833
  474    HD3  PRO  65           HD2      PRO  65   3.170  11.771   5.619
  475    H    ALA  66           H        ALA  66   1.083   8.607   7.802
  476    HA   ALA  66           HA       ALA  66   0.304   8.038  10.543
  477    HB1  ALA  66           HB1      ALA  66  -2.058   9.130   9.234
  478    HB2  ALA  66           HB2      ALA  66  -0.806  10.355   9.432
  479    HB3  ALA  66           HB3      ALA  66  -1.411   9.478  10.837
  480    H    GLY  67           H        GLY  67   0.940   6.797   7.833
  481    HA2  GLY  67           HA3      GLY  67  -0.224   4.399   7.842
  482    HA3  GLY  67           HA2      GLY  67  -1.584   5.354   7.262
  483    H    ILE  68           H        ILE  68  -0.831   3.507   5.508
  484    HA   ILE  68           HA       ILE  68   1.134   4.738   3.641
  485    HB   ILE  68           HB       ILE  68  -0.175   2.002   3.643
  486   HG12  ILE  68          HG13      ILE  68   2.716   2.724   4.177
  487   HG13  ILE  68          HG12      ILE  68   1.527   2.563   5.471
  488   HG21  ILE  68          HG21      ILE  68   0.373   2.189   1.427
  489   HG22  ILE  68          HG22      ILE  68   1.978   1.779   2.030
  490   HG23  ILE  68          HG23      ILE  68   1.556   3.463   1.722
  491   HD11  ILE  68          HD11      ILE  68   1.577   0.333   3.526
  492   HD12  ILE  68          HD12      ILE  68   1.436   0.292   5.284
  493   HD13  ILE  68          HD13      ILE  68   3.019   0.488   4.529
  494    H    ALA  69           H        ALA  69   0.530   5.270   1.501
  495    HA   ALA  69           HA       ALA  69  -2.415   5.241   0.939
  496    HB1  ALA  69           HB1      ALA  69  -1.064   7.330  -0.498
  497    HB2  ALA  69           HB2      ALA  69  -0.682   7.471   1.219
  498    HB3  ALA  69           HB3      ALA  69  -2.364   7.473   0.687
  499    H    LEU  70           H        LEU  70  -3.023   4.637  -1.134
  500    HA   LEU  70           HA       LEU  70  -0.831   3.602  -2.882
  501    HB2  LEU  70           HB3      LEU  70  -3.758   2.901  -2.707
  502    HB3  LEU  70           HB2      LEU  70  -2.654   2.218  -3.890
  503    HG   LEU  70           HG       LEU  70  -1.486   2.024  -1.263
  504   HD11  LEU  70          HD11      LEU  70  -4.286   0.906  -1.583
  505   HD12  LEU  70          HD12      LEU  70  -3.731   2.050  -0.360
  506   HD13  LEU  70          HD13      LEU  70  -3.155   0.383  -0.336
  507   HD21  LEU  70          HD21      LEU  70  -0.952   0.643  -3.266
  508   HD22  LEU  70          HD22      LEU  70  -2.550  -0.095  -3.161
  509   HD23  LEU  70          HD23      LEU  70  -1.375  -0.351  -1.871
  510    H    LEU  71           H        LEU  71  -0.514   4.595  -4.841
  511    HA   LEU  71           HA       LEU  71  -2.561   6.590  -5.732
  512    HB2  LEU  71           HB3      LEU  71   0.409   6.434  -6.326
  513    HB3  LEU  71           HB2      LEU  71  -0.683   7.683  -6.920
  514    HG   LEU  71           HG       LEU  71  -0.518   7.143  -3.966
  515   HD11  LEU  71          HD11      LEU  71   1.564   8.378  -5.706
  516   HD12  LEU  71          HD12      LEU  71   1.740   7.516  -4.178
  517   HD13  LEU  71          HD13      LEU  71   1.199   9.194  -4.187
  518   HD21  LEU  71          HD21      LEU  71  -2.055   8.843  -5.450
  519   HD22  LEU  71          HD22      LEU  71  -0.671   9.877  -5.105
  520   HD23  LEU  71          HD23      LEU  71  -1.584   9.158  -3.780
  521    H    GLU  72           H        GLU  72  -2.376   6.922  -8.240
  522    HA   GLU  72           HA       GLU  72  -2.228   4.228  -9.550
  523    HB2  GLU  72           HB3      GLU  72  -3.988   5.390 -11.136
  524    HB3  GLU  72           HB2      GLU  72  -4.510   4.674  -9.613
  525    HG2  GLU  72           HG3      GLU  72  -4.473   6.830  -8.510
  526    HG3  GLU  72           HG2      GLU  72  -3.756   7.590  -9.931
  527    H    ARG  73           H        ARG  73  -0.207   6.484  -9.331
  528    HA   ARG  73           HA       ARG  73   1.475   7.235 -10.794
  529    HB2  ARG  73           HB3      ARG  73   0.453   5.155 -12.204
  530    HB3  ARG  73           HB2      ARG  73   0.014   6.491 -13.268
  531    HG2  ARG  73           HG3      ARG  73   2.360   7.266 -13.260
  532    HG3  ARG  73           HG2      ARG  73   2.799   5.921 -12.207
  533    HD2  ARG  73           HD3      ARG  73   2.843   4.455 -13.928
  534    HD3  ARG  73           HD2      ARG  73   1.320   5.055 -14.581
  535    HE   ARG  73           HE       ARG  73   3.965   5.829 -15.475
  536   HH11  ARG  73          HH22      ARG  73   0.716   6.865 -14.955
  537   HH12  ARG  73          HH21      ARG  73   0.772   8.092 -16.176
  538   HH21  ARG  73          HH11      ARG  73   4.056   7.427 -17.071
  539   HH22  ARG  73          HH12      ARG  73   2.663   8.410 -17.374
  540    H    GLY  74           H        GLY  74  -0.945   8.755  -9.987
  541    HA2  GLY  74           HA3      GLY  74  -0.647  10.921 -11.972
  542    HA3  GLY  74           HA2      GLY  74  -2.283  10.305 -11.737
  543    H    GLY  75           H        GLY  75  -0.888   9.866  -8.824
  544    HA2  GLY  75           HA3      GLY  75  -0.543  11.324  -6.934
  545    HA3  GLY  75           HA2      GLY  75  -1.229  12.654  -7.866
  546    H    LEU  76           H        LEU  76  -3.306  10.295  -8.556
  547    HA   LEU  76           HA       LEU  76  -5.281  11.254  -6.629
  548    HB2  LEU  76           HB3      LEU  76  -5.296   9.394  -8.982
  549    HB3  LEU  76           HB2      LEU  76  -6.634   9.329  -7.835
  550    HG   LEU  76           HG       LEU  76  -7.046  11.726  -8.139
  551   HD11  LEU  76          HD11      LEU  76  -4.919  12.659  -8.562
  552   HD12  LEU  76          HD12      LEU  76  -5.746  12.798 -10.113
  553   HD13  LEU  76          HD13      LEU  76  -4.573  11.507  -9.851
  554   HD21  LEU  76          HD21      LEU  76  -8.234  11.407 -10.064
  555   HD22  LEU  76          HD22      LEU  76  -7.650   9.749  -9.922
  556   HD23  LEU  76          HD23      LEU  76  -6.811  10.893 -10.970
  557    H    THR  77           H        THR  77  -4.893  10.506  -4.559
  558    HA   THR  77           HA       THR  77  -3.810   7.960  -3.887
  559    HB   THR  77           HB       THR  77  -5.771   9.089  -1.985
  560    HG1  THR  77           HG1      THR  77  -3.888  10.752  -1.713
  561   HG21  THR  77          HG21      THR  77  -2.789   8.693  -1.708
  562   HG22  THR  77          HG22      THR  77  -3.936   7.362  -1.556
  563   HG23  THR  77          HG23      THR  77  -4.005   8.719  -0.430
  564    H    LEU  78           H        LEU  78  -4.710   5.980  -4.078
  565    HA   LEU  78           HA       LEU  78  -7.564   5.742  -4.762
  566    HB2  LEU  78           HB3      LEU  78  -5.516   3.545  -4.375
  567    HB3  LEU  78           HB2      LEU  78  -7.067   3.406  -5.191
  568    HG   LEU  78           HG       LEU  78  -4.814   5.232  -6.082
  569   HD11  LEU  78          HD11      LEU  78  -4.995   2.451  -6.360
  570   HD12  LEU  78          HD12      LEU  78  -3.978   3.534  -7.310
  571   HD13  LEU  78          HD13      LEU  78  -5.578   3.087  -7.898
  572   HD21  LEU  78          HD21      LEU  78  -6.341   5.100  -8.222
  573   HD22  LEU  78          HD22      LEU  78  -6.772   6.203  -6.917
  574   HD23  LEU  78          HD23      LEU  78  -7.597   4.652  -7.072
  575    H    MET  79           H        MET  79  -5.410   4.802  -2.082
  576    HA   MET  79           HA       MET  79  -7.741   4.702  -0.302
  577    HB2  MET  79           HB3      MET  79  -7.634   2.447  -1.408
  578    HB3  MET  79           HB2      MET  79  -6.058   2.205  -0.665
  579    HG2  MET  79           HG3      MET  79  -7.635   1.177   0.811
  580    HG3  MET  79           HG2      MET  79  -7.198   2.705   1.574
  581    HE1  MET  79           HE1      MET  79  -9.642   0.586  -0.278
  582    HE2  MET  79           HE2      MET  79 -11.203   1.204   0.280
  583    HE3  MET  79           HE3      MET  79 -10.040   0.562   1.438
  584    H    LEU  80           H        LEU  80  -7.164   4.971   1.841
  585    HA   LEU  80           HA       LEU  80  -4.264   5.462   2.359
  586    HB2  LEU  80           HB3      LEU  80  -5.670   7.418   2.730
  587    HB3  LEU  80           HB2      LEU  80  -6.767   6.483   3.741
  588    HG   LEU  80           HG       LEU  80  -5.026   6.170   5.422
  589   HD11  LEU  80          HD11      LEU  80  -2.994   5.981   4.283
  590   HD12  LEU  80          HD12      LEU  80  -2.865   7.596   4.979
  591   HD13  LEU  80          HD13      LEU  80  -3.308   7.400   3.283
  592   HD21  LEU  80          HD21      LEU  80  -4.496   8.997   5.089
  593   HD22  LEU  80          HD22      LEU  80  -5.520   8.194   6.279
  594   HD23  LEU  80          HD23      LEU  80  -6.179   8.639   4.705
  595    H    LEU  81           H        LEU  81  -3.460   3.529   3.125
  596    HA   LEU  81           HA       LEU  81  -5.061   1.826   4.896
  597    HB2  LEU  81           HB3      LEU  81  -2.488   1.637   3.464
  598    HB3  LEU  81           HB2      LEU  81  -2.491   0.858   5.043
  599    HG   LEU  81           HG       LEU  81  -4.516  -0.406   4.427
  600   HD11  LEU  81          HD11      LEU  81  -4.332   1.383   2.043
  601   HD12  LEU  81          HD12      LEU  81  -5.757   0.796   2.902
  602   HD13  LEU  81          HD13      LEU  81  -4.904  -0.264   1.781
  603   HD21  LEU  81          HD21      LEU  81  -2.085  -0.529   2.651
  604   HD22  LEU  81          HD22      LEU  81  -3.426  -1.646   2.400
  605   HD23  LEU  81          HD23      LEU  81  -2.569  -1.630   3.942
  606    H    GLY  82           H        GLY  82  -5.282   2.377   7.024
  607    HA2  GLY  82           HA3      GLY  82  -3.325   4.178   8.274
  608    HA3  GLY  82           HA2      GLY  82  -4.824   3.611   9.002
  609    H    ARG  83           H        ARG  83  -1.787   3.573   9.726
  610    HA   ARG  83           HA       ARG  83  -1.103   0.782  10.008
  611    HB2  ARG  83           HB3      ARG  83   0.557   2.643  10.055
  612    HB3  ARG  83           HB2      ARG  83  -0.106   3.161  11.600
