*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   06-JUL-05   2A7Y              
*TITLE     SOLUTION STRUCTURE OF THE CONSERVED HYPOTHETICAL PROTEIN              
*TITLE    2 RV2302 FROM THE BACTERIUM MYCOBACTERIUM TUBERCULOSIS                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HYPOTHETICAL PROTEIN RV2302/MT2359;                        
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS;                     
*SOURCE   3 GENE: RV2302;                                                        
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21PRO;                                   
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET28B                                    
*KEYWDS    ANTI-PARALLEL BETA SHEET, STRUCTURAL GENOMICS, PSI, PROTEIN           
*KEYWDS   2 STRUCTURE INITIATIVE, TB STRUCTURAL GENOMICS CONSORTIUM,             
*KEYWDS   3 TBSGC                                                                
*EXPDTA    NMR, 25 STRUCTURES                                                    
*AUTHOR    G.W.BUCHKO, C.-Y.KIM, T.C.TERWILLIGER, M.A.KENNEDY, TB                
*AUTHOR   2 STRUCTURAL GENOMICS CONSORTIUM (TBSGC)                               
*REVDAT   1   23-AUG-05 2A7Y    0                                                


J Z z?[???i??i?TEXTMSWDrv2302all25res.tbl!ALL DISTANCE RESTRAINTS
!beta sheet H bonds.
!alpha helical H bonds.
!Beta sheets
assign (resid    8 and  name HN   )(resid   59 and  name O    ) 1.8 0.0 0.5 !!
assign (resid    8 and  name N    )(resid   59 and  name O    ) 2.8 0.0 0.5 !!
assign (resid   59 and  name HN   )(resid    8 and  name O    ) 1.8 0.0 0.5 !!
assign (resid   59 and  name N    )(resid    8 and  name O    ) 2.8 0.0 0.5 !!
assign (resid   10 and  name HN   )(resid   57 and  name O    ) 1.8 0.0 0.5 !!
assign (resid   10 and  name N    )(resid   57 and  name O    ) 2.8 0.0 0.5 !!
assign (resid   57 and  name HN   )(resid   10 and  name O    ) 1.8 0.0 0.5 !!
assign (resid   57 and  name N    )(resid   10 and  name O    ) 2.8 0.0 0.5 !!
assign (resid   11 and  name HN   )(resid   21 and  name O    ) 1.8 0.0 1.2 !BI
assign (resid   11 and  name N    )(resid   21 and  name O    ) 2.8 0.0 1.2 !BI
assign (resid   11 and  name HN   )(resid   20 and  name O    ) 1.8 0.0 1.2 !BI
assign (resid   11 and  name N    )(resid   20 and  name O    ) 2.8 0.0 1.2 !BI
assign (resid   20 and  name HN   )(resid   11 and  name O    ) 1.8 0.0 0.5 !BI
assign (resid   20 and  name N    )(resid   11 and  name O    ) 2.8 0.0 0.5 !BI
assign (resid   23 and  name HN   )(resid    9 and  name O    ) 1.8 0.0 0.5 !!
assign (resid   23 and  name N    )(resid    9 and  name O    ) 2.8 0.0 0.5 !!
assign (resid    9 and  name HN   )(resid   23 and  name O    ) 1.8 0.0 0.5 !!
assign (resid    9 and  name N    )(resid   23 and  name O    ) 2.8 0.0 0.5 !!
assign (resid   25 and  name HN   )(resid    7 and  name O    ) 1.8 0.0 0.5 !!
assign (resid   25 and  name N    )(resid    7 and  name O    ) 2.8 0.0 0.5 !!
assign (resid    7 and  name HN   )(resid   25 and  name O    ) 1.8 0.0 1.2 !Bi
assign (resid    7 and  name N    )(resid   25 and  name O    ) 2.8 0.0 1.2 !Bi
assign (resid    6 and  name HN   )(resid   25 and  name O    ) 1.8 0.0 1.2 !Bi
assign (resid    6 and  name N    )(resid   25 and  name O    ) 2.8 0.0 1.2 !Bi
assign (resid   37 and  name HN   )(resid   50 and  name O    ) 1.8 0.0 0.5 !
assign (resid   37 and  name N    )(resid   50 and  name O    ) 2.8 0.0 0.5 !
assign (resid   50 and  name HN   )(resid   37 and  name O    ) 1.8 0.0 0.5 !
assign (resid   50 and  name N    )(resid   37 and  name O    ) 2.8 0.0 0.5 !
assign (resid   38 and  name HN   )(resid   27 and  name O    ) 1.8 0.0 0.5 !!
assign (resid   38 and  name N    )(resid   27 and  name O    ) 2.8 0.0 0.5 !!
assign (resid   27 and  name HN   )(resid   38 and  name O    ) 1.8 0.0 1.2 !BI
assign (resid   27 and  name N    )(resid   38 and  name O    ) 2.8 0.0 1.2 !BI
assign (resid   26 and  name HN   )(resid   38 and  name O    ) 1.8 0.0 1.2 !BI
assign (resid   26 and  name N    )(resid   38 and  name O    ) 2.8 0.0 1.2 !BI
assign (resid   39 and  name HN   )(resid   48 and  name O    ) 1.8 0.0 0.5 !!
assign (resid   39 and  name N    )(resid   48 and  name O    ) 2.8 0.0 0.5 !!
assign (resid   48 and  name HN   )(resid   39 and  name O    ) 1.8 0.0 0.5 !!
assign (resid   48 and  name N    )(resid   39 and  name O    ) 2.8 0.0 0.5 !!
assign (resid   40 and  name HN   )(resid   24 and  name O    ) 1.8 0.0 0.5 !!
assign (resid   40 and  name N    )(resid   24 and  name O    ) 2.8 0.0 0.5 !!
assign (resid   24 and  name HN   )(resid   40 and  name O    ) 1.8 0.0 0.5 !!
assign (resid   24 and  name N    )(resid   40 and  name O    ) 2.8 0.0 0.5 !!
assign (resid   41 and  name HN   )(resid   46 and  name O    ) 1.8 0.0 0.5 !10
assign (resid   41 and  name N    )(resid   46 and  name O    ) 2.8 0.0 0.5 !10
!a-helix based on structure only.  D2o xchange...gone in 30 min.
assign (resid   68 and  name HN   )(resid   64 and  name O    ) 1.8 0.0 0.5
assign (resid   68 and  name N    )(resid   64 and  name O    ) 2.8 0.0 0.5
assign (resid   69 and  name HN   )(resid   65 and  name O    ) 1.8 0.0 0.5
assign (resid   69 and  name N    )(resid   65 and  name O    ) 2.8 0.0 0.5
assign (resid   70 and  name HN   )(resid   66 and  name O    ) 1.8 0.0 0.5
assign (resid   70 and  name N    )(resid   66 and  name O    ) 2.8 0.0 0.5
assign (resid   71 and  name HN   )(resid   67 and  name O    ) 1.8 0.0 0.5
assign (resid   71 and  name N    )(resid   67 and  name O    ) 2.8 0.0 0.5
assign (resid   72 and  name HN   )(resid   68 and  name O    ) 1.8 0.0 0.5
assign (resid   72 and  name N    )(resid   68 and  name O    ) 2.8 0.0 0.5
assign (resid   73 and  name HN   )(resid   69 and  name O    ) 1.8 0.0 0.5
assign (resid   73 and  name N    )(resid   69 and  name O    ) 2.8 0.0 0.5
assign (resid   74 and  name HN   )(resid   70 and  name O    ) 1.8 0.0 0.5
assign (resid   74 and  name N    )(resid   70 and  name O    ) 2.8 0.0 0.5
assign (resid   75 and  name HN   )(resid   71 and  name O    ) 1.8 0.0 0.5
assign (resid   75 and  name N    )(resid   71 and  name O    ) 2.8 0.0 0.5
!remarks  Ni-Ni+1
! strong 1.2 (3.0 A), medium, 1.7 (3.5 A), weak 3.2 (5.0 A)
! typically 2.8 Ang. in helix, 4.3 Ang. in beta strand
assign (resid    2 and  name HN   )(resid    3 and  name HN   ) 1.8 0.0 3.2
assign (resid    3 and  name HN   )(resid    4 and  name HN   ) 1.8 0.0 3.2
assign (resid    4 and  name HN   )(resid    5 and  name HN   ) 1.8 0.0 3.7
assign (resid    4 and  name HN   )(resid    7 and  name HN   ) 1.8 0.0 3.7
assign (resid    5 and  name HN   )(resid    6 and  name HN   ) 1.8 0.0 3.2
assign (resid    6 and  name HN   )(resid    7 and  name HN   ) 1.8 0.0 3.2
assign (resid    7 and  name HN   )(resid    8 and  name HN   ) 1.8 0.0 3.2
assign (resid    7 and  name HN   )(resid   25 and  name HN   ) 1.8 0.0 3.2 !B
assign (resid    8 and  name HN   )(resid   59 and  name HN   ) 1.8 0.0 3.2 !B
assign (resid    9 and  name HN   )(resid   10 and  name HN   ) 1.8 0.0 3.7
assign (resid    9 and  name HN   )(resid   23 and  name HN   ) 1.8 0.0 3.2 !B
assign (resid   11 and  name HN   )(resid   21 and  name HN   ) 1.8 0.0 3.2 !B
assign (resid   10 and  name HN   )(resid   57 and  name HN   ) 1.8 0.0 3.2 !B
assign (resid   24 and  name HN   )(resid   40 and  name HN   ) 1.8 0.0 3.2 !B
assign (resid   26 and  name HN   )(resid   27 and  name HN   ) 1.8 0.0 3.2
assign (resid   28 and  name HN   )(resid   29 and  name HN   ) 1.8 0.0 3.7
assign (resid   27 and  name HN   )(resid   38 and  name HN   ) 1.8 0.0 3.2 !B
assign (resid   28 and  name HN   )(resid   29 and  name HN   ) 1.8 0.0 3.7
assign (resid   29 and  name HN   )(resid   30 and  name HN   ) 1.8 0.0 2.7
assign (resid   32 and  name HN   )(resid   33 and  name HN   ) 1.8 0.0 2.7
assign (resid   33 and  name HN   )(resid   34 and  name HN   ) 1.8 0.0 3.2
assign (resid   37 and  name HN   )(resid   38 and  name HN   ) 1.8 0.0 3.7
assign (resid   37 and  name HN   )(resid   50 and  name HN   ) 1.8 0.0 3.2 !9
assign (resid   38 and  name HN   )(resid   39 and  name HN   ) 1.8 0.0 3.7
assign (resid   39 and  name HN   )(resid   48 and  name HN   ) 1.8 0.0 2.7 !B
assign (resid   39 and  name HN   )(resid   40 and  name HN   ) 1.8 0.0 3.7
assign (resid   43 and  name HN   )(resid   44 and  name HN   ) 1.8 0.0 2.7 !4
assign (resid   44 and  name HN   )(resid   45 and  name HN   ) 1.8 0.0 2.7 !4
assign (resid   44 and  name HN   )(resid   44 and  name HD21 ) 1.8 0.0 4.2
assign (resid   44 and  name HN   )(resid   44 and  name HD22 ) 1.8 0.0 4.2
assign (resid   45 and  name HN   )(resid   46 and  name HN   ) 1.8 0.0 2.7
assign (resid   45 and  name HN   )(resid   41 and  name HN   ) 1.8 0.0 3.7 !B 
assign (resid   46 and  name HN   )(resid   47 and  name HN   ) 1.8 0.0 3.2
assign (resid   46 and  name HN   )(resid   41 and  name HN   ) 1.8 0.0 3.2 !B
assign (resid   47 and  name HN   )(resid   48 and  name HN   ) 1.8 0.0 3.2
assign (resid   48 and  name HN   )(resid   49 and  name HN   ) 1.8 0.0 3.2
assign (resid   54 and  name HN   )(resid   55 and  name HN   ) 1.8 0.0 3.2
assign (resid   55 and  name HN   )(resid   56 and  name HN   ) 1.8 0.0 1.7
assign (resid   56 and  name HN   )(resid   57 and  name HN   ) 1.8 0.0 3.2
assign (resid   57 and  name HN   )(resid   58 and  name HN   ) 1.8 0.0 3.7
assign (resid   58 and  name HN   )(resid   59 and  name HN   ) 1.8 0.0 3.2