  613    HG2  ARG  83           HG3      ARG  83   0.401   0.374  11.822
  614    HG3  ARG  83           HG2      ARG  83   1.829   1.096  11.082
  615    HD2  ARG  83           HD3      ARG  83   2.084   1.184  13.497
  616    HD3  ARG  83           HD2      ARG  83   1.836   2.822  12.896
  617    HE   ARG  83           HE       ARG  83  -0.663   1.560  13.667
  618   HH11  ARG  83          HH22      ARG  83   2.180   3.187  14.744
  619   HH12  ARG  83          HH21      ARG  83   1.437   3.819  16.176
  620   HH21  ARG  83          HH11      ARG  83  -1.649   2.374  15.532
  621   HH22  ARG  83          HH12      ARG  83  -0.729   3.358  16.622
  622    H    GLN  84           H        GLN  84  -2.133  -0.613  11.340
  623    HA   GLN  84           HA       GLN  84  -3.606   0.448  13.683
  624    HB2  GLN  84           HB3      GLN  84  -4.952  -1.022  12.404
  625    HB3  GLN  84           HB2      GLN  84  -3.614  -2.134  12.122
  626    HG2  GLN  84           HG3      GLN  84  -5.368  -2.870  13.825
  627    HG3  GLN  84           HG2      GLN  84  -3.690  -2.955  14.351
  628   HE21  GLN  84          HE22      GLN  84  -5.899  -0.113  14.122
  629   HE22  GLN  84          HE21      GLN  84  -5.759   0.315  15.758
  630    H    GLY  85           H        GLY  85  -0.844  -1.450  12.743
  631    HA2  GLY  85           HA3      GLY  85   0.326  -1.299  15.382
  632    HA3  GLY  85           HA2      GLY  85  -0.238  -2.933  15.023
  633    H    GLU  86           H        GLU  86   2.447  -1.118  14.954
  634    HA   GLU  86           HA       GLU  86   3.911  -0.977  12.775
  635    HB2  GLU  86           HB3      GLU  86   5.056  -0.961  14.871
  636    HB3  GLU  86           HB2      GLU  86   4.662  -2.652  15.176
  637    HG2  GLU  86           HG3      GLU  86   6.252  -3.438  13.695
  638    HG3  GLU  86           HG2      GLU  86   6.176  -1.992  12.684
  639    H    GLY  87           H        GLY  87   3.349  -2.049  10.899
  640    HA2  GLY  87           HA3      GLY  87   3.871  -3.826   9.365
  641    HA3  GLY  87           HA2      GLY  87   4.133  -4.899  10.735
  642    H    ASP  88           H        ASP  88   1.318  -2.938  10.831
  643    HA   ASP  88           HA       ASP  88  -0.390  -4.989   9.587
  644    HB2  ASP  88           HB3      ASP  88   0.056  -4.911  12.430
  645    HB3  ASP  88           HB2      ASP  88  -1.613  -4.450  12.099
  646    H    TYR  89           H        TYR  89  -1.189  -3.451   8.184
  647    HA   TYR  89           HA       TYR  89  -2.472  -1.023   9.372
  648    HB2  TYR  89           HB3      TYR  89  -1.709  -1.472   6.474
  649    HB3  TYR  89           HB2      TYR  89  -2.242   0.018   7.197
  650    HD1  TYR  89           HD1      TYR  89   0.497  -2.557   7.801
  651    HD2  TYR  89           HD2      TYR  89  -0.609   1.608   7.616
  652    HE1  TYR  89           HE1      TYR  89   2.822  -1.906   8.290
  653    HE2  TYR  89           HE2      TYR  89   1.737   2.237   8.094
  654    HH   TYR  89           HH       TYR  89   4.105  -0.101   9.082
  655    H    ARG  90           H        ARG  90  -4.649  -0.681   8.933
  656    HA   ARG  90           HA       ARG  90  -6.014  -2.524   7.046
  657    HB2  ARG  90           HB3      ARG  90  -7.533  -2.078   9.527
  658    HB3  ARG  90           HB2      ARG  90  -7.313  -3.558   8.597
  659    HG2  ARG  90           HG3      ARG  90  -5.068  -3.849   9.579
  660    HG3  ARG  90           HG2      ARG  90  -5.284  -2.365  10.506
  661    HD2  ARG  90           HD3      ARG  90  -6.987  -4.862  10.726
  662    HD3  ARG  90           HD2      ARG  90  -5.811  -4.296  11.912
  663    HE   ARG  90           HE       ARG  90  -7.906  -2.346  11.286
  664   HH11  ARG  90          HH22      ARG  90  -6.854  -5.008  13.214
  665   HH12  ARG  90          HH21      ARG  90  -7.898  -4.629  14.540
  666   HH21  ARG  90          HH11      ARG  90  -9.278  -1.841  13.008
  667   HH22  ARG  90          HH12      ARG  90  -9.272  -2.838  14.425
  668    H    VAL  91           H        VAL  91  -8.121  -1.701   6.395
  669    HA   VAL  91           HA       VAL  91  -8.663   1.133   7.143
  670    HB   VAL  91           HB       VAL  91  -7.313   0.912   4.964
  671   HG11  VAL  91          HG11      VAL  91  -9.975   0.109   3.792
  672   HG12  VAL  91          HG12      VAL  91  -8.790  -1.106   4.271
  673   HG13  VAL  91          HG13      VAL  91  -8.383   0.081   3.031
  674   HG21  VAL  91          HG21      VAL  91  -8.298   3.001   5.209
  675   HG22  VAL  91          HG22      VAL  91  -9.926   2.333   5.337
  676   HG23  VAL  91          HG23      VAL  91  -9.132   2.430   3.765
  677    H    GLN  92           H        GLN  92 -10.782   1.358   7.656
  678    HA   GLN  92           HA       GLN  92 -12.645  -0.748   7.623
  679    HB2  GLN  92           HB3      GLN  92 -12.856   2.229   7.836
  680    HB3  GLN  92           HB2      GLN  92 -14.337   1.301   7.598
  681    HG2  GLN  92           HG3      GLN  92 -12.311   0.617   9.740
  682    HG3  GLN  92           HG2      GLN  92 -13.670   1.703  10.026
  683   HE21  GLN  92          HE22      GLN  92 -13.272  -0.958  11.270
  684   HE22  GLN  92          HE21      GLN  92 -14.603  -1.904  10.805
  685    H    LYS  93           H        LYS  93 -13.220  -1.818   5.795
  686    HA   LYS  93           HA       LYS  93 -13.744  -0.247   3.309
  687    HB2  LYS  93           HB3      LYS  93 -12.212  -2.462   3.596
  688    HB3  LYS  93           HB2      LYS  93 -13.769  -3.218   3.254
  689    HG2  LYS  93           HG3      LYS  93 -13.948  -1.559   1.291
  690    HG3  LYS  93           HG2      LYS  93 -12.228  -1.263   1.543
  691    HD2  LYS  93           HD3      LYS  93 -12.092  -2.999   0.026
  692    HD3  LYS  93           HD2      LYS  93 -12.136  -3.928   1.524
  693    HE2  LYS  93           HE3      LYS  93 -14.746  -3.796   1.184
  694    HE3  LYS  93           HE2      LYS  93 -14.313  -3.490  -0.498
  695    HZ1  LYS  93           HZ1      LYS  93 -14.288  -5.931   0.925
  696    HZ2  LYS  93           HZ2      LYS  93 -12.725  -5.589   0.361
  697    HZ3  LYS  93           HZ3      LYS  93 -14.024  -5.658  -0.731
  698    H    GLY  94           H        GLY  94 -15.294  -1.792   5.892
  699    HA2  GLY  94           HA3      GLY  94 -17.858  -1.183   5.590
  700    HA3  GLY  94           HA2      GLY  94 -17.738  -2.405   4.322
  701    H    ASP  95           H        ASP  95 -19.478  -2.941   6.351
  702    HA   ASP  95           HA       ASP  95 -18.366  -4.302   8.610
  703    HB2  ASP  95           HB3      ASP  95 -21.025  -4.502   7.185
  704    HB3  ASP  95           HB2      ASP  95 -20.649  -5.488   8.599
  705    H    GLY  96           H        GLY  96 -17.906  -5.019   5.455
  706    HA2  GLY  96           HA3      GLY  96 -17.292  -7.843   6.091
  707    HA3  GLY  96           HA2      GLY  96 -18.387  -7.553   4.739
  708    H    GLY  97           H        GLY  97 -15.206  -6.423   5.927
  709    HA2  GLY  97           HA3      GLY  97 -13.753  -7.208   3.647
  710    HA3  GLY  97           HA2      GLY  97 -14.298  -5.560   3.334
  711    H    GLN  98           H        GLN  98 -12.506  -7.563   5.653
  712    HA   GLN  98           HA       GLN  98 -11.169  -5.117   6.682
  713    HB2  GLN  98           HB3      GLN  98 -12.136  -7.158   8.110
  714    HB3  GLN  98           HB2      GLN  98 -10.550  -7.838   7.750
  715    HG2  GLN  98           HG3      GLN  98  -9.470  -5.795   8.608
  716    HG3  GLN  98           HG2      GLN  98 -11.058  -5.136   9.008
  717   HE21  GLN  98          HE22      GLN  98  -9.508  -8.366   9.505
  718   HE22  GLN  98          HE21      GLN  98  -9.884  -8.451  11.158
  719    H    LEU  99           H        LEU  99  -9.504  -4.535   5.445
  720    HA   LEU  99           HA       LEU  99  -7.878  -6.551   4.053
  721    HB2  LEU  99           HB3      LEU  99  -7.493  -3.553   4.228
  722    HB3  LEU  99           HB2      LEU  99  -6.757  -4.646   3.065
  723    HG   LEU  99           HG       LEU  99  -9.724  -4.142   3.348
  724   HD11  LEU  99          HD11      LEU  99  -7.584  -2.889   1.746
  725   HD12  LEU  99          HD12      LEU  99  -9.172  -2.262   2.190
  726   HD13  LEU  99          HD13      LEU  99  -9.010  -3.365   0.823
  727   HD21  LEU  99          HD21      LEU  99  -9.531  -5.344   0.992
  728   HD22  LEU  99          HD22      LEU  99  -9.625  -6.293   2.475
  729   HD23  LEU  99          HD23      LEU  99  -8.064  -6.017   1.700
  730    H    VAL 100           H        VAL 100  -5.714  -7.011   4.588
  731    HA   VAL 100           HA       VAL 100  -4.612  -5.703   7.028
  732    HB   VAL 100           HB       VAL 100  -4.730  -8.702   6.605
  733   HG11  VAL 100          HG11      VAL 100  -3.600  -6.926   8.778
  734   HG12  VAL 100          HG12      VAL 100  -2.758  -8.157   7.838
  735   HG13  VAL 100          HG13      VAL 100  -3.954  -8.634   9.042
  736   HG21  VAL 100          HG21      VAL 100  -6.267  -8.643   8.568
  737   HG22  VAL 100          HG22      VAL 100  -6.938  -7.804   7.170
  738   HG23  VAL 100          HG23      VAL 100  -6.245  -6.882   8.504
  739    H    LEU 101           H        LEU 101  -2.812  -4.771   6.103
  740    HA   LEU 101           HA       LEU 101  -1.200  -6.321   4.143
  741    HB2  LEU 101           HB3      LEU 101  -1.689  -3.841   3.826
  742    HB3  LEU 101           HB2      LEU 101  -0.705  -3.557   5.248
  743    HG   LEU 101           HG       LEU 101   0.771  -5.266   3.508
  744   HD11  LEU 101          HD11      LEU 101   1.026  -3.655   1.603
  745   HD12  LEU 101          HD12      LEU 101  -0.350  -2.751   2.237
  746   HD13  LEU 101          HD13      LEU 101  -0.569  -4.404   1.667
  747   HD21  LEU 101          HD21      LEU 101   1.632  -3.675   5.238
  748   HD22  LEU 101          HD22      LEU 101   1.147  -2.336   4.198
  749   HD23  LEU 101          HD23      LEU 101   2.401  -3.457   3.667
  750    H    ARG 102           H        ARG 102   0.461  -7.621   4.967
  751    HA   ARG 102           HA       ARG 102   1.998  -6.572   7.265
  752    HB2  ARG 102           HB3      ARG 102   0.140  -8.064   8.135
  753    HB3  ARG 102           HB2      ARG 102   0.883  -9.390   7.241
  754    HG2  ARG 102           HG3      ARG 102   3.030  -8.283   8.592
  755    HG3  ARG 102           HG2      ARG 102   1.718  -8.149   9.761
  756    HD2  ARG 102           HD3      ARG 102   1.186 -10.591   9.247
  757    HD3  ARG 102           HD2      ARG 102   2.726 -10.649   8.391
  758    HE   ARG 102           HE       ARG 102   2.379 -10.569  11.287
  759   HH11  ARG 102          HH22      ARG 102   4.385  -9.830   8.581
  760   HH12  ARG 102          HH21      ARG 102   5.858  -9.875   9.494
  761   HH21  ARG 102          HH11      ARG 102   4.290 -10.628  12.492
  762   HH22  ARG 102          HH12      ARG 102   5.804 -10.325  11.706
  763    H    ARG 103           H        ARG 103   4.130  -7.128   7.112
  764    HA   ARG 103           HA       ARG 103   5.363  -7.863   4.750
  765    HB2  ARG 103           HB3      ARG 103   6.852  -9.093   6.881
  766    HB3  ARG 103           HB2      ARG 103   7.209  -7.602   6.009
  767    HG2  ARG 103           HG3      ARG 103   5.700  -6.355   7.511
  768    HG3  ARG 103           HG2      ARG 103   5.339  -7.844   8.386
  769    HD2  ARG 103           HD3      ARG 103   8.218  -7.297   8.098
  770    HD3  ARG 103           HD2      ARG 103   7.351  -6.093   9.050
  771    HE   ARG 103           HE       ARG 103   7.811  -8.882   9.812
  772   HH11  ARG 103          HH22      ARG 103   5.904  -6.029  10.150
  773   HH12  ARG 103          HH21      ARG 103   5.329  -6.441  11.731
  774   HH21  ARG 103          HH11      ARG 103   7.071  -9.436  11.874
  775   HH22  ARG 103          HH12      ARG 103   5.991  -8.369  12.708
  776    H    ALA 104           H        ALA 104   5.412  -9.716   3.546
  777    HA   ALA 104           HA       ALA 104   3.904 -11.982   4.078
  778    HB1  ALA 104           HB1      ALA 104   4.636 -12.421   1.995
  779    HB2  ALA 104           HB2      ALA 104   6.166 -12.951   2.694
  780    HB3  ALA 104           HB3      ALA 104   5.961 -11.272   2.186
  781    H    THR 105           H        THR 105   7.027 -11.177   5.297
  782    HA   THR 105           HA       THR 105   7.385 -13.857   6.484
  783    HB   THR 105           HB       THR 105   9.558 -13.316   6.239
  784    HG1  THR 105           HG1      THR 105  10.258 -12.443   7.999
  785   HG21  THR 105          HG21      THR 105   8.626 -10.477   5.723
  786   HG22  THR 105          HG22      THR 105   8.849 -11.726   4.497
  787   HG23  THR 105          HG23      THR 105  10.239 -11.103   5.386
  788    HA   PRO 106           HA       PRO 106   5.807 -12.802  10.460
  789    HB2  PRO 106           HB2      PRO 106   7.625 -13.951  12.166
  790    HB3  PRO 106           HB3      PRO 106   6.429 -14.874  11.237
  791    HG2  PRO 106           HG3      PRO 106   9.322 -14.451  10.706
  792    HG3  PRO 106           HG2      PRO 106   8.326 -15.895  10.461
  793    HD2  PRO 106           HD3      PRO 106   9.058 -14.221   8.418
  794    HD3  PRO 106           HD2      PRO 106   7.567 -15.187   8.399
  Start of MODEL   20
    1    H1   SER   1           H        SER   1  22.180  21.699   5.039
    2    H2   SER   1           H2       SER   1  23.870  21.829   5.153
    3    H3   SER   1           1HT      SER   1  23.097  22.059   3.659
    4    HA   SER   1           HA       SER   1  24.232  19.846   3.981
    5    HB2  SER   1           HB3      SER   1  21.864  19.572   5.852
    6    HB3  SER   1           HB2      SER   1  22.806  18.209   5.253
    7    HG   SER   1           HG       SER   1  23.326  19.694   7.333
    8    H    SER   2           H        SER   2  22.069  21.588   2.555
    9    HA   SER   2           HA       SER   2  20.714  21.262   0.664
   10    HB2  SER   2           HB3      SER   2  21.396  19.591  -0.718
   11    HB3  SER   2           HB2      SER   2  22.616  19.279   0.514
   12    HG   SER   2           HG       SER   2  20.309  17.889  -0.127
   13    H    LEU   3           H        LEU   3  18.598  20.351   0.128
   14    HA   LEU   3           HA       LEU   3  17.181  19.426   2.557
   15    HB2  LEU   3           HB3      LEU   3  15.965  20.089  -0.133
   16    HB3  LEU   3           HB2      LEU   3  15.167  20.065   1.440
   17    HG   LEU   3           HG       LEU   3  17.231  21.840   1.865
   18   HD11  LEU   3          HD11      LEU   3  17.341  23.340  -0.014
   19   HD12  LEU   3          HD12      LEU   3  16.090  22.445  -0.874
   20   HD13  LEU   3          HD13      LEU   3  17.678  21.720  -0.628
   21   HD21  LEU   3          HD21      LEU   3  15.431  23.576   1.666
   22   HD22  LEU   3          HD22      LEU   3  14.927  22.162   2.593
   23   HD23  LEU   3          HD23      LEU   3  14.393  22.358   0.924
   24    H    ILE   4           H        ILE   4  15.094  18.270   0.614
   25    HA   ILE   4           HA       ILE   4  14.521  16.090  -0.046
   26    HB   ILE   4           HB       ILE   4  17.377  16.134  -1.068
   27   HG12  ILE   4          HG13      ILE   4  15.426  16.556  -3.105
   28   HG13  ILE   4          HG12      ILE   4  15.072  17.681  -1.792
   29   HG21  ILE   4          HG21      ILE   4  15.288  14.141  -1.119
   30   HG22  ILE   4          HG22      ILE   4  16.930  14.038  -1.755
   31   HG23  ILE   4          HG23      ILE   4  15.634  14.687  -2.760
   32   HD11  ILE   4          HD11      ILE   4  16.657  18.719  -3.329
   33   HD12  ILE   4          HD12      ILE   4  17.741  17.334  -3.190
   34   HD13  ILE   4          HD13      ILE   4  17.466  18.383  -1.799
   35    H    LEU   5           H        LEU   5  15.429  16.331   2.649
   36    HA   LEU   5           HA       LEU   5  17.221  14.011   3.079
   37    HB2  LEU   5           HB3      LEU   5  15.939  15.940   5.040
   38    HB3  LEU   5           HB2      LEU   5  17.088  14.674   5.468
   39    HG   LEU   5           HG       LEU   5  17.878  16.572   3.303
   40   HD11  LEU   5          HD11      LEU   5  17.860  17.259   6.258
   41   HD12  LEU   5          HD12      LEU   5  16.963  18.090   4.988
   42   HD13  LEU   5          HD13      LEU   5  18.725  18.170   5.022
   43   HD21  LEU   5          HD21      LEU   5  19.256  14.610   4.109
   44   HD22  LEU   5          HD22      LEU   5  19.399  15.428   5.665
   45   HD23  LEU   5          HD23      LEU   5  20.080  16.165   4.214
   46    H    LEU   6           H        LEU   6  14.209  14.068   2.187
   47    HA   LEU   6           HA       LEU   6  12.995  12.487   4.364
   48    HB2  LEU   6           HB3      LEU   6  11.776  14.216   2.855
   49    HB3  LEU   6           HB2      LEU   6  11.778  12.935   1.642
   50    HG   LEU   6           HG       LEU   6  10.876  11.496   3.703
   51   HD11  LEU   6          HD11      LEU   6   9.587  14.153   4.285
   52   HD12  LEU   6          HD12      LEU   6  11.085  13.701   5.096
   53   HD13  LEU   6          HD13      LEU   6   9.643  12.706   5.290
   54   HD21  LEU   6          HD21      LEU   6   9.695  11.767   1.584
   55   HD22  LEU   6          HD22      LEU   6   9.230  13.412   2.020
   56   HD23  LEU   6          HD23      LEU   6   8.565  12.041   2.910
   57    H    SER   7           H        SER   7  14.212  10.552   4.364
   58    HA   SER   7           HA       SER   7  14.458   9.042   1.833
   59    HB2  SER   7           HB3      SER   7  16.406   8.651   2.985
   60    HB3  SER   7           HB2      SER   7  15.646   8.885   4.556
   61    HG   SER   7           HG       SER   7  14.914   6.836   4.515
   62    H    ALA   8           H        ALA   8  12.336   8.370   1.366
   63    HA   ALA   8           HA       ALA   8  10.806   6.954   3.463
   64    HB1  ALA   8           HB1      ALA   8   8.964   7.441   2.224
   65    HB2  ALA   8           HB2      ALA   8   9.741   6.961   0.715
   66    HB3  ALA   8           HB3      ALA   8  10.027   8.569   1.381
   67    H    SER   9           H        SER   9  13.307   5.793   2.427
   68    HA   SER   9           HA       SER   9  12.366   3.508   0.792
   69    HB2  SER   9           HB3      SER   9  15.162   3.739   1.847
   70    HB3  SER   9           HB2      SER   9  14.601   3.082   0.313
   71    HG   SER   9           HG       SER   9  15.618   5.375   0.578
   72    H    ASP  10           H        ASP  10  12.757   4.329   4.062
   73    HA   ASP  10           HA       ASP  10  13.558   1.755   5.099
   74    HB2  ASP  10           HB3      ASP  10  12.519   4.305   6.197
   75    HB3  ASP  10           HB2      ASP  10  12.167   2.867   7.157
   76    H    LEU  11           H        LEU  11  10.563   3.044   3.923
   77    HA   LEU  11           HA       LEU  11   8.938   0.989   5.276
   78    HB2  LEU  11           HB3      LEU  11   8.082   2.891   3.078
   79    HB3  LEU  11           HB2      LEU  11   7.049   2.051   4.235
   80    HG   LEU  11           HG       LEU  11   9.096   4.191   4.891
   81   HD11  LEU  11          HD11      LEU  11   7.100   5.151   3.913
   82   HD12  LEU  11          HD12      LEU  11   7.028   5.415   5.655
   83   HD13  LEU  11          HD13      LEU  11   6.065   4.137   4.917
   84   HD21  LEU  11          HD21      LEU  11   7.467   2.298   6.557
   85   HD22  LEU  11          HD22      LEU  11   7.778   3.922   7.171
   86   HD23  LEU  11          HD23      LEU  11   9.127   2.849   6.795
   87    H    ALA  12           H        ALA  12  10.320   1.637   2.101
   88    HA   ALA  12           HA       ALA  12   8.972  -0.136   0.447
   89    HB1  ALA  12           HB1      ALA  12  11.959  -0.242   0.367
   90    HB2  ALA  12           HB2      ALA  12  11.180   1.318   0.100
   91    HB3  ALA  12           HB3      ALA  12  10.808  -0.046  -0.955
   92    H    GLY  13           H        GLY  13   9.719  -2.376  -0.262
   93    HA2  GLY  13           HA3      GLY  13  11.206  -4.283   0.805
   94    HA3  GLY  13           HA2      GLY  13  10.119  -4.043   2.167
   95    H    GLN  14           H        GLN  14   9.214  -6.157   1.965
   96    HA   GLN  14           HA       GLN  14   7.509  -6.560  -0.461
   97    HB2  GLN  14           HB3      GLN  14   8.491  -8.727   1.410