assign (resid   59 and  name HN   )(resid   60 and  name HN   ) 1.8 0.0 3.2
assign (resid   60 and  name HN   )(resid   61 and  name HN   ) 1.8 0.0 3.2
assign (resid   61 and  name HN   )(resid   62 and  name HN   ) 1.8 0.0 3.2
assign (resid   62 and  name HN   )(resid   63 and  name HN   ) 1.8 0.0 1.2 !A
assign (resid   63 and  name HN   )(resid   64 and  name HN   ) 1.8 0.0 1.2 !A
assign (resid   63 and  name HN   )(resid   65 and  name HN   ) 1.8 0.0 3.2
assign (resid   64 and  name HN   )(resid   65 and  name HN   ) 1.8 0.0 1.2 !A
assign (resid   65 and  name HN   )(resid   66 and  name HN   ) 1.8 0.0 1.2 !A
assign (resid   66 and  name HN   )(resid   67 and  name HN   ) 1.8 0.0 1.2 !A
assign (resid   67 and  name HN   )(resid   68 and  name HN   ) 1.8 0.0 1.2 !A
assign (resid   67 and  name HN   )(resid   69 and  name HN   ) 1.8 0.0 3.2 
assign (resid   68 and  name HN   )(resid   69 and  name HN   ) 1.8 0.0 1.7 !A weaker
assign (resid   69 and  name HN   )(resid   70 and  name HN   ) 1.8 0.0 1.7 !A weaker
assign (resid   70 and  name HN   )(resid   71 and  name HN   ) 1.8 0.0 1.7 !A weaker
assign (resid   70 and  name HN   )(resid   72 and  name HN   ) 1.8 0.0 3.2
assign (resid   71 and  name HN   )(resid   72 and  name HN   ) 1.8 0.0 1.2 !A
assign (resid   72 and  name HN   )(resid   73 and  name HN   ) 1.8 0.0 1.2 !A
assign (resid   73 and  name HN   )(resid   74 and  name HN   ) 1.8 0.0 1.2 !A
assign (resid   73 and  name HN   )(resid   75 and  name HN   ) 1.8 0.0 2.7
assign (resid   74 and  name HN   )(resid   75 and  name HN   ) 1.8 0.0 1.2 !A
assign (resid   74 and  name HN   )(resid   76 and  name HN   ) 1.8 0.0 2.7 
assign (resid   76 and  name HN   )(resid   75 and  name HN   ) 1.8 0.0 1.2 !A 
assign (resid   76 and  name HN   )(resid   77 and  name HN   ) 1.8 0.0 1.7 !A weaker
assign (resid   77 and  name HN   )(resid   78 and  name HN   ) 1.8 0.0 3.7 
assign (resid   79 and  name HN   )(resid   78 and  name HN   ) 1.8 0.0 3.2 
! amide to side chain  
!NH to a-1 3.0 in B-sheet or helix if strong; otherwise, 3.5 (med) and 5.0 (weak) 
assign (resid    2 and  name HN   )(resid    1 and  name HA   ) 1.8 0.0 1.2
assign (resid    2 and  name HN   )(resid    1 and  name HB*  ) 1.8 0.0 4.2
assign (resid    2 and  name HN   )(resid    1 and  name HG1  ) 1.8 0.0 4.2
assign (resid    2 and  name HN   )(resid    1 and  name HG2  ) 1.8 0.0 4.2
assign (resid    2 and  name HN   )(resid    2 and  name HB1  ) 1.8 0.0 2.7
assign (resid    2 and  name HN   )(resid    2 and  name HB2  ) 1.8 0.0 2.7
assign (resid    3 and  name HN   )(resid    2 and  name HB1  ) 1.8 0.0 4.2
assign (resid    3 and  name HN   )(resid    2 and  name HB2  ) 1.8 0.0 4.2
assign (resid    3 and  name HN   )(resid    2 and  name HA   ) 1.8 0.0 2.7
assign (resid    3 and  name HN   )(resid    3 and  name HB*  ) 1.8 0.0 4.2
assign (resid    3 and  name HN   )(resid   33 and  name HA1  ) 1.8 0.0 3.2 !9
assign (resid    3 and  name HN   )(resid   33 and  name HA2  ) 1.8 0.0 3.2 !9
assign (resid    3 and  name HN   )(resid   28 and  name HG1* ) 1.8 0.0 4.7 !9
assign (resid    4 and  name HN   )(resid    4 and  name HB*  ) 1.8 0.0 2.7
assign (resid    4 and  name HN   )(resid    4 and  name HG1  ) 1.8 0.0 3.2
assign (resid    4 and  name HN   )(resid    4 and  name HG2  ) 1.8 0.0 3.2
assign (resid    4 and  name HN   )(resid   25 and  name HD*  ) 1.8 0.0 4.7
assign (resid    4 and  name HN   )(resid    7 and  name HB*  ) 1.8 0.0 4.2
assign (resid    5 and  name HN   )(resid    4 and  name HG1  ) 1.8 0.0 4.2
assign (resid    5 and  name HN   )(resid    4 and  name HG2  ) 1.8 0.0 4.2
assign (resid    5 and  name HN   )(resid    4 and  name HA   ) 1.8 0.0 0.7 !b-strand
assign (resid    5 and  name HN   )(resid    5 and  name HA   ) 1.8 0.0 1.2
assign (resid    5 and  name HN   )(resid    5 and  name HB   ) 1.8 0.0 1.2
assign (resid    5 and  name HN   )(resid    5 and  name HG2* ) 1.8 0.0 4.7 !10%
assign (resid    5 and  name HN   )(resid   28 and  name HG2* ) 1.8 0.0 4.7 !10%
assign (resid    6 and  name HN   )(resid    5 and  name HA   ) 1.8 0.0 0.7 !b-strand
assign (resid    6 and  name HN   )(resid    5 and  name HB   ) 1.8 0.0 3.7
assign (resid    6 and  name HN   )(resid    5 and  name HG2* ) 1.8 0.0 4.7 !10%
assign (resid    6 and  name HN   )(resid    6 and  name HA1  ) 1.8 0.0 2.2
assign (resid    6 and  name HN   )(resid    6 and  name HA2  ) 1.8 0.0 2.2
assign (resid    6 and  name HN   )(resid   25 and  name HG2* ) 1.8 0.0 4.7 !3d c13ny
assign (resid    7 and  name HN   )(resid    7 and  name HA   ) 1.8 0.0 3.2 !9
assign (resid    7 and  name HN   )(resid    7 and  name HB*  ) 1.8 0.0 2.2
assign (resid    7 and  name HN   )(resid    5 and  name HA   ) 1.8 0.0 1.2
assign (resid    7 and  name HN   )(resid    6 and  name HA1  ) 1.8 0.0 2.0
assign (resid    7 and  name HN   )(resid    6 and  name HA2  ) 1.8 0.0 2.0
assign (resid    7 and  name HN   )(resid   25 and  name HD*  ) 1.8 0.0 4.7
assign (resid    7 and  name HN   )(resid   25 and  name HG2* ) 1.8 0.0 4.7 !3d c13ny
assign (resid    8 and  name HN   )(resid   58 and  name HG*  ) 1.8 0.0 5.6 !15
assign (resid    8 and  name HN   )(resid    8 and  name HA   ) 1.8 0.0 3.2
assign (resid    8 and  name HN   )(resid    8 and  name HB1  ) 1.8 0.0 2.7
assign (resid    8 and  name HN   )(resid    8 and  name HB2  ) 1.8 0.0 2.7
assign (resid    8 and  name HN   )(resid    7 and  name HA   ) 1.8 0.0 0.7 !10 b
assign (resid    8 and  name HN   )(resid    7 and  name HB*  ) 1.8 0.0 2.2
assign (resid    9 and  name HN   )(resid    9 and  name HA   ) 1.8 0.0 3.2 !10
assign (resid    9 and  name HN   )(resid    9 and  name HB1  ) 1.8 0.0 2.7
assign (resid    9 and  name HN   )(resid    9 and  name HB2  ) 1.8 0.0 2.7
assign (resid    9 and  name HN   )(resid    9 and  name HD1* ) 1.8 0.0 4.6
assign (resid    9 and  name HN   )(resid    9 and  name HD2* ) 1.8 0.0 4.6
assign (resid    9 and  name HN   )(resid    8 and  name HB1  ) 1.8 0.0 4.2
assign (resid    9 and  name HN   )(resid    8 and  name HB2  ) 1.8 0.0 4.2
assign (resid    9 and  name HN   )(resid    8 and  name HA   ) 1.8 0.0 0.7 !b-sheet
assign (resid    9 and  name HN   )(resid   24 and  name HA   ) 1.8 0.0 3.2
assign (resid    9 and  name HN   )(resid   23 and  name HB*  ) 1.8 0.0 5.7
assign (resid    9 and  name HN   )(resid   25 and  name HD*  ) 1.8 0.0 5.7
assign (resid   10 and  name HN   )(resid   10 and  name HA   ) 1.8 0.0 3.2
assign (resid   10 and  name HN   )(resid   10 and  name HB   ) 1.8 0.0 3.2
assign (resid   10 and  name HN   )(resid   10 and  name HG1* ) 1.8 0.0 4.7 !10%
assign (resid   10 and  name HN   )(resid   10 and  name HG2* ) 1.8 0.0 4.7 !10%
assign (resid   10 and  name HN   )(resid    9 and  name HA   ) 1.8 0.0 0.7 !B-sheet
assign (resid   10 and  name HN   )(resid    9 and  name HD1* ) 1.8 0.0 4.1
assign (resid   10 and  name HN   )(resid    9 and  name HD2* ) 1.8 0.0 4.1
assign (resid   10 and  name HN   )(resid   58 and  name HA   ) 1.8 0.0 3.2 !3d 13Cny
assign (resid   11 and  name HN   )(resid   11 and  name HA   ) 1.8 0.0 3.2
assign (resid   11 and  name HN   )(resid   11 and  name HB   ) 1.8 0.0 2.2
assign (resid   11 and  name HN   )(resid   11 and  name HG*  ) 1.8 0.0 5.0
assign (resid   11 and  name HN   )(resid   10 and  name HA   ) 1.8 0.0 0.7 !10
assign (resid   11 and  name HN   )(resid   10 and  name HB   ) 1.8 0.0 3.2
assign (resid   11 and  name HN   )(resid   10 and  name HG1* ) 1.8 0.0 4.7 !0%
assign (resid   11 and  name HN   )(resid   10 and  name HG2* ) 1.8 0.0 4.7 !10%
assign (resid   11 and  name HN   )(resid   22 and  name HA   ) 1.8 0.0 3.2
assign (resid   12 and  name HN   )(resid   11 and  name HB   ) 1.8 0.0 3.2
assign (resid   12 and  name HN   )(resid   11 and  name HA   ) 1.8 0.0 0.7 !b-shhet
assign (resid   12 and  name HN   )(resid   56 and  name HA   ) 1.8 0.0 3.2 !WEAK 8
assign (resid   20 and  name HN   )(resid   19 and  name HA   ) 1.8 0.0 0.7
assign (resid   20 and  name HN   )(resid   20 and  name HB*  ) 1.8 0.0 2.7
assign (resid   20 and  name HN   )(resid   19 and  name HB1  ) 1.8 0.0 4.2
assign (resid   20 and  name HN   )(resid   19 and  name HB2  ) 1.8 0.0 4.2
assign (resid   20 and  name HN   )(resid   10 and  name HG1* ) 1.8 0.0 4.7 !10%
assign (resid   21 and  name HN   )(resid   21 and  name HA   ) 1.8 0.0 3.2
assign (resid   21 and  name HN   )(resid   20 and  name HB*  ) 1.8 0.0 3.7
assign (resid   21 and  name HN   )(resid   10 and  name HG1* ) 1.8 0.0 4.7 !10%
assign (resid   22 and  name HN   )(resid   21 and  name HA   ) 1.8 0.0 3.2
assign (resid   23 and  name HN   )(resid   10 and  name HG2* ) 1.8 0.0 4.7 !9
assign (resid   23 and  name HN   )(resid   23 and  name HB*  ) 1.8 0.0 3.7
assign (resid   23 and  name HN   )(resid   22 and  name HA   ) 1.8 0.0 0.7 !b-sheet
assign (resid   23 and  name HN   )(resid   22 and  name HB1  ) 1.8 0.0 4.2
assign (resid   23 and  name HN   )(resid   22 and  name HB2  ) 1.8 0.0 4.2
assign (resid   24 and  name HN   )(resid   24 and  name HA   ) 1.8 0.0 3.2
assign (resid   24 and  name HN   )(resid   23 and  name HA   ) 1.8 0.0 0.7 !10
assign (resid   24 and  name HN   )(resid   23 and  name HB*  ) 1.8 0.0 3.2
assign (resid   24 and  name HN   )(resid   39 and  name HG1* ) 1.8 0.0 4.7 !10%
assign (resid   24 and  name HN   )(resid   41 and  name HA   ) 1.8 0.0 3.2
assign (resid   25 and  name HN   )(resid   25 and  name HA   ) 1.8 0.0 3.2 !looks weak.