   98    HB3  GLN  14           HB2      GLN  14   7.779  -8.919  -0.193
   99    HG2  GLN  14           HG3      GLN  14  10.043  -9.164  -0.680
  100    HG3  GLN  14           HG2      GLN  14   9.823  -7.435  -0.953
  101   HE21  GLN  14          HE22      GLN  14  11.885  -6.673  -0.275
  102   HE22  GLN  14          HE21      GLN  14  12.489  -6.890   1.297
  103    H    TRP  15           H        TRP  15   5.334  -7.154  -0.048
  104    HA   TRP  15           HA       TRP  15   4.494  -7.447   2.774
  105    HB2  TRP  15           HB3      TRP  15   3.348  -5.319   0.944
  106    HB3  TRP  15           HB2      TRP  15   2.763  -5.707   2.555
  107    HD1  TRP  15           HD1      TRP  15   6.043  -4.455   0.876
  108    HE1  TRP  15           HE1      TRP  15   7.248  -2.927   2.561
  109    HE3  TRP  15           HE3      TRP  15   2.907  -4.904   4.893
  110    HZ2  TRP  15           HZ2      TRP  15   6.932  -2.009   5.248
  111    HZ3  TRP  15           HZ3      TRP  15   3.388  -3.688   6.999
  112    HH2  TRP  15           HH2      TRP  15   5.393  -2.243   7.181
  113    H    THR  16           H        THR  16   1.975  -7.761   2.745
  114    HA   THR  16           HA       THR  16   1.086  -9.123   0.253
  115    HB   THR  16           HB       THR  16   0.377 -11.104   1.578
  116    HG1  THR  16           HG1      THR  16   2.062 -10.283   3.642
  117   HG21  THR  16          HG21      THR  16   2.575 -11.055   0.384
  118   HG22  THR  16          HG22      THR  16   2.584 -12.104   1.802
  119   HG23  THR  16          HG23      THR  16   3.331 -10.509   1.880
  120    H    LEU  17           H        LEU  17  -1.271  -9.583   0.334
  121    HA   LEU  17           HA       LEU  17  -2.704  -7.722   2.203
  122    HB2  LEU  17           HB3      LEU  17  -2.718  -7.802  -0.622
  123    HB3  LEU  17           HB2      LEU  17  -4.258  -8.499  -0.117
  124    HG   LEU  17           HG       LEU  17  -4.599  -6.524   1.390
  125   HD11  LEU  17          HD11      LEU  17  -2.875  -5.143   1.806
  126   HD12  LEU  17          HD12      LEU  17  -2.806  -4.713   0.097
  127   HD13  LEU  17          HD13      LEU  17  -1.863  -6.074   0.703
  128   HD21  LEU  17          HD21      LEU  17  -4.322  -5.010  -1.014
  129   HD22  LEU  17          HD22      LEU  17  -5.784  -5.747  -0.359
  130   HD23  LEU  17          HD23      LEU  17  -4.759  -6.657  -1.467
  131    H    GLN  18           H        GLN  18  -4.872  -8.504   2.876
  132    HA   GLN  18           HA       GLN  18  -5.505 -11.324   2.383
  133    HB2  GLN  18           HB3      GLN  18  -3.819 -11.546   4.147
  134    HB3  GLN  18           HB2      GLN  18  -4.687 -10.379   5.147
  135    HG2  GLN  18           HG3      GLN  18  -6.293 -11.886   5.748
  136    HG3  GLN  18           HG2      GLN  18  -6.297 -12.663   4.165
  137   HE21  GLN  18          HE22      GLN  18  -6.048 -14.838   4.975
  138   HE22  GLN  18          HE21      GLN  18  -4.628 -15.360   5.745
  139    H    GLN  19           H        GLN  19  -7.684 -11.455   2.328
  140    HA   GLN  19           HA       GLN  19  -9.273  -9.266   3.566
  141    HB2  GLN  19           HB3      GLN  19  -9.697  -9.848   1.184
  142    HB3  GLN  19           HB2      GLN  19 -10.124 -11.486   1.673
  143    HG2  GLN  19           HG3      GLN  19 -12.198 -10.855   2.294
  144    HG3  GLN  19           HG2      GLN  19 -11.576  -9.491   3.224
  145   HE21  GLN  19          HE22      GLN  19 -11.378  -7.412   2.131
  146   HE22  GLN  19          HE21      GLN  19 -12.110  -7.128   0.626
  147    H    ASP  20           H        ASP  20 -10.382  -9.661   5.440
  148    HA   ASP  20           HA       ASP  20 -10.905 -10.826   7.411
  149    HB2  ASP  20           HB3      ASP  20 -12.936 -11.034   6.054
  150    HB3  ASP  20           HB2      ASP  20 -12.286 -12.468   5.275
  151    H    GLU  21           H        GLU  21 -11.448 -13.909   6.320
  152    HA   GLU  21           HA       GLU  21  -8.651 -14.824   6.670
  153    HB2  GLU  21           HB3      GLU  21 -10.133 -14.742   8.895
  154    HB3  GLU  21           HB2      GLU  21 -10.748 -16.263   8.246
  155    HG2  GLU  21           HG3      GLU  21  -8.311 -16.967   7.951
  156    HG3  GLU  21           HG2      GLU  21  -7.885 -15.565   8.931
  157    H    ALA  22           H        ALA  22 -10.346 -14.752   4.372
  158    HA   ALA  22           HA       ALA  22 -10.942 -17.664   3.995
  159    HB1  ALA  22           HB1      ALA  22 -12.567 -15.385   3.537
  160    HB2  ALA  22           HB2      ALA  22 -12.932 -17.065   3.144
  161    HB3  ALA  22           HB3      ALA  22 -12.134 -16.035   1.955
  162    HA   PRO  23           HA       PRO  23  -7.800 -18.203   0.912
  163    HB2  PRO  23           HB2      PRO  23 -10.049 -18.702  -1.012
  164    HB3  PRO  23           HB3      PRO  23  -8.567 -19.640  -0.743
  165    HG2  PRO  23           HG3      PRO  23 -10.953 -20.378   0.244
  166    HG3  PRO  23           HG2      PRO  23  -9.424 -20.726   1.063
  167    HD2  PRO  23           HD3      PRO  23 -11.559 -18.860   1.853
  168    HD3  PRO  23           HD2      PRO  23 -10.220 -19.522   2.818
  169    H    ALA  24           H        ALA  24  -7.283 -15.887   0.875
  170    HA   ALA  24           HA       ALA  24  -7.596 -14.709  -1.740
  171    HB1  ALA  24           HB1      ALA  24  -9.062 -12.912  -1.307
  172    HB2  ALA  24           HB2      ALA  24  -8.954 -13.127   0.440
  173    HB3  ALA  24           HB3      ALA  24  -9.857 -14.285  -0.537
  174    H    ILE  25           H        ILE  25  -5.235 -14.951  -1.053
  175    HA   ILE  25           HA       ILE  25  -4.357 -12.504   0.438
  176    HB   ILE  25           HB       ILE  25  -2.744 -15.047   0.274
  177   HG12  ILE  25          HG13      ILE  25  -4.826 -14.285   2.346
  178   HG13  ILE  25          HG12      ILE  25  -4.875 -15.687   1.278
  179   HG21  ILE  25          HG21      ILE  25  -2.768 -13.062   2.524
  180   HG22  ILE  25          HG22      ILE  25  -1.929 -12.653   1.027
  181   HG23  ILE  25          HG23      ILE  25  -1.446 -14.078   1.947
  182   HD11  ILE  25          HD11      ILE  25  -4.005 -16.653   3.203
  183   HD12  ILE  25          HD12      ILE  25  -3.140 -15.189   3.670
  184   HD13  ILE  25          HD13      ILE  25  -2.519 -16.201   2.366
  185    H    CYS  26           H        CYS  26  -3.729 -11.145  -1.196
  186    HA   CYS  26           HA       CYS  26  -2.263 -12.268  -3.522
  187    HB2  CYS  26           HB3      CYS  26  -3.467  -9.548  -2.957
  188    HB3  CYS  26           HB2      CYS  26  -2.482  -9.886  -4.379
  189    H    HIS  27           H        HIS  27  -0.103 -11.844  -3.871
  190    HA   HIS  27           HA       HIS  27   1.450 -10.748  -1.648
  191    HB2  HIS  27           HB3      HIS  27   3.011 -11.089  -4.045
  192    HB3  HIS  27           HB2      HIS  27   3.063 -12.039  -2.559
  193    HD1  HIS  27           HD1      HIS  27   1.375 -14.094  -2.409
  194    HD2  HIS  27           HD2      HIS  27   1.677 -12.331  -6.177
  195    HE1  HIS  27           HE1      HIS  27   0.339 -15.725  -4.051
  196    HE2  HIS  27           HE2      HIS  27   0.518 -14.661  -6.345
  197    H    LEU  28           H        LEU  28   2.451  -8.714  -1.624
  198    HA   LEU  28           HA       LEU  28   1.965  -6.966  -3.999
  199    HB2  LEU  28           HB3      LEU  28   1.268  -6.570  -1.138
  200    HB3  LEU  28           HB2      LEU  28   1.944  -5.180  -1.966
  201    HG   LEU  28           HG       LEU  28   0.241  -5.485  -3.787
  202   HD11  LEU  28          HD11      LEU  28  -0.682  -7.556  -3.853
  203   HD12  LEU  28          HD12      LEU  28  -1.765  -6.939  -2.608
  204   HD13  LEU  28          HD13      LEU  28  -0.340  -7.868  -2.152
  205   HD21  LEU  28          HD21      LEU  28  -0.588  -3.847  -2.456
  206   HD22  LEU  28          HD22      LEU  28  -0.329  -4.775  -0.979
  207   HD23  LEU  28          HD23      LEU  28  -1.750  -5.083  -1.976
  208    H    GLU  29           H        GLU  29   3.416  -4.896  -3.768
  209    HA   GLU  29           HA       GLU  29   5.961  -5.343  -2.384
  210    HB2  GLU  29           HB3      GLU  29   5.599  -6.194  -5.118
  211    HB3  GLU  29           HB2      GLU  29   6.771  -4.877  -5.053
  212    HG2  GLU  29           HG3      GLU  29   8.018  -6.085  -3.288
  213    HG3  GLU  29           HG2      GLU  29   6.858  -7.412  -3.388
  214    H    LEU  30           H        LEU  30   6.567  -3.400  -1.700
  215    HA   LEU  30           HA       LEU  30   5.497  -0.966  -3.004
  216    HB2  LEU  30           HB3      LEU  30   6.899  -1.569  -0.401
  217    HB3  LEU  30           HB2      LEU  30   6.728   0.083  -0.976
  218    HG   LEU  30           HG       LEU  30   4.345  -0.031  -0.901
  219   HD11  LEU  30          HD11      LEU  30   3.214  -2.215  -0.255
  220   HD12  LEU  30          HD12      LEU  30   4.757  -3.012  -0.556
  221   HD13  LEU  30          HD13      LEU  30   3.912  -2.196  -1.870
  222   HD21  LEU  30          HD21      LEU  30   5.355  -1.607   1.485
  223   HD22  LEU  30          HD22      LEU  30   3.918  -0.590   1.429
  224   HD23  LEU  30          HD23      LEU  30   5.522   0.137   1.311
  225    H    ARG  31           H        ARG  31   6.740  -0.481  -4.807
  226    HA   ARG  31           HA       ARG  31   9.542  -1.022  -5.041
  227    HB2  ARG  31           HB3      ARG  31   7.496   0.407  -6.582
  228    HB3  ARG  31           HB2      ARG  31   9.102   1.118  -6.735
  229    HG2  ARG  31           HG3      ARG  31  10.028  -1.060  -7.375
  230    HG3  ARG  31           HG2      ARG  31   8.451  -1.816  -7.149
  231    HD2  ARG  31           HD3      ARG  31   8.823  -1.348  -9.529
  232    HD3  ARG  31           HD2      ARG  31   7.513  -0.343  -8.912
  233    HE   ARG  31           HE       ARG  31   9.994   1.076  -8.678
  234   HH11  ARG  31          HH22      ARG  31   7.672  -0.084 -10.948
  235   HH12  ARG  31          HH21      ARG  31   7.984   1.165 -12.106
  236   HH21  ARG  31          HH11      ARG  31  10.413   2.714 -10.176
  237   HH22  ARG  31          HH12      ARG  31   9.535   2.749 -11.669
  238    H    ASP  32           H        ASP  32  11.236   0.746  -5.269
  239    HA   ASP  32           HA       ASP  32  10.849   2.802  -3.126
  240    HB2  ASP  32           HB3      ASP  32  13.567   2.608  -3.527
  241    HB3  ASP  32           HB2      ASP  32  12.673   1.769  -2.259
  242    H    SER  33           H        SER  33  10.627   2.650  -6.315
  243    HA   SER  33           HA       SER  33  12.499   4.760  -7.098
  244    HB2  SER  33           HB3      SER  33  10.077   3.789  -8.634
  245    HB3  SER  33           HB2      SER  33  11.509   4.590  -9.279
  246    HG   SER  33           HG       SER  33  11.265   2.133  -9.324
  247    H    GLU  34           H        GLU  34  11.896   6.937  -7.607
  248    HA   GLU  34           HA       GLU  34   9.576   7.893  -6.052
  249    HB2  GLU  34           HB3      GLU  34  10.518  10.084  -6.315
  250    HB3  GLU  34           HB2      GLU  34  11.870   8.998  -5.991
  251    HG2  GLU  34           HG3      GLU  34  11.851   8.795  -8.658
  252    HG3  GLU  34           HG2      GLU  34  11.128  10.399  -8.520
  253    H    VAL  35           H        VAL  35   7.938   9.259  -7.006
  254    HA   VAL  35           HA       VAL  35   7.791   9.271  -9.974
  255    HB   VAL  35           HB       VAL  35   5.618   8.171  -8.164
  256   HG11  VAL  35          HG11      VAL  35   4.513   9.327  -9.917
  257   HG12  VAL  35          HG12      VAL  35   4.583   7.654 -10.468
  258   HG13  VAL  35          HG13      VAL  35   5.720   8.840 -11.108
  259   HG21  VAL  35          HG21      VAL  35   7.398   6.551  -8.526
  260   HG22  VAL  35          HG22      VAL  35   7.405   6.892 -10.256
  261   HG23  VAL  35          HG23      VAL  35   6.014   6.095  -9.521
  262    H    ALA  36           H        ALA  36   7.405  11.366 -10.491
  263    HA   ALA  36           HA       ALA  36   6.209  13.182  -8.517
  264    HB1  ALA  36           HB1      ALA  36   7.370  13.530 -11.283
  265    HB2  ALA  36           HB2      ALA  36   7.977  14.162  -9.752
  266    HB3  ALA  36           HB3      ALA  36   6.519  14.845 -10.472
  267    H    GLU  37           H        GLU  37   5.239  11.484 -11.430
  268    HA   GLU  37           HA       GLU  37   2.973  12.983 -12.184
  269    HB2  GLU  37           HB3      GLU  37   3.892  10.973 -13.398
  270    HB3  GLU  37           HB2      GLU  37   3.150   9.955 -12.164
  271    HG2  GLU  37           HG3      GLU  37   1.629  10.080 -14.044
  272    HG3  GLU  37           HG2      GLU  37   0.932  11.015 -12.720
  273    H    ALA  38           H        ALA  38   3.415  10.727  -9.520
  274    HA   ALA  38           HA       ALA  38   0.622  11.323  -8.618
  275    HB1  ALA  38           HB1      ALA  38   0.314   9.112  -8.349
  276    HB2  ALA  38           HB2      ALA  38   1.728   9.028  -7.297
  277    HB3  ALA  38           HB3      ALA  38   1.912   8.828  -9.039
  278    H    SER  39           H        SER  39   3.829  11.953  -8.018
  279    HA   SER  39           HA       SER  39   4.895  12.963  -6.200
  280    HB2  SER  39           HB3      SER  39   2.502  14.096  -6.176
  281    HB3  SER  39           HB2      SER  39   2.303  13.142  -4.710
  282    HG   SER  39           HG       SER  39   4.325  14.084  -4.011
  283    H    GLY  40           H        GLY  40   4.805  10.141  -6.266
  284    HA2  GLY  40           HA3      GLY  40   5.227   9.573  -3.423
  285    HA3  GLY  40           HA2      GLY  40   3.892   8.670  -4.140
  286    H    TYR  41           H        TYR  41   4.996   6.643  -3.941
  287    HA   TYR  41           HA       TYR  41   7.355   6.331  -5.750
  288    HB2  TYR  41           HB3      TYR  41   6.611   4.755  -3.274
  289    HB3  TYR  41           HB2      TYR  41   7.998   4.430  -4.313
  290    HD1  TYR  41           HD1      TYR  41   6.435   7.090  -2.202
  291    HD2  TYR  41           HD2      TYR  41  10.019   5.589  -4.016
  292    HE1  TYR  41           HE1      TYR  41   7.762   8.793  -0.985
  293    HE2  TYR  41           HE2      TYR  41  11.354   7.288  -2.794
  294    HH   TYR  41           HH       TYR  41  11.124   8.653  -0.714
  295    H    ASP  42           H        ASP  42   7.382   4.437  -7.052
  296    HA   ASP  42           HA       ASP  42   4.872   3.684  -8.142
  297    HB2  ASP  42           HB3      ASP  42   7.095   3.578  -9.310
  298    HB3  ASP  42           HB2      ASP  42   7.454   2.129  -8.372
  299    H    LEU  43           H        LEU  43   3.998   1.539  -8.274
  300    HA   LEU  43           HA       LEU  43   4.390  -0.124  -5.809
  301    HB2  LEU  43           HB3      LEU  43   2.193   1.082  -5.718
  302    HB3  LEU  43           HB2      LEU  43   1.749   0.332  -7.239
  303    HG   LEU  43           HG       LEU  43   2.225  -1.931  -6.044
  304   HD11  LEU  43          HD11      LEU  43   2.706  -1.960  -3.856
  305   HD12  LEU  43          HD12      LEU  43   1.402  -0.832  -3.490
  306   HD13  LEU  43          HD13      LEU  43   2.985  -0.222  -3.963
  307   HD21  LEU  43          HD21      LEU  43  -0.100  -0.187  -5.218
  308   HD22  LEU  43          HD22      LEU  43  -0.054  -1.946  -5.106
  309   HD23  LEU  43          HD23      LEU  43   0.004  -1.161  -6.682
  310    H    GLY  44           H        GLY  44   4.780  -2.238  -6.217
  311    HA2  GLY  44           HA3      GLY  44   4.189  -3.311  -8.947
  312    HA3  GLY  44           HA2      GLY  44   5.720  -3.651  -8.132
  313    H    GLY  45           H        GLY  45   4.822  -5.958  -8.467
  314    HA2  GLY  45           HA3      GLY  45   4.390  -7.770  -6.901
  315    HA3  GLY  45           HA2      GLY  45   3.330  -6.707  -6.003
  316    H    ASP  46           H        ASP  46   1.503  -8.049  -6.104
  317    HA   ASP  46           HA       ASP  46   0.504  -8.810  -8.797
  318    HB2  ASP  46           HB3      ASP  46   0.585 -10.274  -6.542
  319    HB3  ASP  46           HB2      ASP  46  -0.996  -9.519  -6.323
  320    H    THR  47           H        THR  47   0.461  -6.018  -7.633
  321    HA   THR  47           HA       THR  47  -1.940  -5.071  -6.711
  322    HB   THR  47           HB       THR  47  -1.310  -3.021  -7.508
  323    HG1  THR  47           HG1      THR  47  -0.200  -3.820  -9.902
  324   HG21  THR  47          HG21      THR  47   0.773  -4.209  -6.718
  325   HG22  THR  47          HG22      THR  47   1.068  -2.886  -7.846
  326   HG23  THR  47          HG23      THR  47   1.139  -4.554  -8.409
  327    H    ALA  48           H        ALA  48  -1.444  -6.695  -9.731
  328    HA   ALA  48           HA       ALA  48  -3.813  -5.724 -11.076
  329    HB1  ALA  48           HB1      ALA  48  -3.016  -6.964 -12.786
  330    HB2  ALA  48           HB2      ALA  48  -3.033  -8.435 -11.813
  331    HB3  ALA  48           HB3      ALA  48  -1.643  -7.350 -11.749
  332    H    CYS  49           H        CYS  49  -3.576  -7.441  -8.275
  333    HA   CYS  49           HA       CYS  49  -5.957  -9.157  -8.826
  334    HB2  CYS  49           HB3      CYS  49  -4.821 -10.622  -7.532
  335    HB3  CYS  49           HB2      CYS  49  -3.618  -9.400  -7.126
  336    H    LEU  50           H        LEU  50  -4.929  -6.268  -7.259
  337    HA   LEU  50           HA       LEU  50  -6.962  -6.102  -5.237
  338    HB2  LEU  50           HB3      LEU  50  -5.606  -3.793  -6.650
  339    HB3  LEU  50           HB2      LEU  50  -6.335  -3.782  -5.047
  340    HG   LEU  50           HG       LEU  50  -4.009  -5.569  -5.797
  341   HD11  LEU  50          HD11      LEU  50  -3.907  -2.960  -4.270
  342   HD12  LEU  50          HD12      LEU  50  -3.464  -3.119  -5.969
  343   HD13  LEU  50          HD13      LEU  50  -2.543  -3.974  -4.733
  344   HD21  LEU  50          HD21      LEU  50  -3.759  -5.489  -3.236
  345   HD22  LEU  50          HD22      LEU  50  -5.090  -6.444  -3.881
  346   HD23  LEU  50          HD23      LEU  50  -5.397  -4.839  -3.216
  347    H    THR  51           H        THR  51  -7.363  -6.227  -8.513
  348    HA   THR  51           HA       THR  51  -9.248  -4.113  -8.987
  349    HB   THR  51           HB       THR  51  -9.936  -6.397 -10.560
  350    HG1  THR  51           HG1      THR  51  -8.113  -7.445 -10.325
  351   HG21  THR  51          HG21      THR  51  -8.965  -5.022 -12.367
  352   HG22  THR  51          HG22      THR  51  -8.219  -3.973 -11.162
  353   HG23  THR  51          HG23      THR  51  -9.975  -4.049 -11.296
  354    H    ARG  52           H        ARG  52  -9.451  -6.417  -6.729
  355    HA   ARG  52           HA       ARG  52 -12.395  -6.845  -7.048
  356    HB2  ARG  52           HB3      ARG  52 -12.156  -8.768  -5.604
  357    HB3  ARG  52           HB2      ARG  52 -10.924  -8.887  -6.862
  358    HG2  ARG  52           HG3      ARG  52  -9.417  -7.603  -5.154
  359    HG3  ARG  52           HG2      ARG  52 -10.598  -8.151  -3.964
  360    HD2  ARG  52           HD3      ARG  52  -8.741  -9.758  -4.141
  361    HD3  ARG  52           HD2      ARG  52 -10.248 -10.487  -4.697
  362    HE   ARG  52           HE       ARG  52  -9.086  -9.432  -7.000
  363   HH11  ARG  52          HH22      ARG  52  -8.196 -11.592  -4.464
  364   HH12  ARG  52          HH21      ARG  52  -7.153 -12.547  -5.463
  365   HH21  ARG  52          HH11      ARG  52  -7.730 -10.665  -8.319
  366   HH22  ARG  52          HH12      ARG  52  -6.890 -12.022  -7.647
  367    H    TRP  53           H        TRP  53  -9.938  -5.320  -5.158
  368    HA   TRP  53           HA       TRP  53 -11.955  -4.632  -3.045
  369    HB2  TRP  53           HB3      TRP  53  -8.927  -4.623  -2.883
  370    HB3  TRP  53           HB2      TRP  53 -10.024  -4.185  -1.578
  371    HD1  TRP  53           HD1      TRP  53 -12.080  -6.380  -1.456
  372    HE1  TRP  53           HE1      TRP  53 -11.466  -8.841  -0.991
  373    HE3  TRP  53           HE3      TRP  53  -7.164  -6.329  -2.812
  374    HZ2  TRP  53           HZ2      TRP  53  -9.180 -10.564  -1.174
  375    HZ3  TRP  53           HZ3      TRP  53  -5.791  -8.385  -2.661
  376    HH2  TRP  53           HH2      TRP  53  -6.787 -10.500  -1.845