assign (resid   25 and  name HN   )(resid   25 and  name HG2* ) 1.8 0.0 4.7
assign (resid   25 and  name HN   )(resid   25 and  name HD*  ) 1.8 0.0 4.7
assign (resid   25 and  name HN   )(resid   24 and  name HA   ) 1.8 0.0 0.7 !10
assign (resid   25 and  name HN   )(resid    8 and  name HA   ) 1.8 0.0 3.2
assign (resid   26 and  name HN   )(resid   26 and  name HA   ) 1.8 0.0 3.2
assign (resid   26 and  name HN   )(resid   26 and  name HB   ) 1.8 0.0 3.2
assign (resid   26 and  name HN   )(resid   26 and  name HD*  ) 1.8 0.0 4.7
assign (resid   26 and  name HN   )(resid   26 and  name HG2* ) 1.8 0.0 4.7
assign (resid   26 and  name HN   )(resid   25 and  name HA   ) 1.8 0.0 1.2
assign (resid   26 and  name HN   )(resid   39 and  name HA   ) 1.8 0.0 3.2
assign (resid   26 and  name HN   )(resid   39 and  name HG1* ) 1.8 0.0 5.6
assign (resid   27 and  name HN   )(resid   27 and  name HA   ) 1.8 0.0 3.2
assign (resid   27 and  name HN   )(resid   26 and  name HA   ) 1.8 0.0 2.7
assign (resid   27 and  name HN   )(resid   25 and  name HG2* ) 1.8 0.0 3.7
assign (resid   27 and  name HN   )(resid   25 and  name HA   ) 1.8 0.0 1.7
assign (resid   27 and  name HN   )(resid   26 and  name HB   ) 1.8 0.0 2.7
assign (resid   27 and  name HN   )(resid   26 and  name HD*  ) 1.8 0.0 4.2
assign (resid   27 and  name HN   )(resid   26 and  name HG2* ) 1.8 0.0 4.7
assign (resid   27 and  name HN   )(resid   39 and  name HA   ) 1.8 0.0 3.2
assign (resid   27 and  name HN   )(resid   39 and  name HG2* ) 1.8 0.0 4.7 !10%
assign (resid   28 and  name HN   )(resid   28 and  name HA   ) 1.8 0.0 3.2
assign (resid   28 and  name HN   )(resid   28 and  name HB   ) 1.8 0.0 1.7
assign (resid   28 and  name HN   )(resid   28 and  name HG1* ) 1.8 0.0 4.2 !10%
assign (resid   28 and  name HN   )(resid   28 and  name HG2* ) 1.8 0.0 3.7 !10%  stronger
assign (resid   28 and  name HN   )(resid   27 and  name HA   ) 1.8 0.0 2.7 !10
assign (resid   28 and  name HN   )(resid    5 and  name HG2* ) 1.8 0.0 4.7 !10%
assign (resid   29 and  name HN   )(resid   29 and  name HA   ) 1.8 0.0 3.2
assign (resid   29 and  name HN   )(resid   29 and  name HB1  ) 1.8 0.0 2.7
assign (resid   29 and  name HN   )(resid   29 and  name HB2  ) 1.8 0.0 2.7
assign (resid   29 and  name HN   )(resid   29 and  name HG*  ) 1.8 0.0 4.2
assign (resid   29 and  name HN   )(resid   28 and  name HA   ) 1.8 0.0 1.7
assign (resid   29 and  name HN   )(resid   28 and  name HB   ) 1.8 0.0 3.2
assign (resid   29 and  name HN   )(resid   28 and  name HG1* ) 1.8 0.0 4.7 !10%
assign (resid   29 and  name HN   )(resid   28 and  name HG2* ) 1.8 0.0 4.7 !10%
assign (resid   29 and  name HN   )(resid   37 and  name HA   ) 1.8 0.0 3.2
assign (resid   29 and  name HN   )(resid   37 and  name HD*  ) 1.8 0.0 5.6 !B aromatic
assign (resid   30 and  name HN   )(resid   30 and  name HA   ) 1.8 0.0 1.7
assign (resid   30 and  name HN   )(resid   30 and  name HB1  ) 1.8 0.0 2.7
assign (resid   30 and  name HN   )(resid   30 and  name HB2  ) 1.8 0.0 2.7
assign (resid   30 and  name HN   )(resid   29 and  name HA   ) 1.8 0.0 1.7
assign (resid   30 and  name HN   )(resid   29 and  name HB1  ) 1.8 0.0 3.2
assign (resid   30 and  name HN   )(resid   29 and  name HB2  ) 1.8 0.0 3.2
assign (resid   30 and  name HN   )(resid   29 and  name HG*  ) 1.8 0.0 4.2
assign (resid   30 and  name HN   )(resid   28 and  name HB   ) 1.8 0.0 3.2
assign (resid   30 and  name HN   )(resid   28 and  name HG2* ) 1.8 0.0 4.7 !10%
assign (resid   30 and  name HN   )(resid   28 and  name HG1* ) 1.8 0.0 3.7 !10%
assign (resid   32 and  name HN   )(resid   32 and  name HB1  ) 1.8 0.0 2.7
assign (resid   32 and  name HN   )(resid   32 and  name HB2  ) 1.8 0.0 2.7
assign (resid   32 and  name HN   )(resid   31 and  name HB*  ) 1.8 0.0 3.2
assign (resid   33 and  name HN   )(resid   33 and  name HA1  ) 1.8 0.0 2.7
assign (resid   33 and  name HN   )(resid   33 and  name HA2  ) 1.8 0.0 2.7
assign (resid   33 and  name HN   )(resid   30 and  name HB1  ) 1.8 0.0 4.2
assign (resid   33 and  name HN   )(resid   28 and  name HG1* ) 1.8 0.0 4.7 !9
assign (resid   33 and  name HN   )(resid   33 and  name HA2  ) 1.8 0.0 2.7
assign (resid   34 and  name HN   )(resid   33 and  name HA1  ) 1.8 0.0 4.2
assign (resid   34 and  name HN   )(resid   33 and  name HA2  ) 1.8 0.0 4.2
assign (resid   34 and  name HN   )(resid   28 and  name HG1* ) 1.8 0.0 5.7 !9
assign (resid   37 and  name HN   )(resid   37 and  name HA   ) 1.8 0.0 3.2
assign (resid   37 and  name HN   )(resid   37 and  name HB1  ) 1.8 0.0 2.7
assign (resid   37 and  name HN   )(resid   37 and  name HB2  ) 1.8 0.0 2.7
assign (resid   37 and  name HN   )(resid   36 and  name HA   ) 1.8 0.0 0.7
assign (resid   37 and  name HN   )(resid   36 and  name HB*  ) 1.8 0.0 3.2 !9
assign (resid   37 and  name HN   )(resid   35 and  name HA   ) 1.8 0.0 2.7 !4
assign (resid   38 and  name HN   )(resid   38 and  name HA   ) 1.8 0.0 2.7
assign (resid   38 and  name HN   )(resid   38 and  name HB   ) 1.8 0.0 1.7
assign (resid   38 and  name HN   )(resid   37 and  name HA   ) 1.8 0.0 0.7 !b-sheet
assign (resid   38 and  name HN   )(resid   37 and  name HB1  ) 1.8 0.0 2.7
assign (resid   38 and  name HN   )(resid   37 and  name HB2  ) 1.8 0.0 2.7
assign (resid   38 and  name HN   )(resid   25 and  name HG2* ) 1.8 0.0 5.6 !3d c13ny
assign (resid   39 and  name HN   )(resid   39 and  name HA   ) 1.8 0.0 2.7
assign (resid   39 and  name HN   )(resid   39 and  name HG1* ) 1.8 0.0 3.7 !10% stronger
assign (resid   39 and  name HN   )(resid   39 and  name HG2* ) 1.8 0.0 4.7 !10%
assign (resid   39 and  name HN   )(resid   38 and  name HA   ) 1.8 0.0 0.7 !b-sheet
assign (resid   39 and  name HN   )(resid   38 and  name HG*  ) 1.8 0.0 4.1
assign (resid   39 and  name HN   )(resid   49 and  name HA   ) 1.8 0.0 3.2 !3d C13ny seeit
assign (resid   40 and  name HN   )(resid   40 and  name HA   ) 1.8 0.0 2.7
assign (resid   40 and  name HN   )(resid   40 and  name HB1  ) 1.8 0.0 2.7
assign (resid   40 and  name HN   )(resid   40 and  name HB2  ) 1.8 0.0 2.7
assign (resid   40 and  name HN   )(resid   39 and  name HA   ) 1.8 0.0 0.7 !b-sheet
assign (resid   40 and  name HN   )(resid   39 and  name HG1* ) 1.8 0.0 4.7 !10%
assign (resid   40 and  name HN   )(resid   39 and  name HG2* ) 1.8 0.0 4.7 !10%
assign (resid   40 and  name HN   )(resid   23 and  name HB*  ) 1.8 0.0 4.7
assign (resid   40 and  name HN   )(resid   25 and  name HA   ) 1.8 0.0 3.2
assign (resid   40 and  name HN   )(resid   26 and  name HD*  ) 1.8 0.0 4.7 !9
assign (resid   40 and  name HE   )(resid   40 and  name HB1  ) 1.8 0.0 4.2 !9
assign (resid   40 and  name HE   )(resid   40 and  name HB2  ) 1.8 0.0 4.2 !9
assign (resid   40 and  name HE   )(resid   40 and  name HD*  ) 1.8 0.0 2.7 !9
assign (resid   40 and  name HE   )(resid   40 and  name HG*  ) 1.8 0.0 3.7 !9
assign (resid   40 and  name HE   )(resid   47 and  name HG1  ) 1.8 0.0 4.2 !9
assign (resid   40 and  name HE   )(resid   47 and  name HG2  ) 1.8 0.0 4.2 !9
assign (resid   40 and  name HE   )(resid   26 and  name HD*  ) 1.8 0.0 4.7 !9
assign (resid   41 and  name HN   )(resid   41 and  name HA   ) 1.8 0.0 2.7
assign (resid   41 and  name HN   )(resid   41 and  name HB1  ) 1.8 0.0 4.2
assign (resid   41 and  name HN   )(resid   41 and  name HB2  ) 1.8 0.0 3.2
assign (resid   41 and  name HN   )(resid   41 and  name HD1  ) 1.8 0.0 3.2 !9
assign (resid   41 and  name HN   )(resid   40 and  name HA   ) 1.8 0.0 0.7 !b-sheet
assign (resid   41 and  name HN   )(resid   40 and  name HB2  ) 1.8 0.0 4.2
assign (resid   41 and  name HN   )(resid   47 and  name HA   ) 1.8 0.0 3.2
assign (resid   41 and  name HE1  )(resid   72 and  name HB*  ) 1.8 0.0 4.7
assign (resid   41 and  name HE1  )(resid   39 and  name HG1* ) 1.8 0.0 4.2 !10%
assign (resid   41 and  name HE1  )(resid   48 and  name HG*  ) 1.8 0.0 5.7
assign (resid   42 and  name HN   )(resid   42 and  name HA   ) 1.8 0.0 2.7
assign (resid   42 and  name HN   )(resid   42 and  name HB1  ) 1.8 0.0 4.2
assign (resid   42 and  name HN   )(resid   42 and  name HB2  ) 1.8 0.0 4.2
assign (resid   42 and  name HN   )(resid   42 and  name HD2* ) 1.8 0.0 4.7 !10%
assign (resid   42 and  name HN   )(resid   42 and  name HD1* ) 1.8 0.0 4.7 !10%
assign (resid   42 and  name HN   )(resid   23 and  name HA   ) 1.8 0.0 2.2 
assign (resid   42 and  name HN   )(resid   41 and  name HA   ) 1.8 0.0 1.2 !b-sheet
assign (resid   42 and  name HN   )(resid   23 and  name HB*  ) 1.8 0.0 4.7
assign (resid   43 and  name HN   )(resid   43 and  name HA   ) 1.8 0.0 2.7
assign (resid   43 and  name HN   )(resid   43 and  name HB   ) 1.8 0.0 1.7
assign (resid   43 and  name HN   )(resid   43 and  name HG2* ) 1.8 0.0 4.7 !10%
assign (resid   43 and  name HN   )(resid   43 and  name HG1* ) 1.8 0.0 4.7 !10%
assign (resid   44 and  name HN   )(resid   44 and  name HA   ) 1.8 0.0 1.7
assign (resid   44 and  name HN   )(resid   44 and  name HB1  ) 1.8 0.0 3.2
assign (resid   44 and  name HN   )(resid   44 and  name HB2  ) 1.8 0.0 3.2
assign (resid   44 and  name HN   )(resid   43 and  name HB   ) 1.8 0.0 2.2
assign (resid   44 and  name HN   )(resid   43 and  name HG1* ) 1.8 0.0 4.7 !10%
assign (resid   44 and  name HD21 )(resid   43 and  name HA   ) 1.8 0.0 4.2 !9
assign (resid   44 and  name HD22 )(resid   43 and  name HA   ) 1.8 0.0 4.7 !9
assign (resid   45 and  name HN   )(resid   45 and  name HA*  ) 1.8 0.0 2.2
assign (resid   45 and  name HN   )(resid   44 and  name HA   ) 1.8 0.0 3.2
assign (resid   45 and  name HN   )(resid   44 and  name HB1  ) 1.8 0.0 4.2
assign (resid   45 and  name HN   )(resid   44 and  name HB2  ) 1.8 0.0 4.2
assign (resid   46 and  name HN   )(resid   46 and  name HA   ) 1.8 0.0 2.7
assign (resid   46 and  name HN   )(resid   46 and  name HB1  ) 1.8 0.0 3.2
assign (resid   46 and  name HN   )(resid   46 and  name HB2  ) 1.8 0.0 3.2
assign (resid   46 and  name HN   )(resid   45 and  name HA*  ) 1.8 0.0 2.7
assign (resid   46 and  name HN   )(resid   44 and  name HB1  ) 1.8 0.0 4.2
assign (resid   46 and  name HN   )(resid   44 and  name HB2  ) 1.8 0.0 4.2
assign (resid   47 and  name HN   )(resid   47 and  name HA   ) 1.8 0.0 2.7
assign (resid   47 and  name HN   )(resid   47 and  name HB1  ) 1.8 0.0 2.7
assign (resid   47 and  name HN   )(resid   47 and  name HB2  ) 1.8 0.0 2.7
assign (resid   47 and  name HN   )(resid   47 and  name HG1  ) 1.8 0.0 3.7
assign (resid   47 and  name HN   )(resid   47 and  name HG2  ) 1.8 0.0 3.7
assign (resid   47 and  name HN   )(resid   46 and  name HA   ) 1.8 0.0 0.7 !b-sheet
assign (resid   47 and  name HN   )(resid   46 and  name HB1  ) 1.8 0.0 2.2
assign (resid   47 and  name HN   )(resid   46 and  name HB2  ) 1.8 0.0 2.2
assign (resid   48 and  name HN   )(resid   48 and  name HA   ) 1.8 0.0 2.7
assign (resid   48 and  name HN   )(resid   48 and  name HG2* ) 1.8 0.0 3.2
assign (resid   48 and  name HN   )(resid   47 and  name HA   ) 1.8 0.0 0.7 !b-sheet
assign (resid   48 and  name HN   )(resid   47 and  name HB1  ) 1.8 0.0 4.2
assign (resid   48 and  name HN   )(resid   47 and  name HB2  ) 1.8 0.0 4.2
assign (resid   48 and  name HN   )(resid   47 and  name HG1  ) 1.8 0.0 4.2
assign (resid   48 and  name HN   )(resid   47 and  name HG2  ) 1.8 0.0 4.2
assign (resid   48 and  name HN   )(resid   39 and  name HG1* ) 1.8 0.0 4.2 !10%
assign (resid   49 and  name HN   )(resid   49 and  name HA   ) 1.8 0.0 2.7
assign (resid   49 and  name HN   )(resid   49 and  name HB   ) 1.8 0.0 1.7
assign (resid   49 and  name HN   )(resid   49 and  name HG2* ) 1.8 0.0 4.7
assign (resid   49 and  name HN   )(resid   48 and  name HA   ) 1.8 0.0 0.7 !b-sheet
assign (resid   49 and  name HN   )(resid   48 and  name HG2* ) 1.8 0.0 3.7
assign (resid   49 and  name HN   )(resid   48 and  name HB   ) 1.8 0.0 1.7
assign (resid   50 and  name HN   )(resid   50 and  name HA   ) 1.8 0.0 2.7
assign (resid   50 and  name HN   )(resid   50 and  name HB   ) 1.8 0.0 3.2
assign (resid   50 and  name HN   )(resid   49 and  name HA   ) 1.8 0.0 0.7 !b-sheet
assign (resid   50 and  name HN   )(resid   49 and  name HG2* ) 1.8 0.0 3.7
assign (resid   51 and  name HN   )(resid   51 and  name HA   ) 1.8 0.0 2.7
assign (resid   51 and  name HN   )(resid   51 and  name HB1  ) 1.8 0.0 2.7
assign (resid   51 and  name HN   )(resid   51 and  name HB2  ) 1.8 0.0 2.7
assign (resid   51 and  name HN   )(resid   50 and  name HA   ) 1.8 0.0 1.0 !b-sheet