  377    H    LEU  54           H        LEU  54  -9.551  -3.440  -5.302
  378    HA   LEU  54           HA       LEU  54 -10.163  -0.635  -4.520
  379    HB2  LEU  54           HB3      LEU  54  -7.951  -1.911  -6.134
  380    HB3  LEU  54           HB2      LEU  54  -8.168  -0.169  -6.082
  381    HG   LEU  54           HG       LEU  54  -7.825  -1.904  -3.613
  382   HD11  LEU  54          HD11      LEU  54  -5.563  -1.465  -3.602
  383   HD12  LEU  54          HD12      LEU  54  -5.737   0.013  -4.547
  384   HD13  LEU  54          HD13      LEU  54  -5.829  -1.556  -5.341
  385   HD21  LEU  54          HD21      LEU  54  -7.052   0.721  -3.105
  386   HD22  LEU  54          HD22      LEU  54  -8.544  -0.047  -2.566
  387   HD23  LEU  54          HD23      LEU  54  -8.521   0.889  -4.058
  388    HA   PRO  55           HA       PRO  55 -12.525  -0.234  -8.265
  389    HB2  PRO  55           HB2      PRO  55 -12.319   2.427  -8.815
  390    HB3  PRO  55           HB3      PRO  55 -13.286   1.792  -7.472
  391    HG2  PRO  55           HG3      PRO  55 -10.643   3.112  -7.440
  392    HG3  PRO  55           HG2      PRO  55 -11.936   3.138  -6.234
  393    HD2  PRO  55           HD3      PRO  55  -9.615   1.594  -6.075
  394    HD3  PRO  55           HD2      PRO  55 -11.090   1.332  -5.133
  395    H    SER  56           H        SER  56  -9.176   0.525  -8.264
  396    HA   SER  56           HA       SER  56  -8.988  -0.115 -11.124
  397    HB2  SER  56           HB3      SER  56  -7.341   2.149 -10.907
  398    HB3  SER  56           HB2      SER  56  -8.845   2.027 -11.815
  399    HG   SER  56           HG       SER  56  -9.228   3.633 -10.409
  400    H    GLU  57           H        GLU  57  -6.699  -0.510 -11.735
  401    HA   GLU  57           HA       GLU  57  -5.261  -1.824  -9.612
  402    HB2  GLU  57           HB3      GLU  57  -5.188  -2.544 -11.993
  403    HB3  GLU  57           HB2      GLU  57  -4.286  -1.079 -12.380
  404    HG2  GLU  57           HG3      GLU  57  -2.433  -1.751 -11.019
  405    HG3  GLU  57           HG2      GLU  57  -3.361  -3.063 -10.291
  406    HA   PRO  58           HA       PRO  58  -3.186   2.058  -8.432
  407    HB2  PRO  58           HB2      PRO  58  -1.725   1.050  -6.344
  408    HB3  PRO  58           HB3      PRO  58  -3.413   1.544  -6.212
  409    HG2  PRO  58           HG3      PRO  58  -2.253  -1.150  -6.347
  410    HG3  PRO  58           HG2      PRO  58  -3.736  -0.592  -5.590
  411    HD2  PRO  58           HD3      PRO  58  -3.583  -1.973  -8.011
  412    HD3  PRO  58           HD2      PRO  58  -4.985  -1.043  -7.444
  413    H    ARG  59           H        ARG  59  -1.469   2.784  -9.556
  414    HA   ARG  59           HA       ARG  59   0.849   0.954  -9.983
  415    HB2  ARG  59           HB3      ARG  59  -0.493   2.958 -11.637
  416    HB3  ARG  59           HB2      ARG  59   1.256   3.182 -11.576
  417    HG2  ARG  59           HG3      ARG  59  -0.053   0.511 -12.143
  418    HG3  ARG  59           HG2      ARG  59   0.455   1.627 -13.411
  419    HD2  ARG  59           HD3      ARG  59   2.588   0.927 -13.232
  420    HD3  ARG  59           HD2      ARG  59   2.598   1.289 -11.506
  421    HE   ARG  59           HE       ARG  59   2.167  -0.999 -11.066
  422   HH11  ARG  59          HH22      ARG  59   1.723  -0.174 -14.386
  423   HH12  ARG  59          HH21      ARG  59   1.548  -1.816 -14.908
  424   HH21  ARG  59          HH11      ARG  59   1.946  -3.146 -11.728
  425   HH22  ARG  59          HH12      ARG  59   1.676  -3.499 -13.404
  426    H    ALA  60           H        ALA  60  -0.135   3.546  -8.045
  427    HA   ALA  60           HA       ALA  60   2.717   4.330  -7.622
  428    HB1  ALA  60           HB1      ALA  60   2.160   6.464  -7.957
  429    HB2  ALA  60           HB2      ALA  60   1.017   6.362  -6.622
  430    HB3  ALA  60           HB3      ALA  60   0.493   5.986  -8.267
  431    H    TRP  61           H        TRP  61   2.656   5.620  -5.311
  432    HA   TRP  61           HA       TRP  61   1.084   4.311  -3.234
  433    HB2  TRP  61           HB3      TRP  61   2.786   2.582  -4.084
  434    HB3  TRP  61           HB2      TRP  61   4.023   3.651  -3.476
  435    HD1  TRP  61           HD1      TRP  61   1.113   1.522  -2.292
  436    HE1  TRP  61           HE1      TRP  61   1.525   0.901   0.197
  437    HE3  TRP  61           HE3      TRP  61   5.297   4.261  -1.413
  438    HZ2  TRP  61           HZ2      TRP  61   3.437   1.509   2.274
  439    HZ3  TRP  61           HZ3      TRP  61   6.416   4.218   0.791
  440    HH2  TRP  61           HH2      TRP  61   5.490   2.847   2.638
  441    H    ARG  62           H        ARG  62   1.144   5.880  -1.585
  442    HA   ARG  62           HA       ARG  62   3.621   7.512  -1.272
  443    HB2  ARG  62           HB3      ARG  62   1.961   8.652  -2.809
  444    HB3  ARG  62           HB2      ARG  62   0.892   8.785  -1.412
  445    HG2  ARG  62           HG3      ARG  62   2.821   9.909  -0.190
  446    HG3  ARG  62           HG2      ARG  62   3.645   9.993  -1.747
  447    HD2  ARG  62           HD3      ARG  62   2.567  12.023  -1.830
  448    HD3  ARG  62           HD2      ARG  62   1.277  11.017  -2.489
  449    HE   ARG  62           HE       ARG  62   0.770  10.924   0.203
  450   HH11  ARG  62          HH22      ARG  62   1.472  13.446  -2.041
  451   HH12  ARG  62          HH21      ARG  62   0.536  14.637  -1.201
  452   HH21  ARG  62          HH11      ARG  62  -0.458  12.468   1.314
  453   HH22  ARG  62          HH12      ARG  62  -0.557  14.083   0.697
  454    HA   PRO  63           HA       PRO  63   2.385   6.386   3.015
  455    HB2  PRO  63           HB2      PRO  63   4.701   8.118   3.659
  456    HB3  PRO  63           HB3      PRO  63   4.354   6.461   4.183
  457    HG2  PRO  63           HG3      PRO  63   6.238   7.064   2.361
  458    HG3  PRO  63           HG2      PRO  63   5.342   5.540   2.373
  459    HD2  PRO  63           HD3      PRO  63   5.096   7.843   0.516
  460    HD3  PRO  63           HD2      PRO  63   4.705   6.129   0.250
  461    H    THR  64           H        THR  64   1.154   7.617   4.515
  462    HA   THR  64           HA       THR  64   1.127  10.575   4.089
  463    HB   THR  64           HB       THR  64  -1.314  10.040   5.175
  464    HG1  THR  64           HG1      THR  64  -0.526   7.822   3.609
  465   HG21  THR  64          HG21      THR  64  -2.204  10.269   2.893
  466   HG22  THR  64          HG22      THR  64  -0.614   9.893   2.228
  467   HG23  THR  64          HG23      THR  64  -0.858  11.380   3.144
  468    HA   PRO  65           HA       PRO  65   2.139  10.989   8.365
  469    HB2  PRO  65           HB2      PRO  65   0.384  12.993   9.170
  470    HB3  PRO  65           HB3      PRO  65   1.911  13.264   8.315
  471    HG2  PRO  65           HG3      PRO  65  -0.864  13.211   7.263
  472    HG3  PRO  65           HG2      PRO  65   0.506  14.233   6.798
  473    HD2  PRO  65           HD3      PRO  65  -0.297  12.122   5.293
  474    HD3  PRO  65           HD2      PRO  65   1.404  12.626   5.386
  475    H    ALA  66           H        ALA  66   0.093   8.936   7.741
  476    HA   ALA  66           HA       ALA  66  -0.844   8.464  10.424
  477    HB1  ALA  66           HB1      ALA  66  -3.333   8.502   9.101
  478    HB2  ALA  66           HB2      ALA  66  -2.553  10.032   8.698
  479    HB3  ALA  66           HB3      ALA  66  -2.795   9.584  10.386
  480    H    GLY  67           H        GLY  67   0.291   7.259   7.739
  481    HA2  GLY  67           HA3      GLY  67   0.010   4.623   8.087
  482    HA3  GLY  67           HA2      GLY  67  -1.586   4.983   7.452
  483    H    ILE  68           H        ILE  68  -1.585   4.192   5.401
  484    HA   ILE  68           HA       ILE  68   0.534   5.169   3.552
  485    HB   ILE  68           HB       ILE  68  -0.550   2.345   3.523
  486   HG12  ILE  68          HG13      ILE  68   2.182   3.280   4.457
  487   HG13  ILE  68          HG12      ILE  68   0.873   2.830   5.543
  488   HG21  ILE  68          HG21      ILE  68   1.817   3.602   2.100
  489   HG22  ILE  68          HG22      ILE  68   0.243   3.329   1.357
  490   HG23  ILE  68          HG23      ILE  68   1.212   1.960   1.887
  491   HD11  ILE  68          HD11      ILE  68   2.758   1.091   4.475
  492   HD12  ILE  68          HD12      ILE  68   1.325   0.811   3.485
  493   HD13  ILE  68          HD13      ILE  68   1.235   0.629   5.235
  494    H    ALA  69           H        ALA  69  -0.205   5.631   1.470
  495    HA   ALA  69           HA       ALA  69  -3.114   5.164   0.957
  496    HB1  ALA  69           HB1      ALA  69  -1.858   7.636   1.302
  497    HB2  ALA  69           HB2      ALA  69  -3.422   7.365   0.534
  498    HB3  ALA  69           HB3      ALA  69  -1.959   7.447  -0.448
  499    H    LEU  70           H        LEU  70  -3.608   4.567  -1.177
  500    HA   LEU  70           HA       LEU  70  -1.241   3.826  -2.888
  501    HB2  LEU  70           HB3      LEU  70  -4.013   2.661  -2.577
  502    HB3  LEU  70           HB2      LEU  70  -2.943   2.186  -3.878
  503    HG   LEU  70           HG       LEU  70  -1.684   2.120  -1.216
  504   HD11  LEU  70          HD11      LEU  70  -3.855   1.419  -0.454
  505   HD12  LEU  70          HD12      LEU  70  -2.875  -0.036  -0.626
  506   HD13  LEU  70          HD13      LEU  70  -4.072   0.370  -1.856
  507   HD21  LEU  70          HD21      LEU  70  -0.867   1.171  -3.471
  508   HD22  LEU  70          HD22      LEU  70  -2.051  -0.111  -3.226
  509   HD23  LEU  70          HD23      LEU  70  -0.736   0.107  -2.070
  510    H    LEU  71           H        LEU  71  -1.258   4.625  -5.028
  511    HA   LEU  71           HA       LEU  71  -3.676   6.239  -5.804
  512    HB2  LEU  71           HB3      LEU  71  -1.134   7.015  -7.051
  513    HB3  LEU  71           HB2      LEU  71  -2.401   8.009  -6.380
  514    HG   LEU  71           HG       LEU  71  -0.333   6.518  -4.734
  515   HD11  LEU  71          HD11      LEU  71   1.005   8.261  -5.205