assign (resid   51 and  name HN   )(resid   50 and  name HB   ) 1.8 0.0 2.2
assign (resid   51 and  name HN   )(resid   50 and  name HG*  ) 1.8 0.0 5.0
assign (resid   53 and  name HN   )(resid   53 and  name HA1  ) 1.8 0.0 3.7
assign (resid   53 and  name HN   )(resid   53 and  name HA2  ) 1.8 0.0 3.7
assign (resid   53 and  name HN   )(resid   52 and  name HB1  ) 1.8 0.0 4.2
assign (resid   53 and  name HN   )(resid   52 and  name HB2  ) 1.8 0.0 4.2
assign (resid   54 and  name HN   )(resid   53 and  name HA1  ) 1.8 0.0 3.7
assign (resid   54 and  name HN   )(resid   53 and  name HA2  ) 1.8 0.0 3.7
assign (resid   55 and  name HN   )(resid   55 and  name HB1  ) 1.8 0.0 2.7
assign (resid   55 and  name HN   )(resid   55 and  name HB2  ) 1.8 0.0 2.7
assign (resid   55 and  name HN   )(resid   54 and  name HA   ) 1.8 0.0 1.2
assign (resid   55 and  name HN   )(resid   54 and  name HB1  ) 1.8 0.0 4.2
assign (resid   55 and  name HN   )(resid   54 and  name HB2  ) 1.8 0.0 4.2
assign (resid   55 and  name HN   )(resid   56 and  name HB*  ) 1.8 0.0 4.7
assign (resid   56 and  name HN   )(resid   56 and  name HA   ) 1.8 0.0 1.7
assign (resid   56 and  name HN   )(resid   56 and  name HB*  ) 1.8 0.0 3.2
assign (resid   56 and  name HN   )(resid   54 and  name HA   ) 1.8 0.0 2.2
assign (resid   56 and  name HN   )(resid   55 and  name HB1  ) 1.8 0.0 4.2
assign (resid   56 and  name HN   )(resid   55 and  name HB2  ) 1.8 0.0 4.2
assign (resid   57 and  name HN   )(resid   56 and  name HA   ) 1.8 0.0 0.7 !b-sheet
assign (resid   57 and  name HN   )(resid   11 and  name HA   ) 1.8 0.0 3.2
assign (resid   57 and  name HN   )(resid   57 and  name HA   ) 1.8 0.0 2.7
assign (resid   57 and  name HN   )(resid   57 and  name HB   ) 1.8 0.0 3.2
assign (resid   57 and  name HN   )(resid   57 and  name HG*  ) 1.8 0.0 5.0
assign (resid   57 and  name HN   )(resid   56 and  name HB*  ) 1.8 0.0 3.2
assign (resid   57 and  name HN   )(resid   10 and  name HG2* ) 1.8 0.0 4.7 !9
assign (resid   58 and  name HN   )(resid   57 and  name HA   ) 1.8 0.0 0.7 !b-sheet
assign (resid   58 and  name HN   )(resid   58 and  name HA   ) 1.8 0.0 2.7
assign (resid   58 and  name HN   )(resid   58 and  name HB   ) 1.8 0.0 1.7
assign (resid   58 and  name HN   )(resid   58 and  name HG*  ) 1.8 0.0 5.0
assign (resid   58 and  name HN   )(resid   57 and  name HB   ) 1.8 0.0 1.7
assign (resid   58 and  name HN   )(resid   57 and  name HG*  ) 1.8 0.0 4.0
assign (resid   59 and  name HN   )(resid   59 and  name HG2* ) 1.8 0.0 4.7 !10%
assign (resid   59 and  name HN   )(resid   59 and  name HG1* ) 1.8 0.0 4.7 !10%
assign (resid   59 and  name HN   )(resid   58 and  name HA   ) 1.8 0.0 0.7 !b-sheet
assign (resid   59 and  name HN   )(resid   58 and  name HB   ) 1.8 0.0 3.2
assign (resid   59 and  name HN   )(resid   58 and  name HG*  ) 1.8 0.0 5.0
assign (resid   59 and  name HN   )(resid    9 and  name HA   ) 1.8 0.0 3.2 !3d C13ny
assign (resid   59 and  name HN   )(resid   59 and  name HA   ) 1.8 0.0 2.7
assign (resid   59 and  name HN   )(resid   59 and  name HB   ) 1.8 0.0 1.7
assign (resid   60 and  name HN   )(resid   60 and  name HA   ) 1.8 0.0 2.0
assign (resid   60 and  name HN   )(resid   60 and  name HB   ) 1.8 0.0 2.2
assign (resid   60 and  name HN   )(resid   60 and  name HG2* ) 1.8 0.0 2.2
assign (resid   60 and  name HN   )(resid   59 and  name HA   ) 1.8 0.0 0.7 !b-sheet
assign (resid   60 and  name HN   )(resid   59 and  name HB   ) 1.8 0.0 2.2
assign (resid   60 and  name HN   )(resid   59 and  name HG2* ) 1.8 0.0 3.7 !10% stronger
assign (resid   60 and  name HN   )(resid   59 and  name HG1* ) 1.8 0.0 4.7 !10%
assign (resid   60 and  name HN   )(resid   63 and  name HG1  ) 1.8 0.0 4.2
assign (resid   60 and  name HN   )(resid   63 and  name HG2  ) 1.8 0.0 4.2
assign (resid   60 and  name HN   )(resid   63 and  name HB*  ) 1.8 0.0 4.2
assign (resid   61 and  name HN   )(resid   61 and  name HB*  ) 1.8 0.0 2.2
assign (resid   61 and  name HN   )(resid   60 and  name HA   ) 1.8 0.0 1.2 !strong but overlap
assign (resid   61 and  name HN   )(resid   60 and  name HB   ) 1.8 0.0 1.7
assign (resid   61 and  name HN   )(resid   60 and  name HG2* ) 1.8 0.0 4.7
assign (resid   62 and  name HN   )(resid   62 and  name HA   ) 1.8 0.0 1.2 !a-helix
assign (resid   62 and  name HN   )(resid   62 and  name HB   ) 1.8 0.0 1.7
assign (resid   62 and  name HN   )(resid   62 and  name HG2* ) 1.8 0.0 3.2
assign (resid   62 and  name HN   )(resid   61 and  name HB*  ) 1.8 0.0 2.2
assign (resid   62 and  name HN   )(resid   60 and  name HA   ) 1.8 0.0 3.2
assign (resid   62 and  name HN   )(resid   60 and  name HB   ) 1.8 0.0 3.2
assign (resid   62 and  name HN   )(resid   60 and  name HG2* ) 1.8 0.0 4.7
assign (resid   63 and  name HN   )(resid   63 and  name HA   ) 1.8 0.0 2.2
assign (resid   63 and  name HN   )(resid   63 and  name HB*  ) 1.8 0.0 2.7
assign (resid   63 and  name HN   )(resid   63 and  name HG1  ) 1.8 0.0 2.7
assign (resid   63 and  name HN   )(resid   63 and  name HG2  ) 1.8 0.0 2.7
assign (resid   63 and  name HN   )(resid   61 and  name HB*  ) 1.8 0.0 4.7
assign (resid   63 and  name HN   )(resid   62 and  name HA   ) 1.8 0.0 2.2
assign (resid   63 and  name HN   )(resid   62 and  name HB   ) 1.8 0.0 2.2
assign (resid   63 and  name HN   )(resid   62 and  name HG2* ) 1.8 0.0 4.7
assign (resid   63 and  name HN   )(resid   60 and  name HA   ) 1.8 0.0 4.2 !very weak
assign (resid   63 and  name HN   )(resid   60 and  name HB   ) 1.8 0.0 3.2
assign (resid   63 and  name HN   )(resid   60 and  name HG2* ) 1.8 0.0 4.7
assign (resid   64 and  name HN   )(resid   64 and  name HA   ) 1.8 0.0 1.7
assign (resid   64 and  name HN   )(resid   64 and  name HB1  ) 1.8 0.0 2.2
assign (resid   64 and  name HN   )(resid   64 and  name HB2  ) 1.8 0.0 2.2
assign (resid   64 and  name HN   )(resid   63 and  name HB*  ) 1.8 0.0 4.2
assign (resid   64 and  name HN   )(resid   63 and  name HG1  ) 1.8 0.0 4.2
assign (resid   64 and  name HN   )(resid   63 and  name HG2  ) 1.8 0.0 4.2
assign (resid   64 and  name HN   )(resid   62 and  name HA   ) 1.8 0.0 4.2
assign (resid   64 and  name HN   )(resid   59 and  name HB   ) 1.8 0.0 3.2
assign (resid   64 and  name HN   )(resid   59 and  name HG1* ) 1.8 0.0 4.6
assign (resid   65 and  name HN   )(resid   65 and  name HA   ) 1.8 0.0 1.2 !a-helix
assign (resid   65 and  name HN   )(resid   65 and  name HB*  ) 1.8 0.0 2.2
assign (resid   65 and  name HN   )(resid   64 and  name HB1  ) 1.8 0.0 4.0
assign (resid   65 and  name HN   )(resid   64 and  name HB2  ) 1.8 0.0 4.0
assign (resid   65 and  name HN   )(resid   62 and  name HA   ) 1.8 0.0 3.2
assign (resid   65 and  name HN   )(resid   43 and  name HG2* ) 1.8 0.0 4.2 !9
assign (resid   66 and  name HN   )(resid   66 and  name HA   ) 1.8 0.0 1.2 !a-helix
assign (resid   66 and  name HN   )(resid   66 and  name HB1  ) 1.8 0.0 2.7 
assign (resid   66 and  name HN   )(resid   66 and  name HB2  ) 1.8 0.0 2.7 
assign (resid   66 and  name HN   )(resid   66 and  name HG*  ) 1.8 0.0 3.7 
assign (resid   66 and  name HN   )(resid   62 and  name HA   ) 1.8 0.0 4.2
assign (resid   66 and  name HN   )(resid   65 and  name HB*  ) 1.8 0.0 3.2
assign (resid   66 and  name HN   )(resid   65 and  name HA   ) 1.8 0.0 3.2
assign (resid   67 and  name HN   )(resid   67 and  name HB*  ) 1.8 0.0 3.2
assign (resid   67 and  name HN   )(resid   66 and  name HA   ) 1.8 0.0 3.2
assign (resid   67 and  name HN   )(resid   66 and  name HB1  ) 1.8 0.0 3.7 
assign (resid   67 and  name HN   )(resid   66 and  name HB2  ) 1.8 0.0 3.7 
assign (resid   67 and  name HN   )(resid   66 and  name HG*  ) 1.8 0.0 4.2
assign (resid   68 and  name HN   )(resid   68 and  name HA   ) 1.8 0.0 1.2 !a-helix
assign (resid   68 and  name HN   )(resid   68 and  name HB*  ) 1.8 0.0 4.2
assign (resid   68 and  name HN   )(resid   68 and  name HG1  ) 1.8 0.0 4.2
assign (resid   68 and  name HN   )(resid   68 and  name HG2  ) 1.8 0.0 4.2
assign (resid   68 and  name HN   )(resid   65 and  name HA   ) 1.8 0.0 3.2
assign (resid   68 and  name HN   )(resid   67 and  name HB*  ) 1.8 0.0 4.7
assign (resid   68 and  name HN   )(resid   66 and  name HA   ) 1.8 0.0 3.2
assign (resid   68 and  name HN   )(resid   43 and  name HG2* ) 1.8 0.0 5.2 !9
assign (resid   69 and  name HN   )(resid   69 and  name HA   ) 1.8 0.0 1.2 !a-helix
assign (resid   69 and  name HN   )(resid   69 and  name HB1  ) 1.8 0.0 2.7 
assign (resid   69 and  name HN   )(resid   69 and  name HB2  ) 1.8 0.0 2.7
assign (resid   69 and  name HN   )(resid   69 and  name HG*  ) 1.8 0.0 3.7
assign (resid   69 and  name HN   )(resid   66 and  name HA   ) 1.8 0.0 3.2
assign (resid   69 and  name HN   )(resid   68 and  name HA   ) 1.8 0.0 3.2
assign (resid   70 and  name HN   )(resid   70 and  name HA   ) 1.8 0.0 1.2 !a-helix
assign (resid   70 and  name HN   )(resid   70 and  name HB1  ) 1.8 0.0 2.7 
assign (resid   70 and  name HN   )(resid   70 and  name HB2  ) 1.8 0.0 2.7 
assign (resid   70 and  name HN   )(resid   70 and  name HG*  ) 1.8 0.0 4.2
assign (resid   70 and  name HN   )(resid   70 and  name HD1  ) 1.8 0.0 4.2 
assign (resid   70 and  name HN   )(resid   70 and  name HD2  ) 1.8 0.0 3.7
assign (resid   70 and  name HN   )(resid   69 and  name HA   ) 1.8 0.0 3.2 
assign (resid   70 and  name HN   )(resid   66 and  name HA   ) 1.8 0.0 3.2
assign (resid   71 and  name HN   )(resid   71 and  name HA   ) 1.8 0.0 1.2 !a-helix
assign (resid   71 and  name HN   )(resid   71 and  name HB*  ) 1.8 0.0 3.2
assign (resid   71 and  name HN   )(resid   70 and  name HA   ) 1.8 0.0 3.2
assign (resid   71 and  name HN   )(resid   70 and  name HB1  ) 1.8 0.0 4.2 
assign (resid   71 and  name HN   )(resid   70 and  name HB2  ) 1.8 0.0 4.2 
assign (resid   71 and  name HN   )(resid   70 and  name HG*  ) 1.8 0.0 4.2
assign (resid   71 and  name HN   )(resid   68 and  name HA   ) 1.8 0.0 3.2
assign (resid   72 and  name HN   )(resid   72 and  name HA   ) 1.8 0.0 1.2 !a-helix
assign (resid   72 and  name HN   )(resid   72 and  name HB*  ) 1.8 0.0 2.2
assign (resid   72 and  name HN   )(resid   71 and  name HA   ) 1.8 0.0 3.2
assign (resid   72 and  name HN   )(resid   71 and  name HB*  ) 1.8 0.0 3.7
assign (resid   72 and  name HN   )(resid   69 and  name HA   ) 1.8 0.0 3.2
assign (resid   73 and  name HN   )(resid   73 and  name HA   ) 1.8 0.0 1.2 !a-helix
assign (resid   73 and  name HN   )(resid   73 and  name HB*  ) 1.8 0.0 3.2
assign (resid   73 and  name HN   )(resid   72 and  name HA   ) 1.8 0.0 3.2
assign (resid   73 and  name HN   )(resid   71 and  name HA   ) 1.8 0.0 3.2
assign (resid   73 and  name HN   )(resid   72 and  name HB*  ) 1.8 0.0 2.2
assign (resid   74 and  name HN   )(resid   74 and  name HA   ) 1.8 0.0 1.2 !a-helix
assign (resid   74 and  name HN   )(resid   74 and  name HB*  ) 1.8 0.0 2.7
assign (resid   74 and  name HN   )(resid   74 and  name HG*  ) 1.8 0.0 3.7
assign (resid   74 and  name HN   )(resid   73 and  name HB*  ) 1.8 0.0 4.2
assign (resid   74 and  name HN   )(resid   73 and  name HA   ) 1.8 0.0 3.2
assign (resid   74 and  name HN   )(resid   71 and  name HA   ) 1.8 0.0 2.2
assign (resid   75 and  name HN   )(resid   75 and  name HA   ) 1.8 0.0 1.7
assign (resid   75 and  name HN   )(resid   74 and  name HG*  ) 1.8 0.0 4.2
assign (resid   75 and  name HN   )(resid   75 and  name HB*  ) 1.8 0.0 3.2
assign (resid   75 and  name HN   )(resid   74 and  name HA   ) 1.8 0.0 2.7
assign (resid   75 and  name HN   )(resid   72 and  name HA   ) 1.8 0.0 4.7 !3d c13ny
assign (resid   76 and  name HN   )(resid   76 and  name HA1  ) 1.8 0.0 2.2 !a-helix
assign (resid   76 and  name HN   )(resid   76 and  name HA2  ) 1.8 0.0 2.2 !a-helix
assign (resid   76 and  name HN   )(resid   75 and  name HA   ) 1.8 0.0 2.2
assign (resid   76 and  name HN   )(resid   75 and  name HB*  ) 1.8 0.0 4.2
assign (resid   77 and  name HN   )(resid   76 and  name HA2  ) 1.8 0.0 2.7
assign (resid   77 and  name HN   )(resid   76 and  name HA2  ) 1.8 0.0 2.7
assign (resid   78 and  name HN   )(resid   78 and  name HA   ) 1.8 0.0 3.2
assign (resid   78 and  name HN   )(resid   78 and  name HB*  ) 1.8 0.0 4.2
assign (resid   79 and  name HN   )(resid   79 and  name HA   ) 1.8 0.0 3.2
assign (resid   79 and  name HN   )(resid   79 and  name HB*  ) 1.8 0.0 4.2
assign (resid   79 and  name HN   )(resid   78 and  name HA   ) 1.8 0.0 3.2