  516   HD12  LEU  71          HD12      LEU  71  -0.140   9.289  -4.342
  517   HD13  LEU  71          HD13      LEU  71  -0.282   9.081  -6.087
  518   HD21  LEU  71          HD21      LEU  71  -2.883   7.610  -4.073
  519   HD22  LEU  71          HD22      LEU  71  -1.657   8.668  -3.378
  520   HD23  LEU  71          HD23      LEU  71  -1.673   6.951  -2.975
  521    H    GLU  72           H        GLU  72  -3.520   6.676  -8.328
  522    HA   GLU  72           HA       GLU  72  -2.889   4.055  -9.641
  523    HB2  GLU  72           HB3      GLU  72  -4.769   4.672 -11.219
  524    HB3  GLU  72           HB2      GLU  72  -5.274   4.319  -9.568
  525    HG2  GLU  72           HG3      GLU  72  -5.469   6.657  -9.040
  526    HG3  GLU  72           HG2      GLU  72  -4.708   7.119 -10.564
  527    H    ARG  73           H        ARG  73  -1.354   6.789  -9.437
  528    HA   ARG  73           HA       ARG  73   0.221   7.733 -10.904
  529    HB2  ARG  73           HB3      ARG  73  -0.355   5.483 -12.289
  530    HB3  ARG  73           HB2      ARG  73  -1.046   6.685 -13.377
  531    HG2  ARG  73           HG3      ARG  73   1.169   7.951 -13.132
  532    HG3  ARG  73           HG2      ARG  73   1.805   6.479 -12.399
  533    HD2  ARG  73           HD3      ARG  73   1.179   5.203 -14.419
  534    HD3  ARG  73           HD2      ARG  73   0.554   6.679 -15.154
  535    HE   ARG  73           HE       ARG  73   2.779   7.329 -15.612
  536   HH11  ARG  73          HH22      ARG  73   2.602   4.781 -13.296
  537   HH12  ARG  73          HH21      ARG  73   4.314   4.519 -13.256
  538   HH21  ARG  73          HH11      ARG  73   5.015   7.003 -15.572
  539   HH22  ARG  73          HH12      ARG  73   5.680   5.777 -14.544
  540    H    GLY  74           H        GLY  74  -2.266   8.919 -10.075
  541    HA2  GLY  74           HA3      GLY  74  -2.442  10.997 -12.151
  542    HA3  GLY  74           HA2      GLY  74  -3.944  10.133 -11.823
  543    H    GLY  75           H        GLY  75  -2.658   9.901  -8.940
  544    HA2  GLY  75           HA3      GLY  75  -2.433  11.412  -7.064
  545    HA3  GLY  75           HA2      GLY  75  -3.199  12.677  -8.023
  546    H    LEU  76           H        LEU  76  -4.950   9.950  -8.611
  547    HA   LEU  76           HA       LEU  76  -7.088  10.826  -6.786
  548    HB2  LEU  76           HB3      LEU  76  -7.457  10.122  -9.215
  549    HB3  LEU  76           HB2      LEU  76  -7.142   8.468  -8.686
  550    HG   LEU  76           HG       LEU  76  -8.944   9.172  -6.813
  551   HD11  LEU  76          HD11      LEU  76  -9.882  10.643  -9.287
  552   HD12  LEU  76          HD12      LEU  76  -9.120  11.458  -7.920
  553   HD13  LEU  76          HD13      LEU  76 -10.649  10.606  -7.700
  554   HD21  LEU  76          HD21      LEU  76  -9.128   7.213  -8.262
  555   HD22  LEU  76          HD22      LEU  76  -9.536   8.235  -9.639
  556   HD23  LEU  76          HD23      LEU  76 -10.657   8.093  -8.286
  557    H    THR  77           H        THR  77  -6.476  10.181  -4.704
  558    HA   THR  77           HA       THR  77  -5.192   7.776  -3.995
  559    HB   THR  77           HB       THR  77  -7.176   8.505  -2.022
  560    HG1  THR  77           HG1      THR  77  -5.810  10.675  -1.983
  561   HG21  THR  77          HG21      THR  77  -4.193   8.998  -2.056
  562   HG22  THR  77          HG22      THR  77  -4.916   7.431  -1.691
  563   HG23  THR  77          HG23      THR  77  -5.231   8.814  -0.641
  564    H    LEU  78           H        LEU  78  -5.845   5.696  -4.025
  565    HA   LEU  78           HA       LEU  78  -8.657   5.111  -4.725
  566    HB2  LEU  78           HB3      LEU  78  -6.339   3.197  -4.361
  567    HB3  LEU  78           HB2      LEU  78  -7.877   2.837  -5.117
  568    HG   LEU  78           HG       LEU  78  -6.088   5.022  -6.186
  569   HD11  LEU  78          HD11      LEU  78  -4.611   3.440  -6.815
  570   HD12  LEU  78          HD12      LEU  78  -5.866   2.822  -7.889
  571   HD13  LEU  78          HD13      LEU  78  -5.670   2.136  -6.279
  572   HD21  LEU  78          HD21      LEU  78  -8.329   3.334  -7.337
  573   HD22  LEU  78          HD22      LEU  78  -7.339   4.430  -8.293
  574   HD23  LEU  78          HD23      LEU  78  -8.371   5.066  -7.016
  575    H    MET  79           H        MET  79  -6.347   4.541  -2.084
  576    HA   MET  79           HA       MET  79  -8.578   4.180  -0.226
  577    HB2  MET  79           HB3      MET  79  -8.027   1.930  -1.448
  578    HB3  MET  79           HB2      MET  79  -6.654   1.877  -0.354
  579    HG2  MET  79           HG3      MET  79  -8.443   0.711   0.745
  580    HG3  MET  79           HG2      MET  79  -8.297   2.274   1.547
  581    HE1  MET  79           HE1      MET  79 -11.994   2.271   1.888
  582    HE2  MET  79           HE2      MET  79 -10.535   3.140   2.380
  583    HE3  MET  79           HE3      MET  79 -10.586   1.382   2.463
  584    H    LEU  80           H        LEU  80  -7.947   4.521   1.895
  585    HA   LEU  80           HA       LEU  80  -5.079   5.255   2.299
  586    HB2  LEU  80           HB3      LEU  80  -6.497   7.158   2.657
  587    HB3  LEU  80           HB2      LEU  80  -7.633   6.211   3.614
  588    HG   LEU  80           HG       LEU  80  -6.054   5.991   5.420
  589   HD11  LEU  80          HD11      LEU  80  -4.110   7.090   3.391
  590   HD12  LEU  80          HD12      LEU  80  -3.970   5.628   4.368
  591   HD13  LEU  80          HD13      LEU  80  -3.783   7.212   5.119
  592   HD21  LEU  80          HD21      LEU  80  -5.610   8.380   5.959
  593   HD22  LEU  80          HD22      LEU  80  -7.245   8.131   5.348
  594   HD23  LEU  80          HD23      LEU  80  -6.002   8.808   4.295
  595    H    LEU  81           H        LEU  81  -4.155   3.390   3.089
  596    HA   LEU  81           HA       LEU  81  -5.581   1.692   5.023
  597    HB2  LEU  81           HB3      LEU  81  -2.969   1.604   3.573
  598    HB3  LEU  81           HB2      LEU  81  -3.083   0.717   5.092
  599    HG   LEU  81           HG       LEU  81  -5.075  -0.470   4.264
  600   HD11  LEU  81          HD11      LEU  81  -6.155   0.985   2.785
  601   HD12  LEU  81          HD12      LEU  81  -5.420  -0.176   1.679
  602   HD13  LEU  81          HD13      LEU  81  -4.661   1.395   1.943
  603   HD21  LEU  81          HD21      LEU  81  -3.051  -0.689   2.055
  604   HD22  LEU  81          HD22      LEU  81  -3.907  -1.972   2.910
  605   HD23  LEU  81          HD23      LEU  81  -2.584  -1.115   3.701
  606    H    GLY  82           H        GLY  82  -5.569   2.135   7.210
  607    HA2  GLY  82           HA3      GLY  82  -3.592   4.115   8.206
  608    HA3  GLY  82           HA2      GLY  82  -5.097   3.679   9.002
  609    H    ARG  83           H        ARG  83  -2.187   3.644   9.896
  610    HA   ARG  83           HA       ARG  83  -1.488   0.858  10.314
  611    HB2  ARG  83           HB3      ARG  83   0.039   2.967  10.418
  612    HB3  ARG  83           HB2      ARG  83  -0.564   3.134  12.061
  613    HG2  ARG  83           HG3      ARG  83   0.082   0.466  11.985
  614    HG3  ARG  83           HG2      ARG  83   1.323   1.163  10.945
  615    HD2  ARG  83           HD3      ARG  83   2.228   1.262  13.144
  616    HD3  ARG  83           HD2      ARG  83   1.681   2.902  12.794
  617    HE   ARG  83           HE       ARG  83  -0.478   1.579  14.039
  618   HH11  ARG  83          HH22      ARG  83   2.779   2.509  14.684
  619   HH12  ARG  83          HH21      ARG  83   2.527   2.703  16.387
  620   HH21  ARG  83          HH11      ARG  83  -0.827   1.829  16.257
  621   HH22  ARG  83          HH12      ARG  83   0.484   2.318  17.277
  622    H    GLN  84           H        GLN  84  -2.492  -0.484  11.777
  623    HA   GLN  84           HA       GLN  84  -4.218   0.744  13.849
  624    HB2  GLN  84           HB3      GLN  84  -4.035  -1.918  12.525
  625    HB3  GLN  84           HB2      GLN  84  -4.634  -1.881  14.186
  626    HG2  GLN  84           HG3      GLN  84  -5.711   0.072  12.169
  627    HG3  GLN  84           HG2      GLN  84  -6.336  -1.574  12.214
  628   HE21  GLN  84          HE22      GLN  84  -7.720  -2.161  13.966
  629   HE22  GLN  84          HE21      GLN  84  -8.190  -1.073  15.179
  630    H    GLY  85           H        GLY  85  -1.243  -1.078  13.505
  631    HA2  GLY  85           HA3      GLY  85  -0.183  -0.354  16.003
  632    HA3  GLY  85           HA2      GLY  85  -1.003  -1.897  16.255
  633    H    GLU  86           H        GLU  86   1.927  -0.531  15.404
  634    HA   GLU  86           HA       GLU  86   3.939  -1.580  14.775
  635    HB2  GLU  86           HB3      GLU  86   2.517  -3.662  15.774
  636    HB3  GLU  86           HB2      GLU  86   2.649  -4.165  14.088
  637    HG2  GLU  86           HG3      GLU  86   5.153  -3.611  14.293
  638    HG3  GLU  86           HG2      GLU  86   4.878  -3.572  16.036
  639    H    GLY  87           H        GLY  87   4.242  -3.540  12.693
  640    HA2  GLY  87           HA3      GLY  87   3.804  -1.825  10.388
  641    HA3  GLY  87           HA2      GLY  87   4.503  -3.443  10.350
  642    H    ASP  88           H        ASP  88   1.405  -2.810  11.851
  643    HA   ASP  88           HA       ASP  88   0.103  -4.433   9.704
  644    HB2  ASP  88           HB3      ASP  88  -0.944  -5.562  11.348
  645    HB3  ASP  88           HB2      ASP  88   0.102  -4.726  12.497
  646    H    TYR  89           H        TYR  89  -1.543  -3.527   8.550
  647    HA   TYR  89           HA       TYR  89  -2.713  -0.951   9.508
  648    HB2  TYR  89           HB3      TYR  89  -1.943  -1.545   6.650
  649    HB3  TYR  89           HB2      TYR  89  -2.630  -0.058   7.239
  650    HD1  TYR  89           HD1      TYR  89   0.305  -2.323   7.807
  651    HD2  TYR  89           HD2      TYR  89  -1.207   1.701   7.847
  652    HE1  TYR  89           HE1      TYR  89   2.570  -1.473   8.330
  653    HE2  TYR  89           HE2      TYR  89   1.067   2.545   8.362
  654    HH   TYR  89           HH       TYR  89   3.460   0.768   9.552
  655    H    ARG  90           H        ARG  90  -4.902  -0.724   9.045