assign (resid   79 and  name HN   )(resid   78 and  name HB*  ) 1.8 0.0 4.7
assign (resid   80 and  name HN   )(resid   79 and  name HA   ) 1.8 0.0 3.2
!Side to side chain
assign (resid    1 and  name HE*  )(resid    9 and  name HG   ) 1.8 0.0 4.7 !4D
assign (resid    1 and  name HE*  )(resid   56 and  name HB*  ) 1.8 0.0 6.2 !4D
assign (resid    1 and  name HE*  )(resid   58 and  name HG*  ) 1.8 0.0 6.6 !8
assign (resid    1 and  name HE*  )(resid   57 and  name HA   ) 1.8 0.0 4.7 !8
assign (resid    1 and  name HG*  )(resid   37 and  name HE*  ) 1.8 0.0 5.7 !8
assign (resid    1 and  name HG*  )(resid   58 and  name HG*  ) 1.8 0.0 6.6 !8
assign (resid    3 and  name HA   )(resid    3 and  name HB*  ) 1.8 0.0 3.2 !4D
assign (resid    3 and  name HB*  )(resid   25 and  name HG2* ) 1.8 0.0 6.2 !3d 5 
assign (resid    3 and  name HB*  )(resid   25 and  name HD*  ) 1.8 0.0 5.7 !3d 5 
assign (resid    3 and  name HB*  )(resid    7 and  name HB*  ) 1.8 0.0 5.7 !3d 5 
assign (resid    3 and  name HB*  )(resid   28 and  name HG2* ) 1.8 0.0 6.2 !4D
assign (resid    3 and  name HB*  )(resid   37 and  name HE*  ) 1.8 0.0 5.7 !4D 
assign (resid    5 and  name HA   )(resid    5 and  name HB   ) 1.8 0.0 1.7 !4D
assign (resid    5 and  name HA   )(resid    5 and  name HG1* ) 1.8 0.0 4.7 !4D
assign (resid    5 and  name HA   )(resid    5 and  name HG2* ) 1.8 0.0 4.7 !4D
assign (resid    5 and  name HA   )(resid   26 and  name HA   ) 2.5 0.0 3.5 !4D
assign (resid    5 and  name HA   )(resid   28 and  name HA   ) 2.5 0.0 3.5 !4D
assign (resid    5 and  name HA   )(resid   28 and  name HG2* ) 1.8 0.0 4.7 !3d 10%
assign (resid    5 and  name HA   )(resid   25 and  name HG2* ) 1.8 0.0 6.2 !3d 
assign (resid    5 and  name HA   )(resid   25 and  name HD*  ) 2.5 0.0 4.5 !4D
assign (resid    5 and  name HG2* )(resid   27 and  name HA   ) 1.8 0.0 3.7 !4D
assign (resid    5 and  name HG2* )(resid   26 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid    5 and  name HG1* )(resid   28 and  name HG2* ) 1.8 0.0 6.2 !4D from 28G2*
assign (resid    5 and  name HG2* )(resid   28 and  name HG2* ) 1.8 0.0 6.2 !4D
assign (resid    5 and  name HG2* )(resid   25 and  name HG2* ) 1.8 0.0 6.2 !4D
assign (resid    6 and  name HA1  )(resid    5 and  name HG1* ) 1.8 0.0 4.7 !4D
assign (resid    6 and  name HA1  )(resid    5 and  name HG2* ) 1.8 0.0 4.7 !4D
assign (resid    7 and  name HA   )(resid   60 and  name HA   ) 1.8 0.0 1.7 !10 medium AA
assign (resid    7 and  name HB*  )(resid   25 and  name HD*  ) 1.8 0.0 5.7 !10
assign (resid    8 and  name HA   )(resid   24 and  name HA   ) 1.8 0.0 1.2 !3d shorten 10 aa 
assign (resid    8 and  name HA   )(resid    8 and  name HB1  ) 1.8 0.0 2.7 !3d 2
assign (resid    8 and  name HA   )(resid    8 and  name HB2  ) 1.8 0.0 2.7 !3d 2
assign (resid    8 and  name HD*  )(resid   42 and  name HD1* ) 1.8 0.0 5.7 !4D
assign (resid    8 and  name HD*  )(resid   61 and  name HA   ) 1.8 0.0 4.2 !4D
assign (resid    8 and  name HD*  )(resid   61 and  name HB*  ) 1.8 0.0 5.7 !4D
assign (resid    8 and  name HE*  )(resid   61 and  name HA   ) 1.8 0.0 4.2 !4D
assign (resid    8 and  name HE*  )(resid   61 and  name HB*  ) 1.8 0.0 5.2 !4D
assign (resid    8 and  name HE*  )(resid   42 and  name HD1* ) 1.8 0.0 5.2 !4D
assign (resid    8 and  name HE*  )(resid   42 and  name HD2* ) 1.8 0.0 5.2 !4d
assign (resid    8 and  name HE*  )(resid   43 and  name HG1* ) 1.8 0.0 5.2 !4D
assign (resid    8 and  name HE*  )(resid   43 and  name HG2* ) 1.8 0.0 5.2 !4d
assign (resid    9 and  name HB1  )(resid    9 and  name HA   ) 1.8 0.0 4.2 !4D from B
assign (resid    9 and  name HB2  )(resid    9 and  name HA   ) 1.8 0.0 4.2 !4D from B
assign (resid    9 and  name HB1  )(resid    9 and  name HG   ) 1.8 0.0 3.2 !4D
assign (resid    9 and  name HB1  )(resid    9 and  name HD1* ) 1.8 0.0 5.6 !4D
assign (resid    9 and  name HB1  )(resid    9 and  name HD2* ) 1.8 0.0 5.6 !4D
assign (resid    9 and  name HG   )(resid   52 and  name HA   ) 1.8 0.0 4.7 !4d
assign (resid    9 and  name HG   )(resid   52 and  name HB1  ) 1.8 0.0 4.7 !4d
assign (resid    9 and  name HG   )(resid   52 and  name HB2  ) 1.8 0.0 4.7 !4d
assign (resid    9 and  name HG   )(resid   52 and  name HG1  ) 1.8 0.0 4.7 !4d
assign (resid    9 and  name HG   )(resid   52 and  name HG2  ) 1.8 0.0 4.7 !4d
assign (resid    9 and  name HG   )(resid   37 and  name HE*  ) 1.8 0.0 4.2 !4d
assign (resid    9 and  name HG   )(resid   56 and  name HA   ) 1.8 0.0 4.2 !4D
assign (resid    9 and  name HD2* )(resid   23 and  name HB*  ) 1.8 0.0 5.2 !4D
assign (resid    9 and  name HB1  )(resid   23 and  name HB*  ) 1.8 0.0 5.7 !4D
assign (resid    9 and  name HD2* )(resid   52 and  name HG1  ) 1.8 0.0 5.7 !4d
assign (resid    9 and  name HD2* )(resid   52 and  name HG2  ) 1.8 0.0 5.7 !4d
assign (resid    9 and  name HD2* )(resid   52 and  name HB1  ) 1.8 0.0 5.7 !4d
assign (resid    9 and  name HD2* )(resid   52 and  name HB2  ) 1.8 0.0 5.7 !4d
assign (resid   10 and  name HA   )(resid   22 and  name HA   ) 1.8 0.0 1.7 !4D from H22 inc to 3.5 AA
assign (resid   10 and  name HG1* )(resid   10 and  name HB   ) 1.8 0.0 3.7 !4D
assign (resid   10 and  name HG2* )(resid   10 and  name HB   ) 1.8 0.0 3.7 !4D
assign (resid   10 and  name HG1* )(resid   22 and  name HA   ) 1.8 0.0 4.7 !3d 10%
assign (resid   10 and  name HG2* )(resid   22 and  name HA   ) 1.8 0.0 4.7 !3d 10%
assign (resid   10 and  name HG2* )(resid   20 and  name HA   ) 1.8 0.0 4.7 !4d
assign (resid   10 and  name HG2* )(resid   19 and  name HB1  ) 1.8 0.0 4.7 !4d
assign (resid   10 and  name HG2* )(resid   19 and  name HB2  ) 1.8 0.0 4.7 !4d
assign (resid   10 and  name HG1* )(resid   20 and  name HA   ) 1.8 0.0 5.7 !3d 10%
assign (resid   10 and  name HG1* )(resid   59 and  name HG1* ) 1.8 0.0 6.2 !4d
assign (resid   10 and  name HG2* )(resid   59 and  name HG2* ) 1.8 0.0 6.2 !4d
assign (resid   10 and  name HG1* )(resid   57 and  name HG1* ) 1.8 0.0 5.6 !4d
assign (resid   10 and  name HG2* )(resid   57 and  name HB   ) 1.8 0.0 6.2 !4d
assign (resid   10 and  name HG1* )(resid   57 and  name HB   ) 1.8 0.0 6.2 !4d
assign (resid   10 and  name HG2* )(resid   57 and  name HG1* ) 1.8 0.0 6.2 !4d
assign (resid   11 and  name HA   )(resid   11 and  name HB   ) 1.8 0.0 1.7 !4d
assign (resid   20 and  name HB*  )(resid   10 and  name HG1* ) 1.8 0.0 5.7 !4d
assign (resid   22 and  name HA   )(resid   22 and  name HB1  ) 1.8 0.0 4.7 !4D
assign (resid   22 and  name HA   )(resid   22 and  name HB2  ) 1.8 0.0 4.7 !4D
assign (resid   22 and  name HB1  )(resid   10 and  name HG2* ) 1.8 0.0 5.7 !4D
assign (resid   22 and  name HB1  )(resid   10 and  name HA   ) 1.8 0.0 4.2 !4D
assign (resid   23 and  name HA   )(resid   23 and  name HB*  ) 1.8 0.0 2.3 !3d 4D
assign (resid   23 and  name HA   )(resid   41 and  name HA   ) 1.8 0.0 1.7 !3d C13ny aa
assign (resid   23 and  name HA   )(resid   42 and  name HG   ) 1.8 0.0 3.2 !3d 4D
assign (resid   23 and  name HA   )(resid   42 and  name HD2* ) 1.8 0.0 4.7 !3d 10%
assign (resid   23 and  name HA   )(resid   42 and  name HD1* ) 1.8 0.0 4.7 !3d 10%
assign (resid   23 and  name HB*  )(resid   39 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   23 and  name HB*  )(resid   39 and  name HG1* ) 1.8 0.0 4.7 !3d 10%
assign (resid   23 and  name HB*  )(resid   39 and  name HG2* ) 1.8 0.0 6.2 !3d 10%
assign (resid   23 and  name HB*  )(resid   41 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   23 and  name HB*  )(resid   41 and  name HZ3  ) 1.8 0.0 4.7 !4d
assign (resid   23 and  name HB*  )(resid   42 and  name HD2* ) 1.8 0.0 5.2 !4D
assign (resid   23 and  name HB*  )(resid   42 and  name HG   ) 1.8 0.0 4.7 !4D
assign (resid   25 and  name HA   )(resid   25 and  name HG2* ) 1.8 0.0 4.7 !4D
assign (resid   25 and  name HG11 )(resid   25 and  name HD*  ) 1.8 0.0 4.2 !4D
assign (resid   25 and  name HG12 )(resid   25 and  name HG2* ) 1.8 0.0 4.2 !4D
assign (resid   25 and  name HG12 )(resid   25 and  name HD*  ) 1.8 0.0 4.2 !4D
assign (resid   25 and  name HG12 )(resid   25 and  name HD*  ) 1.8 0.0 4.2 !4D
assign (resid   25 and  name HG11 )(resid   25 and  name HG2* ) 1.8 0.0 4.2 !4D
assign (resid   25 and  name HA   )(resid   39 and  name HA   ) 1.8 0.0 1.2 !3d 10 shorten  aa
assign (resid   25 and  name HG11 )(resid   39 and  name HG2* ) 1.8 0.0 5.7 !4D
assign (resid   25 and  name HG12 )(resid   39 and  name HG2* ) 1.8 0.0 5.7 !4D
assign (resid   25 and  name HG2* )(resid   39 and  name HG2* ) 1.8 0.0 6.2 !4D
assign (resid   25 and  name HG2* )(resid   28 and  name HG2* ) 1.8 0.0 6.2 !4D
assign (resid   25 and  name HG2* )(resid    8 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   25 and  name HG2* )(resid   39 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   25 and  name HG2* )(resid   37 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   25 and  name HG2* )(resid   37 and  name HB1  ) 1.8 0.0 4.7 !4D
assign (resid   25 and  name HG2* )(resid   37 and  name HB2  ) 1.8 0.0 4.7 !4D
assign (resid   25 and  name HG2* )(resid   37 and  name HD*  ) 1.8 0.0 5.7 !4D
assign (resid   25 and  name HG2* )(resid   37 and  name HE*  ) 1.8 0.0 6.2 !4D
assign (resid   25 and  name HD*  )(resid   28 and  name HG2* ) 1.8 0.0 6.2 !4D
assign (resid   25 and  name HD*  )(resid   58 and  name HG*  ) 1.8 0.0 7.1 !8
assign (resid   26 and  name HB   )(resid   26 and  name HA   ) 1.8 0.0 1.7 !4d
assign (resid   26 and  name HB   )(resid   26 and  name HG11 ) 1.8 0.0 2.7 !4d
assign (resid   26 and  name HB   )(resid   26 and  name HG12 ) 1.8 0.0 2.7 !4d
assign (resid   26 and  name HB   )(resid   26 and  name HG*  ) 1.8 0.0 4.7 !4d
assign (resid   26 and  name HB   )(resid   26 and  name HD*  ) 1.8 0.0 4.7 !4d
assign (resid   26 and  name HG2* )(resid   26 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   26 and  name HG2* )(resid   39 and  name HA   ) 1.8 0.0 4.7 !3d C13ny
assign (resid   26 and  name HD*  )(resid   39 and  name HA   ) 1.8 0.0 4.7 !3d C13ny
assign (resid   26 and  name HD*  )(resid   39 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   26 and  name HD*  )(resid   47 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   26 and  name HD*  )(resid   47 and  name HG1  ) 1.8 0.0 5.7 !4D
assign (resid   26 and  name HD*  )(resid   47 and  name HG2  ) 1.8 0.0 5.7 !4D
assign (resid   26 and  name HD*  )(resid   47 and  name HB*  ) 1.8 0.0 5.7 !4D
assign (resid   27 and  name HA   )(resid   27 and  name HB*  ) 1.8 0.0 2.7 !4D
assign (resid   27 and  name HA   )(resid   27 and  name HG1  ) 1.8 0.0 2.7 !4D
assign (resid   27 and  name HA   )(resid   27 and  name HG2  ) 1.8 0.0 2.7 !4D
assign (resid   28 and  name HG1* )(resid   28 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   28 and  name HG2* )(resid   28 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   28 and  name HG2* )(resid   28 and  name HB   ) 1.8 0.0 3.2 !4D
assign (resid   28 and  name HG1* )(resid   37 and  name HD*  ) 1.8 0.0 6.1 !3d 10%
assign (resid   28 and  name HG1* )(resid   37 and  name HE*  ) 1.8 0.0 5.1 !3d 10%
assign (resid   28 and  name HG2* )(resid   37 and  name HD*  ) 1.8 0.0 5.1 !3d 10%
assign (resid   28 and  name HG2* )(resid   37 and  name HE*  ) 1.8 0.0 6.1 !3d 10%
assign (resid   28 and  name HG2* )(resid   37 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   28 and  name HG1* )(resid    5 and  name HB   ) 1.8 0.0 4.7 !4D
assign (resid   28 and  name HG2* )(resid    4 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   28 and  name HG1* )(resid    4 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   28 and  name HG1* )(resid   37 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   28 and  name HG1* )(resid   33 and  name HA1  ) 1.8 0.0 5.7 !4D
assign (resid   28 and  name HG1* )(resid   33 and  name HA2  ) 1.8 0.0 5.7 !4D
assign (resid   32 and  name HA   )(resid   32 and  name HB1  ) 1.8 0.0 2.7 !4d from b
assign (resid   32 and  name HA   )(resid   32 and  name HB2  ) 1.8 0.0 2.7 !4d from b
assign (resid   35 and  name HA   )(resid   35 and  name HB1  ) 1.8 0.0 2.7 !4d 
assign (resid   35 and  name HA   )(resid   35 and  name HB2  ) 1.8 0.0 2.7 !4d 
assign (resid   35 and  name HA   )(resid   36 and  name HA   ) 1.8 0.0 3.2 !4d
assign (resid   35 and  name HA   )(resid   37 and  name HD*  ) 1.8 0.0 4.7 !3d c13ny 
assign (resid   35 and  name HA   )(resid   37 and  name HE*  ) 1.8 0.0 4.7 !3d c13ny !
assign (resid   35 and  name HB1  )(resid   36 and  name HA   ) 1.8 0.0 4.2 !4D
assign (resid   35 and  name HB2  )(resid   36 and  name HA   ) 1.8 0.0 4.2 !4D
assign (resid   36 and  name HA   )(resid   36 and  name HB*  ) 1.8 0.0 2.7 !4D
assign (resid   36 and  name HD*  )(resid   49 and  name HG2* ) 1.8 0.0 5.2 !4d
assign (resid   37 and  name HA   )(resid   28 and  name HA   ) 1.8 0.0 3.2 !3d C13ny  aa 
assign (resid   37 and  name HA   )(resid   37 and  name HB1  ) 1.8 0.0 2.7 !3d c13ny
assign (resid   37 and  name HA   )(resid   37 and  name HB2  ) 1.8 0.0 2.7 !3d c13ny
assign (resid   37 and  name HD*  )(resid   28 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   37 and  name HE*  )(resid   28 and  name HA   ) 1.8 0.0 5.2 !4D
assign (resid   37 and  name HE*  )(resid   58 and  name HG*  ) 1.8 0.0 7.0 !8
assign (resid   39 and  name HB   )(resid   39 and  name HA   ) 1.8 0.0 1.7 !4D
assign (resid   39 and  name HB   )(resid   39 and  name HG1* ) 1.8 0.0 4.7 !4D
assign (resid   39 and  name HB   )(resid   39 and  name HG2* ) 1.8 0.0 4.7 !4D
assign (resid   39 and  name HB   )(resid   23 and  name HB*  ) 1.8 0.0 4.7 !4D
assign (resid   39 and  name HB   )(resid   26 and  name HD*  ) 1.8 0.0 4.7 !4D
assign (resid   39 and  name HA   )(resid   39 and  name HG1* ) 1.8 0.0 4.7 !4d
assign (resid   39 and  name HA   )(resid   39 and  name HG2* ) 1.8 0.0 4.7 !4d
assign (resid   39 and  name HG1* )(resid    9 and  name HD2* ) 1.8 0.0 6.7 !4d
assign (resid   39 and  name HG1* )(resid    9 and  name HD1* ) 1.8 0.0 7.7 !4d
assign (resid   39 and  name HG1* )(resid   40 and  name HA   ) 1.8 0.0 4.7 !4d
assign (resid   39 and  name HG1* )(resid   48 and  name HG2* ) 1.8 0.0 6.2 !4d
assign (resid   39 and  name HG1* )(resid   48 and  name HB   ) 1.8 0.0 5.2 !4d
assign (resid   39 and  name HG1* )(resid   38 and  name HA   ) 1.8 0.0 5.2 !4d
assign (resid   39 and  name HG1* )(resid   75 and  name HB*  ) 1.8 0.0 6.2 !4D
assign (resid   39 and  name HG2* )(resid   25 and  name HA   ) 1.8 0.0 4.7 !3d 10%
assign (resid   39 and  name HG2* )(resid   38 and  name HA   ) 1.8 0.0 4.7 !4d
assign (resid   39 and  name HG2* )(resid   37 and  name HA   ) 1.8 0.0 4.7 !4d
assign (resid   39 and  name HG2* )(resid   37 and  name HB1  ) 1.8 0.0 5.7 !3d 10%
assign (resid   39 and  name HG2* )(resid   37 and  name HB2  ) 1.8 0.0 5.7 !3d 10%
assign (resid   39 and  name HG2* )(resid   37 and  name HD*  ) 1.8 0.0 5.7 !4d
assign (resid   41 and  name HA   )(resid   41 and  name HB1  ) 1.8 0.0 2.7 !4d
assign (resid   41 and  name HA   )(resid   41 and  name HB2  ) 1.8 0.0 2.7 !4d
assign (resid   41 and  name HE3  )(resid   41 and  name HA   ) 1.8 0.0 4.2 !4d
assign (resid   41 and  name HH2  )(resid   72 and  name HA   ) 1.8 0.0 4.7 !4d
assign (resid   41 and  name HH2  )(resid   75 and  name HB*  ) 1.8 0.0 4.2 !4d
assign (resid   41 and  name HZ2  )(resid   72 and  name HA   ) 1.8 0.0 4.2 !4d
assign (resid   41 and  name HZ2  )(resid   75 and  name HB*  ) 1.8 0.0 4.7
assign (resid   41 and  name HZ2  )(resid   75 and  name HB*  ) 1.8 0.0 4.2
assign (resid   41 and  name HZ2  )(resid   39 and  name HG1* ) 1.8 0.0 4.7
assign (resid   41 and  name HD1  )(resid   41 and  name HB1  ) 1.8 0.0 4.2 !4D
assign (resid   41 and  name HD1  )(resid   41 and  name HB2  ) 1.8 0.0 4.0 !4d
assign (resid   41 and  name HD1  )(resid   39 and  name HG1* ) 1.8 0.0 4.7 !4D
assign (resid   41 and  name HD1  )(resid   48 and  name HG2* ) 1.8 0.0 4.2 !4D
assign (resid   41 and  name HD1  )(resid   72 and  name HB*  ) 2.5 0.0 4.7 !4D
assign (resid   42 and  name HB1  )(resid   42 and  name HD1* ) 1.8 0.0 4.2 !4D
assign (resid   42 and  name HB2  )(resid   42 and  name HD1* ) 1.8 0.0 4.2 !4D
assign (resid   42 and  name HG   )(resid   42 and  name HD2* ) 1.8 0.0 4.7 !4D
assign (resid   42 and  name HG   )(resid   42 and  name HD1* ) 1.8 0.0 4.7 !4D
assign (resid   42 and  name HD1* )(resid   43 and  name HG1* ) 2.0 0.0 6.2 !4D
assign (resid   42 and  name HD1* )(resid   43 and  name HG2* ) 1.8 0.0 5.2 !4D
assign (resid   42 and  name HD2* )(resid   43 and  name HG1* ) 2.5 0.0 6.2 !4D
assign (resid   42 and  name HD2* )(resid   43 and  name HG2* ) 2.5 0.0 6.2 !4D
assign (resid   42 and  name HD1* )(resid   43 and  name HA   ) 1.8 0.0 6.2 !4D
assign (resid   42 and  name HD2* )(resid   43 and  name HA   ) 1.8 0.0 6.2 !4D
assign (resid   43 and  name HB   )(resid   65 and  name HA   ) 1.8 0.0 5.2 !4D
assign (resid   43 and  name HB   )(resid   43 and  name HA   ) 1.8 0.0 1.7 !4D
assign (resid   43 and  name HB   )(resid   43 and  name HG1* ) 1.8 0.0 3.9 !4D
assign (resid   43 and  name HB   )(resid   43 and  name HG2* ) 1.8 0.0 3.9 !4D
assign (resid   43 and  name HG1* )(resid   44 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   43 and  name HG1* )(resid   65 and  name HA   ) 1.8 0.0 3.7 !4D
assign (resid   43 and  name HG1* )(resid   65 and  name HB*  ) 1.8 0.0 5.2 !3d 10% and 4d
assign (resid   43 and  name HG2* )(resid   65 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   43 and  name HG2* )(resid   65 and  name HB*  ) 1.8 0.0 6.2 !4D
assign (resid   44 and  name HA   )(resid   44 and  name HB1  ) 1.8 0.0 2.7 !4d
assign (resid   46 and  name HA   )(resid   46 and  name HB2  ) 1.8 0.0 2.7 !4d
assign (resid   46 and  name HA   )(resid   46 and  name HB1  ) 1.8 0.0 2.7 !4d
assign (resid   44 and  name HA   )(resid   44 and  name HB2  ) 1.8 0.0 2.7 !4d
assign (resid   47 and  name HG1  )(resid   47 and  name HA   ) 1.8 0.0 2.7 !4D
assign (resid   47 and  name HG2  )(resid   47 and  name HA   ) 1.8 0.0 2.7 !4D
assign (resid   47 and  name HG1  )(resid   47 and  name HB*  ) 1.8 0.0 3.7 !4D
assign (resid   47 and  name HG2  )(resid   47 and  name HB*  ) 1.8 0.0 3.7 !4D
assign (resid   47 and  name HA   )(resid   47 and  name HB*  ) 1.8 0.0 2.7 !4d
assign (resid   47 and  name HA   )(resid   39 and  name HG1* ) 1.8 0.0 4.7 !4d
assign (resid   47 and  name HA   )(resid   48 and  name HG2* ) 1.8 0.0 4.7 !4D
assign (resid   47 and  name HA   )(resid   40 and  name HA   ) 1.8 0.0 1.2 !3d 10 shorten aa
assign (resid   47 and  name HA   )(resid   40 and  name HG*  ) 1.8 0.0 4.2 !4D
assign (resid   47 and  name HG1  )(resid   40 and  name HA   ) 1.8 0.0 4.2 !4D
assign (resid   47 and  name HG2  )(resid   40 and  name HA   ) 1.8 0.0 4.2 !4D
assign (resid   48 and  name HB   )(resid   48 and  name HA   ) 1.8 0.0 1.7 !4D
assign (resid   48 and  name HB   )(resid   38 and  name HG*  ) 1.8 0.0 6.2 !4D
assign (resid   48 and  name HG2* )(resid   72 and  name HB*  ) 1.8 0.0 6.2 !4D
assign (resid   49 and  name HA   )(resid   38 and  name HA   ) 1.8 0.0 1.2 !3d shorten aa
assign (resid   49 and  name HA   )(resid   39 and  name HG1  ) 1.8 0.0 4.7 !4D
assign (resid   49 and  name HB   )(resid   49 and  name HA   ) 1.8 0.0 1.7 !4D
assign (resid   49 and  name HB   )(resid   49 and  name HG2* ) 1.8 0.0 3.2 !4D
assign (resid   51 and  name HA   )(resid   51 and  name HB1  ) 1.8 0.0 2.7 !4d
assign (resid   51 and  name HA   )(resid   51 and  name HB2  ) 1.8 0.0 2.7 !4d
assign (resid   51 and  name HE*  )(resid   49 and  name HB   ) 1.8 0.0 4.7 !4D
assign (resid   51 and  name HE*  )(resid   49 and  name HG2* ) 1.8 0.0 5.7 !4D
assign (resid   51 and  name HE*  )(resid   36 and  name HD*  ) 1.8 0.0 5.2 !4D
assign (resid   51 and  name HD*  )(resid   36 and  name HD*  ) 1.8 0.0 6.2 !4D
assign (resid   51 and  name HE*  )(resid   36 and  name HG*  ) 1.8 0.0 5.2 !4D
assign (resid   51 and  name HD*  )(resid   36 and  name HG*  ) 1.8 0.0 6.2 !4D
assign (resid   51 and  name HD*  )(resid   49 and  name HG2* ) 1.8 0.0 5.7 !4D
assign (resid   52 and  name HA   )(resid   50 and  name HG*  ) 1.8 0.0 5.0 !3d C13ny
assign (resid   52 and  name HA   )(resid   52 and  name HB1  ) 1.8 0.0 2.7 !3d c13ny
assign (resid   52 and  name HA   )(resid   52 and  name HB2  ) 1.8 0.0 2.7 !3d c13ny
assign (resid   52 and  name HA   )(resid   52 and  name HB1  ) 1.8 0.0 2.7 !4d
assign (resid   52 and  name HA   )(resid   52 and  name HB2  ) 1.8 0.0 2.7 !4d
assign (resid   52 and  name HA   )(resid   56 and  name HB*  ) 1.8 0.0 4.7 !4D
assign (resid   52 and  name HG1  )(resid    1 and  name HE*  ) 1.8 0.0 5.7 !4d
assign (resid   52 and  name HD1  )(resid   52 and  name HG1  ) 1.8 0.0 3.7 !4d
assign (resid   52 and  name HD1  )(resid   52 and  name HG2  ) 1.8 0.0 3.7
assign (resid   52 and  name HD2  )(resid   52 and  name HG1  ) 1.8 0.0 3.7
assign (resid   52 and  name HD2  )(resid   52 and  name HG2  ) 1.8 0.0 3.7
assign (resid   54 and  name HA   )(resid   54 and  name HB1  ) 1.8 0.0 2.7 !3d
assign (resid   54 and  name HA   )(resid   54 and  name HB2  ) 1.8 0.0 2.7 !3d
assign (resid   55 and  name HA   )(resid   55 and  name HB1  ) 1.8 0.0 2.7 !4d
assign (resid   55 and  name HA   )(resid   55 and  name HB2  ) 1.8 0.0 2.7 !4d
assign (resid   56 and  name HA   )(resid   11 and  name HA   ) 1.8 0.0 1.2 !4D shorten 10 AA
assign (resid   56 and  name HA   )(resid   56 and  name HB*  ) 1.8 0.0 3.5 !4D
assign (resid   56 and  name HB*  )(resid    9 and  name HG   ) 1.8 0.0 4.7 !4D
assign (resid   56 and  name HB*  )(resid    9 and  name HD2* ) 1.8 0.0 5.6 !4D
assign (resid   56 and  name HB*  )(resid   11 and  name HA   ) 1.8 0.0 4.7 !4d
assign (resid   56 and  name HB*  )(resid   52 and  name HB1  ) 1.8 0.0 5.2 !4d
assign (resid   56 and  name HB*  )(resid   52 and  name HB2  ) 1.8 0.0 5.2 !4d
assign (resid   56 and  name HB*  )(resid   52 and  name HG1  ) 1.8 0.0 6.7 !4d
assign (resid   56 and  name HB*  )(resid   52 and  name HG2  ) 1.8 0.0 6.7 !4d
assign (resid   57 and  name HB   )(resid   57 and  name HA   ) 1.8 0.0 1.7 !4D
assign (resid   57 and  name HB   )(resid   57 and  name HG1* ) 1.8 0.0 4.1 !4D
assign (resid   57 and  name HB   )(resid   57 and  name HG2* ) 1.8 0.0 4.1 !4D
assign (resid   57 and  name HG2* )(resid   56 and  name HA   ) 1.8 0.0 5.6 !4D from 56HA
assign (resid   57 and  name HG1* )(resid   56 and  name HA   ) 1.8 0.0 5.6 !4D from 56HA
assign (resid   58 and  name HA   )(resid    9 and  name HA   ) 1.8 0.0 1.7 !3d C13ny aa 4 (3.2)
assign (resid   58 and  name HA   )(resid   58 and  name HB   ) 1.8 0.0 1.7 !4d
assign (resid   58 and  name HA   )(resid   58 and  name HG*  ) 1.8 0.0 5.6 !4D
assign (resid   58 and  name HB   )(resid   58 and  name HG*  ) 1.8 0.0 5.6 !4d