  656    HA   ARG  90           HA       ARG  90  -6.211  -2.831   7.417
  657    HB2  ARG  90           HB3      ARG  90  -7.395  -2.159  10.097
  658    HB3  ARG  90           HB2      ARG  90  -7.602  -3.614   9.121
  659    HG2  ARG  90           HG3      ARG  90  -5.205  -4.188   9.559
  660    HG3  ARG  90           HG2      ARG  90  -5.111  -2.803  10.641
  661    HD2  ARG  90           HD3      ARG  90  -5.543  -4.794  11.965
  662    HD3  ARG  90           HD2      ARG  90  -6.985  -3.779  11.982
  663    HE   ARG  90           HE       ARG  90  -7.498  -5.455   9.883
  664   HH11  ARG  90          HH22      ARG  90  -6.376  -5.916  13.111
  665   HH12  ARG  90          HH21      ARG  90  -7.069  -7.496  13.268
  666   HH21  ARG  90          HH11      ARG  90  -8.406  -7.517  10.070
  667   HH22  ARG  90          HH12      ARG  90  -8.218  -8.401  11.548
  668    H    VAL  91           H        VAL  91  -8.358  -2.201   6.744
  669    HA   VAL  91           HA       VAL  91  -9.151   0.602   7.321
  670    HB   VAL  91           HB       VAL  91  -7.655   0.363   5.186
  671   HG11  VAL  91          HG11      VAL  91 -10.291  -0.417   3.945
  672   HG12  VAL  91          HG12      VAL  91  -9.148  -1.652   4.475
  673   HG13  VAL  91          HG13      VAL  91  -8.675  -0.484   3.241
  674   HG21  VAL  91          HG21      VAL  91  -8.973   2.373   5.792
  675   HG22  VAL  91          HG22      VAL  91 -10.401   1.658   5.045
  676   HG23  VAL  91          HG23      VAL  91  -9.008   2.086   4.052
  677    H    GLN  92           H        GLN  92 -11.387   0.927   7.149
  678    HA   GLN  92           HA       GLN  92 -13.034  -1.460   7.244
  679    HB2  GLN  92           HB3      GLN  92 -13.526   1.496   7.414
  680    HB3  GLN  92           HB2      GLN  92 -14.892   0.415   7.135
  681    HG2  GLN  92           HG3      GLN  92 -14.495  -0.773   9.167
  682    HG3  GLN  92           HG2      GLN  92 -12.904  -0.037   9.367
  683   HE21  GLN  92          HE22      GLN  92 -15.466   0.071  11.098
  684   HE22  GLN  92          HE21      GLN  92 -15.709   1.731  11.355
  685    H    LYS  93           H        LYS  93 -13.308  -2.557   5.340
  686    HA   LYS  93           HA       LYS  93 -13.645  -1.038   2.823
  687    HB2  LYS  93           HB3      LYS  93 -12.218  -3.193   3.128
  688    HB3  LYS  93           HB2      LYS  93 -13.766  -4.040   3.074
  689    HG2  LYS  93           HG3      LYS  93 -14.236  -2.747   0.916
  690    HG3  LYS  93           HG2      LYS  93 -12.531  -2.295   0.937
  691    HD2  LYS  93           HD3      LYS  93 -12.241  -4.237  -0.217
  692    HD3  LYS  93           HD2      LYS  93 -12.363  -4.988   1.374
  693    HE2  LYS  93           HE3      LYS  93 -14.518  -4.684  -0.717
  694    HE3  LYS  93           HE2      LYS  93 -13.936  -6.163   0.045
  695    HZ1  LYS  93           HZ1      LYS  93 -14.788  -5.242   2.182
  696    HZ2  LYS  93           HZ2      LYS  93 -15.994  -5.608   1.046
  697    HZ3  LYS  93           HZ3      LYS  93 -15.525  -3.994   1.295
  698    H    GLY  94           H        GLY  94 -15.768  -0.219   3.862
  699    HA2  GLY  94           HA3      GLY  94 -18.101  -0.205   3.356
  700    HA3  GLY  94           HA2      GLY  94 -17.959  -1.864   2.777
  701    H    ASP  95           H        ASP  95 -17.674  -3.563   4.468
  702    HA   ASP  95           HA       ASP  95 -18.004  -3.107   7.243
  703    HB2  ASP  95           HB3      ASP  95 -20.516  -3.949   7.229
  704    HB3  ASP  95           HB2      ASP  95 -20.149  -2.232   7.064
  705    H    GLY  96           H        GLY  96 -16.452  -4.900   6.846
  706    HA2  GLY  96           HA3      GLY  96 -16.972  -7.348   7.707
  707    HA3  GLY  96           HA2      GLY  96 -17.707  -7.491   6.110
  708    H    GLY  97           H        GLY  97 -16.107  -6.533   4.321
  709    HA2  GLY  97           HA3      GLY  97 -13.881  -8.293   4.194
  710    HA3  GLY  97           HA2      GLY  97 -14.101  -6.886   3.154
  711    H    GLN  98           H        GLN  98 -12.347  -8.195   5.764
  712    HA   GLN  98           HA       GLN  98 -11.236  -5.542   6.522
  713    HB2  GLN  98           HB3      GLN  98 -11.984  -7.577   8.142
  714    HB3  GLN  98           HB2      GLN  98 -10.301  -8.022   7.869
  715    HG2  GLN  98           HG3      GLN  98  -9.564  -5.778   8.550
  716    HG3  GLN  98           HG2      GLN  98 -11.247  -5.313   8.836
  717   HE21  GLN  98          HE22      GLN  98 -11.346  -8.434   9.729
  718   HE22  GLN  98          HE21      GLN  98 -10.908  -8.315  11.365
  719    H    LEU  99           H        LEU  99  -9.561  -4.931   5.327
  720    HA   LEU  99           HA       LEU  99  -7.817  -6.948   4.069
  721    HB2  LEU  99           HB3      LEU  99  -7.665  -3.926   3.975
  722    HB3  LEU  99           HB2      LEU  99  -6.840  -5.053   2.909
  723    HG   LEU  99           HG       LEU  99  -9.839  -4.750   3.156
  724   HD11  LEU  99          HD11      LEU  99  -9.043  -4.203   0.545
  725   HD12  LEU  99          HD12      LEU  99  -7.814  -3.413   1.532
  726   HD13  LEU  99          HD13      LEU  99  -9.517  -3.008   1.753
  727   HD21  LEU  99          HD21      LEU  99  -8.047  -6.683   1.752
  728   HD22  LEU  99          HD22      LEU  99  -9.488  -6.139   0.891
  729   HD23  LEU  99          HD23      LEU  99  -9.644  -6.940   2.455
  730    H    VAL 100           H        VAL 100  -5.615  -7.178   4.610
  731    HA   VAL 100           HA       VAL 100  -4.624  -5.598   6.938
  732    HB   VAL 100           HB       VAL 100  -4.584  -8.622   6.702
  733   HG11  VAL 100          HG11      VAL 100  -2.562  -8.206   7.756
  734   HG12  VAL 100          HG12      VAL 100  -3.642  -8.191   9.150
  735   HG13  VAL 100          HG13      VAL 100  -3.111  -6.672   8.430
  736   HG21  VAL 100          HG21      VAL 100  -6.738  -7.659   7.454
  737   HG22  VAL 100          HG22      VAL 100  -5.891  -6.754   8.709
  738   HG23  VAL 100          HG23      VAL 100  -5.931  -8.516   8.768
  739    H    LEU 101           H        LEU 101  -2.843  -4.606   6.047
  740    HA   LEU 101           HA       LEU 101  -1.169  -6.096   4.096
  741    HB2  LEU 101           HB3      LEU 101  -1.866  -3.722   3.649
  742    HB3  LEU 101           HB2      LEU 101  -0.949  -3.249   5.057
  743    HG   LEU 101           HG       LEU 101   0.731  -4.874   3.425
  744   HD11  LEU 101          HD11      LEU 101  -0.642  -2.550   2.037
  745   HD12  LEU 101          HD12      LEU 101  -0.659  -4.241   1.531
  746   HD13  LEU 101          HD13      LEU 101   0.838  -3.315   1.456
  747   HD21  LEU 101          HD21      LEU 101   2.145  -2.877   3.510
  748   HD22  LEU 101          HD22      LEU 101   1.399  -3.131   5.087
  749   HD23  LEU 101          HD23      LEU 101   0.768  -1.895   4.001
  750    H    ARG 102           H        ARG 102   0.523  -7.306   4.999
  751    HA   ARG 102           HA       ARG 102   1.972  -6.067   7.301
  752    HB2  ARG 102           HB3      ARG 102   0.451  -7.894   8.088
  753    HB3  ARG 102           HB2      ARG 102   1.299  -9.009   7.016
  754    HG2  ARG 102           HG3      ARG 102   3.256  -7.580   8.540
  755    HG3  ARG 102           HG2      ARG 102   2.040  -8.205   9.654
  756    HD2  ARG 102           HD3      ARG 102   3.422  -9.864   7.526
  757    HD3  ARG 102           HD2      ARG 102   3.895  -9.827   9.224
  758    HE   ARG 102           HE       ARG 102   1.182 -10.456   9.268
  759   HH11  ARG 102          HH22      ARG 102   4.052 -11.675   7.797
  760   HH12  ARG 102          HH21      ARG 102   3.510 -13.320   7.792
  761   HH21  ARG 102          HH11      ARG 102   0.457 -12.597   9.272
  762   HH22  ARG 102          HH12      ARG 102   1.475 -13.842   8.628
  763    H    ARG 103           H        ARG 103   4.108  -6.052   7.058
  764    HA   ARG 103           HA       ARG 103   5.436  -6.499   4.665
  765    HB2  ARG 103           HB3      ARG 103   7.498  -6.477   5.958
  766    HB3  ARG 103           HB2      ARG 103   6.377  -5.300   6.631
  767    HG2  ARG 103           HG3      ARG 103   5.666  -7.476   8.070
  768    HG3  ARG 103           HG2      ARG 103   7.367  -7.850   7.789
  769    HD2  ARG 103           HD3      ARG 103   7.795  -5.389   8.520
  770    HD3  ARG 103           HD2      ARG 103   6.173  -5.477   9.206
  771    HE   ARG 103           HE       ARG 103   7.012  -6.924  10.880
  772   HH11  ARG 103          HH22      ARG 103   9.194  -6.551   8.236
  773   HH12  ARG 103          HH21      ARG 103  10.497  -7.377   9.022
  774   HH21  ARG 103          HH11      ARG 103   8.703  -8.005  11.922
  775   HH22  ARG 103          HH12      ARG 103  10.219  -8.201  11.109
  776    H    ALA 104           H        ALA 104   6.150  -8.289   3.586
  777    HA   ALA 104           HA       ALA 104   5.348 -10.913   4.378
  778    HB1  ALA 104           HB1      ALA 104   7.682 -10.747   2.575
  779    HB2  ALA 104           HB2      ALA 104   6.288  -9.796   2.060
  780    HB3  ALA 104           HB3      ALA 104   6.121 -11.530   2.326
  781    H    THR 105           H        THR 105   6.482 -12.559   5.419
  782    HA   THR 105           HA       THR 105   9.244 -11.936   6.376
  783    HB   THR 105           HB       THR 105   8.722 -12.558   8.600
  784    HG1  THR 105           HG1      THR 105   7.358 -14.109   8.861
  785   HG21  THR 105          HG21      THR 105   7.742 -10.343   7.752
  786   HG22  THR 105          HG22      THR 105   7.065 -10.984   9.249
  787   HG23  THR 105          HG23      THR 105   6.185 -11.170   7.734
  788    HA   PRO 106           HA       PRO 106   8.598 -16.262   4.590
  789    HB2  PRO 106           HB2      PRO 106  10.370 -16.014   2.512
  790    HB3  PRO 106           HB3      PRO 106   8.641 -15.643   2.376
  791    HG2  PRO 106           HG3      PRO 106  10.952 -13.804   2.699
  792    HG3  PRO 106           HG2      PRO 106   9.472 -13.606   1.745
  793    HD2  PRO 106           HD3      PRO 106   9.869 -12.395   4.176
  794    HD3  PRO 106           HD2      PRO 106   8.262 -12.810   3.540