assign (resid   59 and  name HB   )(resid   59 and  name HA   ) 1.8 0.0 1.7 !4D
assign (resid   59 and  name HB   )(resid   59 and  name HG1* ) 1.8 0.0 3.2 !4D
assign (resid   59 and  name HB   )(resid   59 and  name HG1* ) 1.8 0.0 3.2 !4D
assign (resid   59 and  name HA   )(resid   60 and  name HG2* ) 1.8 0.0 4.7 !4D
assign (resid   59 and  name HB   )(resid   60 and  name HG2* ) 1.8 0.0 4.7 !4D
assign (resid   59 and  name HB   )(resid   64 and  name HB1  ) 1.8 0.0 4.2 !3d c13ny
assign (resid   59 and  name HB   )(resid   64 and  name HB2  ) 1.8 0.0 4.2 !3d c13ny
assign (resid   59 and  name HB   )(resid   63 and  name HB*  ) 1.8 0.0 4.7 !4D
assign (resid   59 and  name HG1* )(resid   10 and  name HA   ) 1.8 0.0 5.2 !4D
assign (resid   59 and  name HG1* )(resid   58 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   59 and  name HG1* )(resid   64 and  name HA   ) 1.8 0.0 4.7 !4D
assign (resid   59 and  name HG1* )(resid   63 and  name HB*  ) 1.8 0.0 5.7 !4D
assign (resid   59 and  name HG1* )(resid   63 and  name HG*  ) 1.8 0.0 6.7 !4D
assign (resid   59 and  name HG1* )(resid   64 and  name HB1  ) 1.8 0.0 5.7 !4D
assign (resid   59 and  name HG1* )(resid   64 and  name HB2  ) 1.8 0.0 5.7 !4D
assign (resid   59 and  name HG2* )(resid   64 and  name HB1  ) 1.8 0.0 5.1 !3d 10%
assign (resid   59 and  name HG2* )(resid   64 and  name HB2  ) 1.8 0.0 5.1 !3d 10%
assign (resid   59 and  name HG2* )(resid   63 and  name HB*  ) 1.8 0.0 4.7 !4D
assign (resid   59 and  name HG2* )(resid   63 and  name HG*  ) 1.8 0.0 5.7 !4D
assign (resid   59 and  name HG2* )(resid   64 and  name HA   ) 1.8 0.0 4.2 !4D
assign (resid   60 and  name HB   )(resid   60 and  name HA   ) 1.8 0.0 1.7 !4D
assign (resid   60 and  name HB   )(resid   60 and  name HG2* ) 1.8 0.0 4.7 !4D
assign (resid   60 and  name HA   )(resid   61 and  name HB*  ) 1.8 0.0 4.7 !3d c13ny
assign (resid   60 and  name HB   )(resid   61 and  name HB*  ) 1.8 0.0 4.7 !3d c13ny
assign (resid   60 and  name HB   )(resid   63 and  name HG*  ) 1.8 0.0 4.2 !4D
assign (resid   60 and  name HG2* )(resid   63 and  name HG*  ) 1.8 0.0 5.5
assign (resid   60 and  name HG2* )(resid   63 and  name HB*  ) 1.8 0.0 5.7
assign (resid   61 and  name HB*  )(resid   62 and  name HA   ) 1.8 0.0 3.7
assign (resid   61 and  name HB*  )(resid   62 and  name HB   ) 1.8 0.0 4.7
assign (resid   61 and  name HB*  )(resid   62 and  name HG2* ) 1.8 0.0 6.2
assign (resid   62 and  name HA   )(resid   62 and  name HB   ) 1.8 0.0 1.7 !4D
assign (resid   62 and  name HA   )(resid   62 and  name HG2* ) 1.8 0.0 4.7 !4D
assign (resid   62 and  name HB   )(resid   62 and  name HG2* ) 1.8 0.0 3.7
assign (resid   62 and  name HA   )(resid   65 and  name HB*  ) 1.8 0.0 4.2 !3d c13ny
assign (resid   62 and  name HB   )(resid   65 and  name HB*  ) 1.8 0.0 4.7
assign (resid   63 and  name HA   )(resid   63 and  name HB*  ) 1.8 0.0 3.7 !4D
assign (resid   63 and  name HA   )(resid   63 and  name HG*  ) 1.8 0.0 4.7
assign (resid   65 and  name HB*  )(resid   65 and  name HA   ) 1.8 0.0 3.2 !4D
assign (resid   65 and  name HB*  )(resid   66 and  name HG2* ) 1.8 0.0 6.2 !4D
assign (resid   65 and  name HB*  )(resid   43 and  name HB   ) 1.8 0.0 5.2 !4D
assign (resid   66 and  name HA   )(resid   66 and  name HB1  ) 1.8 0.0 2.7 !3d c13ny
assign (resid   64 and  name HB1  )(resid   64 and  name HA   ) 1.8 0.0 2.7 !4d
assign (resid   64 and  name HB2  )(resid   64 and  name HA   ) 1.8 0.0 2.7 !4d
assign (resid   66 and  name HA   )(resid   66 and  name HB2  ) 1.8 0.0 2.7 !3d c13ny
assign (resid   66 and  name HA   )(resid   66 and  name HG*  ) 1.8 0.0 4.7 !3d c13ny
assign (resid   66 and  name HG*  )(resid   66 and  name HB*  ) 1.8 0.0 3.7
assign (resid   66 and  name HA   )(resid   69 and  name HB1  ) 1.8 0.0 4.2
assign (resid   66 and  name HA   )(resid   69 and  name HB2  ) 1.8 0.0 4.2
assign (resid   66 and  name HA   )(resid   69 and  name HG*  ) 1.8 0.0 4.2
assign (resid   66 and  name HA   )(resid   69 and  name HD1  ) 1.8 0.0 4.7
assign (resid   66 and  name HA   )(resid   69 and  name HD2  ) 1.8 0.0 4.7
assign (resid   66 and  name HA   )(resid   69 and  name HE*  ) 1.8 0.0 5.7
assign (resid   66 and  name HG*  )(resid   62 and  name HG2* ) 1.8 0.0 5.7
assign (resid   66 and  name HG*  )(resid   62 and  name HB   ) 1.8 0.0 4.2
assign (resid   66 and  name HG*  )(resid   62 and  name HA   ) 1.8 0.0 4.2
assign (resid   67 and  name HB*  )(resid   67 and  name HA   ) 1.8 0.0 3.2
assign (resid   67 and  name HB*  )(resid   64 and  name HA   ) 1.8 0.0 4.2
assign (resid   68 and  name HA   )(resid   68 and  name HB1  ) 1.8 0.0 2.7
assign (resid   68 and  name HA   )(resid   68 and  name HB2  ) 1.8 0.0 2.7
assign (resid   68 and  name HA   )(resid   68 and  name HG1  ) 1.8 0.0 3.2
assign (resid   68 and  name HA   )(resid   68 and  name HG2  ) 1.8 0.0 3.2
assign (resid   68 and  name HA   )(resid   71 and  name HB*  ) 1.8 0.0 4.7 !3d c13ny
assign (resid   69 and  name HA   )(resid   69 and  name HB1  ) 1.8 0.0 2.7
assign (resid   69 and  name HA   )(resid   69 and  name HB2  ) 1.8 0.0 2.7
assign (resid   69 and  name HA   )(resid   69 and  name HG*  ) 1.8 0.0 4.2
assign (resid   69 and  name HA   )(resid   69 and  name HD1  ) 1.8 0.0 3.2
assign (resid   69 and  name HA   )(resid   69 and  name HD2  ) 1.8 0.0 3.2
assign (resid   69 and  name HA   )(resid   69 and  name HB1  ) 1.8 0.0 2.7 !3d c13ny
assign (resid   69 and  name HA   )(resid   69 and  name HB2  ) 1.8 0.0 2.7 !3d c13ny
assign (resid   69 and  name HE1  )(resid   69 and  name HD1  ) 1.8 0.0 2.7 !3d c13ny
assign (resid   69 and  name HE1  )(resid   69 and  name HD2  ) 1.8 0.0 2.7 !3d c13ny
assign (resid   69 and  name HE2  )(resid   69 and  name HD1  ) 1.8 0.0 2.7 !3d c13ny
assign (resid   69 and  name HE2  )(resid   69 and  name HD2  ) 1.8 0.0 2.7 !3d c13ny
assign (resid   69 and  name HA   )(resid   72 and  name HB*  ) 1.8 0.0 4.2 !3d c13ny
assign (resid   70 and  name HA   )(resid   70 and  name HB1  ) 1.8 0.0 2.7 !3d c13ny
assign (resid   70 and  name HA   )(resid   70 and  name HB2  ) 1.8 0.0 2.7 !3d c13ny
assign (resid   70 and  name HA   )(resid   70 and  name HG1  ) 1.8 0.0 3.7 !3d c13ny
assign (resid   70 and  name HA   )(resid   70 and  name HG2  ) 1.8 0.0 3.7
assign (resid   70 and  name HA   )(resid   70 and  name HD1  ) 1.8 0.0 4.7 !3d c13ny
assign (resid   70 and  name HA   )(resid   70 and  name HD2  ) 1.8 0.0 4.7 !3d c13ny
assign (resid   70 and  name HA   )(resid   73 and  name HB*  ) 1.8 0.0 4.7
assign (resid   71 and  name HB*  )(resid   71 and  name HA   ) 1.8 0.0 3.2 !4d
assign (resid   71 and  name HB*  )(resid   72 and  name HB*  ) 1.8 0.0 6.2 !4d
assign (resid   71 and  name HB*  )(resid   74 and  name HB*  ) 1.8 0.0 5.7 !4d
assign (resid   72 and  name HA   )(resid   72 and  name HB*  ) 1.8 0.0 3.2 !4D
assign (resid   72 and  name HB*  )(resid   73 and  name HB*  ) 1.8 0.0 6.2 !3d c13ny
assign (resid   72 and  name HA   )(resid   75 and  name HB*  ) 1.8 0.0 4.7 !3d c13ny
assign (resid   73 and  name HB*  )(resid   70 and  name HB1  ) 1.8 0.0 5.5 !3d c13ny
assign (resid   73 and  name HB*  )(resid   70 and  name HB2  ) 1.8 0.0 5.7 !3d c13ny
assign (resid   74 and  name HA   )(resid   77 and  name HB*  ) 1.8 0.0 4.2 !3d c13ny
assign (resid   74 and  name HA   )(resid   74 and  name HB*  ) 1.8 0.0 2.7
assign (resid   74 and  name HA   )(resid   74 and  name HG*  ) 1.8 0.0 3.2
assign (resid   74 and  name HA   )(resid   74 and  name HD1  ) 1.8 0.0 4.2 !4d
assign (resid   74 and  name HA   )(resid   74 and  name HD2  ) 1.8 0.0 4.2 !4d
assign (resid   74 and  name HG*  )(resid   74 and  name HB*  ) 1.8 0.0 3.7 !3d c13ny
assign (resid   74 and  name HG*  )(resid   74 and  name HD1  ) 1.8 0.0 3.7 !3d c13ny
assign (resid   74 and  name HG*  )(resid   74 and  name HD2  ) 1.8 0.0 3.7 !3d c13ny
assign (resid   75 and  name HB*  )(resid    9 and  name HD2* ) 1.8 0.0 5.6 !4D
assign (resid   75 and  name HB*  )(resid    9 and  name HD1* ) 1.8 0.0 6.6 !4D
assign (resid   75 and  name HB*  )(resid   72 and  name HB*  ) 1.8 0.0 6.2 !4D
assign (resid   77 and  name HB*  )(resid   77 and  name HD2  ) 1.8 0.0 4.2
assign (resid   77 and  name HA   )(resid   77 and  name HB*  ) 1.8 0.0 2.7
assign (resid   78 and  name HB*  )(resid   77 and  name HA   ) 1.8 0.0 4.7
assign (resid   78 and  name HA   )(resid   78 and  name HB*  ) 1.8 0.0 3.2 !4d
assign (resid   79 and  name HA   )(resid   79 and  name HB*  ) 1.8 0.0 3.2
!Long range introduced at #17 file
assign (resid   75 and  name HB*  )(resid   50 and  name HB   ) 1.8 0.0 4.7 !17L
assign (resid   52 and  name HA   )(resid   75 and  name HA   ) 1.8 0.0 3.2 !17L
assign (resid   52 and  name HA   )(resid   75 and  name HB*  ) 1.8 0.0 4.7 !17L
assign (resid   51 and  name HD*  )(resid   79 and  name HB*  ) 1.8 0.0 6.7 !17L
assign (resid   51 and  name HE*  )(resid   79 and  name HB*  ) 1.8 0.0 6.7 !17L
assign (resid   76 and  name HN   )(resid   50 and  name HG*  ) 1.8 0.0 5.6 !17L
assign (resid   76 and  name HA1  )(resid   50 and  name HG*  ) 1.8 0.0 6.6 !17L
assign (resid   76 and  name HA2  )(resid   50 and  name HG*  ) 1.8 0.0 6.6 !17L
assign (resid   76 and  name HA1  )(resid   50 and  name HA   ) 1.8 0.0 4.7 !17L
assign (resid   76 and  name HA2  )(resid   50 and  name HA   ) 1.8 0.0 4.7 !17L
assign (resid   52 and  name HD1  )(resid   50 and  name HG*  ) 1.8 0.0 6.6 !17
assign (resid   52 and  name HD2  )(resid   50 and  name HG*  ) 1.8 0.0 6.6 !17
assign (resid   52 and  name HD1  )(resid   51 and  name HA   ) 1.8 0.0 3.2 !17
assign (resid   52 and  name HD2  )(resid   51 and  name HA   ) 1.8 0.0 3.2 !17
assign (resid   52 and  name HD1  )(resid   52 and  name HG1  ) 1.8 0.0 3.7 !17
assign (resid   52 and  name HD1  )(resid   52 and  name HG2  ) 1.8 0.0 3.7
assign (resid   52 and  name HD2  )(resid   52 and  name HG1  ) 1.8 0.0 3.7
assign (resid   52 and  name HD2  )(resid   52 and  name HG2  ) 1.8 0.0 3.7
assign (resid   39 and  name HG1* )(resid   50 and  name HB   ) 1.8 0.0 4.7 !17

!! DIHEDRAL RESTRAINTS

restraints dihedral reset

!! Phi restraints: minimum deviation = -139 +/- 40 using Ha to HN NOE of its
!!  beta sheets
  !!    2 
 assign (resid   1 and name c )    (resid   2 and name n ) 
        (resid   2 and name ca)    (resid   2 and name c )  1.0 -139.0 40.0 2
  !!    3 
 assign (resid   2 and name c )    (resid   3 and name n ) 
        (resid   3 and name ca)    (resid   3 and name c )  1.0 -139.0 40.0 2
  !!    4 
 assign (resid   3 and name c )    (resid   4 and name n ) 
        (resid   4 and name ca)    (resid   4 and name c )  1.0 -139.0 40.0 2 
 !!    7 
 assign (resid   6 and name c )    (resid   7 and name n ) 
        (resid   7 and name ca)    (resid   7 and name c )  1.0 -139.0 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 -139.0 40.0 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 -139.0 40.0 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 -139.0 40.0 2
  !!    11-talos 
 assign (resid   10 and name c )    (resid   11 and name n ) 
        (resid   11 and name ca)    (resid   11 and name c )  1.0 -139.0 40.0 2
  !!    22 
 assign (resid   21 and name c )    (resid   22 and name n ) 
        (resid   22 and name ca)    (resid   22 and name c )  1.0 -139.0 40.0 2
  !!    23 
 assign (resid   22 and name c )    (resid   23 and name n ) 
        (resid   23 and name ca)    (resid   23 and name c )  1.0 -139.0 40.0 2
  !!    24 
 assign (resid   23 and name c )    (resid   24 and name n ) 
        (resid   24 and name ca)    (resid   24 and name c )  1.0 -139.0 40.0 2
  !!    27-Talos
 assign (resid   26 and name c )    (resid   27 and name n ) 
        (resid   27 and name ca)    (resid   27 and name c )  1.0 -139.0 40.0 2
  !!    28-Talos 
 assign (resid   27 and name c )    (resid   28 and name n ) 
        (resid   28 and name ca)    (resid   28 and name c )  1.0 -139.0 40.0 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 -139.0 40.0 2
  !!    38 
 assign (resid   37 and name c )    (resid   38 and name n ) 
        (resid   38 and name ca)    (resid   38 and name c )  1.0 -139.0 40.0 2
  !!    39
 assign (resid   38 and name c )    (resid   39 and name n ) 
        (resid   39 and name ca)    (resid   39 and name c )  1.0 -139.0 40.0 2
  !!    40 
 assign (resid   39 and name c )    (resid   40 and name n ) 
        (resid   40 and name ca)    (resid   40 and name c )  1.0 -139.0 40.0 2
  !!    42- TURN
 assign (resid   41 and name c )    (resid   42 and name n ) 
        (resid   42 and name ca)    (resid   42 and name c )  1.0 -60.0 40.0 2
  !!    43- TURN
 assign (resid   42 and name c )    (resid   43 and name n ) 
        (resid   43 and name ca)    (resid   43 and name c )  1.0 -60.0 40.0 2
  !!    44-TURN
 assign (resid   43 and name c )    (resid   44 and name n ) 
        (resid   44 and name ca)    (resid   44 and name c )  1.0 -60.0 40.0 2
  !!    46 
 assign (resid   45 and name c )    (resid   46 and name n ) 
        (resid   46 and name ca)    (resid   46 and name c )  1.0 -139.0 40.0 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 -139.0 40.0 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 -139.0 40.0 2
  !!    49 
 assign (resid   48 and name c )    (resid   49 and name n ) 
        (resid   49 and name ca)    (resid   49 and name c )  1.0 -139.0 40.0 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 -139.0 40.0 2
  !!    51- 
 assign (resid   50 and name c )    (resid   51 and name n ) 
        (resid   51 and name ca)    (resid   51 and name c )  1.0 -139.0 40.0 2
  !!    56-Talos
 assign (resid   45 and name c )    (resid   56 and name n ) 
        (resid   56 and name ca)    (resid   56 and name c )  1.0 -139.0 40.0 2
  !!    57 
 assign (resid   56 and name c )    (resid   57 and name n ) 
        (resid   57 and name ca)    (resid   57 and name c )  1.0 -139.0 40.0 2
  !!    58 
 assign (resid   57 and name c )    (resid   58 and name n ) 
        (resid   58 and name ca)    (resid   58 and name c )  1.0 -139.0 40.0 2
  !!    59 
 assign (resid   58 and name c )    (resid   59 and name n ) 
        (resid   59 and name ca)    (resid   59 and name c )  1.0 -139.0 40.0 2
!!    alpha helices -57 +/- 25
  !! 61
 assign (resid   60 and name c )   (resid   61 and name n ) 
        (resid   61 and name ca)   (resid   61 and name c )  1.0 -57.0 25.0 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 -57.0 25.0 2
  !! 63
 assign (resid   62 and name c )   (resid   63 and name n ) 
        (resid   63 and name ca)   (resid   63 and name c )  1.0 -57.0 25.0 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 -57.0 25.0 2
  !! 65
 assign (resid   64 and name c )   (resid   65 and name n ) 
        (resid   65 and name ca)   (resid   65 and name c )  1.0 -57.0 25.0 2
  !! 66
 assign (resid   65 and name c )   (resid   66 and name n ) 
        (resid   66 and name ca)   (resid   66 and name c )  1.0 -57.0 25.0 2
  !! 67
 assign (resid   66 and name c )   (resid   67 and name n ) 
        (resid   67 and name ca)   (resid   67 and name c )  1.0 -57.0 25.0 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 -57.0 25.0 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 -57.0 25.0 2
  !! 70
 assign (resid   69 and name c )   (resid   70 and name n ) 
        (resid   70 and name ca)   (resid   70 and name c )  1.0 -57.0 25.0 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 -57.0 25.0 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 -57.0 25.0 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 -57.0 25.0 2
  !! 74
 assign (resid   73 and name c )   (resid   74 and name n ) 
        (resid   74 and name ca)   (resid   74 and name c )  1.0 -57.0 25.0 2
  !!  PSI restraints 
  !!  B-sheets.
  !! 2
 assign (resid    2 and  name N    ) (resid    2 and  name CA   ) 
        (resid    2 and  name C    ) (resid    3 and  name N    ) 1.0  140.0 40 2
  !! 3
 assign (resid    3 and  name N    ) (resid    3 and  name CA   ) 
        (resid    3 and  name C    ) (resid    4 and  name N    ) 1.0  140.0 40 2
  !! 4
 assign (resid    4 and  name N    ) (resid    4 and  name CA   ) 
        (resid    4 and  name C    ) (resid    5 and  name N    ) 1.0  140.0 40 2
  !! 7
 assign (resid    7 and  name N    ) (resid    7 and  name CA   ) 
        (resid    7 and  name C    ) (resid    8 and  name N    ) 1.0  140.0 40 2
  !! 8
 assign (resid    8 and  name N    ) (resid    8 and  name CA   ) 
        (resid    8 and  name C    ) (resid    9 and  name N    ) 1.0  140.0 40 2
  !! 9
 assign (resid    9 and  name N    ) (resid    9 and  name CA   ) 
        (resid    9 and  name C    ) (resid   10 and  name N    ) 1.0  140.0 40 2
  !! 10
 assign (resid   10 and  name N    ) (resid   10 and  name CA   ) 
        (resid   10 and  name C    ) (resid   11 and  name N    ) 1.0  140.0 40 2
  !! 11-Talos
 assign (resid   11 and  name N    ) (resid   11 and  name CA   ) 
        (resid   11 and  name C    ) (resid   12 and  name N    ) 1.0  140.0 40 2
  !! 22
 assign (resid   22 and  name N    ) (resid   22 and  name CA   ) 
        (resid   22 and  name C    ) (resid   23 and  name N    ) 1.0  140.0 40 2
  !! 23
 assign (resid   23 and  name N    ) (resid   23 and  name CA   ) 
        (resid   23 and  name C    ) (resid   24 and  name N    ) 1.0  140.0 40 2
  !! 24
 assign (resid   24 and  name N    ) (resid   24 and  name CA   ) 
        (resid   24 and  name C    ) (resid   25 and  name N    ) 1.0  140.0 50 2
  !! 27-Talos
 assign (resid   27 and  name N    ) (resid   27 and  name CA   ) 
        (resid   27 and  name C    ) (resid   28 and  name N    ) 1.0  140.0 40 2
  !! 28
 assign (resid   28 and  name N    ) (resid   28 and  name CA   ) 
        (resid   28 and  name C    ) (resid   29 and  name N    ) 1.0  140.0 40 2
  !! 37
 assign (resid   37 and  name N    ) (resid   37 and  name CA   ) 
        (resid   37 and  name C    ) (resid   38 and  name N    ) 1.0  140.0 40 2
  !! 38
 assign (resid   38 and  name N    ) (resid   38 and  name CA   ) 
        (resid   38 and  name C    ) (resid   39 and  name N    ) 1.0  140.0 40 2
  !! 39
 assign (resid   39 and  name N    ) (resid   39 and  name CA   ) 
        (resid   39 and  name C    ) (resid   40 and  name N    ) 1.0  140.0 40 2
  !! 40
 assign (resid   40 and  name N    ) (resid   40 and  name CA   ) 
        (resid   40 and  name C    ) (resid   41 and  name N    ) 1.0  140.0 40 2
  !! 42- TURN
 assign (resid   42 and  name N    ) (resid   42 and  name CA   ) 
        (resid   42 and  name C    ) (resid   43 and  name N    ) 1.0  -40.0 50 2
  !! 43- TURN
 assign (resid   43 and  name N    ) (resid   43 and  name CA   ) 
        (resid   43 and  name C    ) (resid   44 and  name N    ) 1.0  -40.0 50 2
  !! 44- TURN
 assign (resid   44 and  name N    ) (resid   44 and  name CA   ) 
        (resid   44 and  name C    ) (resid   45 and  name N    ) 1.0  -40.0 50 2
  !! 46
 assign (resid   46 and  name N    ) (resid   46 and  name CA   ) 
        (resid   46 and  name C    ) (resid   47 and  name N    ) 1.0  140.0 40 2
  !! 47
 assign (resid   47 and  name N    ) (resid   47 and  name CA   ) 
        (resid   47 and  name C    ) (resid   48 and  name N    ) 1.0  140.0 40 2
  !! 48
 assign (resid   48 and  name N    ) (resid   48 and  name CA   ) 
        (resid   48 and  name C    ) (resid   49 and  name N    ) 1.0  140.0 40 2
  !! 49
 assign (resid   49 and  name N    ) (resid   49 and  name CA   ) 
        (resid   49 and  name C    ) (resid   50 and  name N    ) 1.0  140.0 40 2
  !! 50
 assign (resid   50 and  name N    ) (resid   50 and  name CA   ) 
        (resid   50 and  name C    ) (resid   51 and  name N    ) 1.0  140.0 40 2
  !! 51-
 assign (resid   51 and  name N    ) (resid   51 and  name CA   ) 
        (resid   51 and  name C    ) (resid   52 and  name N    ) 1.0  140.0 40 2
  !! 56-Talos
 assign (resid   56 and  name N    ) (resid   56 and  name CA   ) 
        (resid   56 and  name C    ) (resid   57 and  name N    ) 1.0  140.0 40 2
  !! 57
 assign (resid   57 and  name N    ) (resid   57 and  name CA   ) 
        (resid   57 and  name C    ) (resid   58 and  name N    ) 1.0  140.0 40 2
  !! 58
 assign (resid   58 and  name N    ) (resid   58 and  name CA   ) 
        (resid   58 and  name C    ) (resid   59 and  name N    ) 1.0  140.0 40 2
  !! 59
 assign (resid   59 and  name N    ) (resid   59 and  name CA   ) 
        (resid   59 and  name C    ) (resid   60 and  name N    ) 1.0  140.0 40 2
!!  a-helices
 !! 61
 assign (resid   61 and  name N    ) (resid   61 and  name CA   ) 
        (resid   61 and  name C    ) (resid   62 and  name N    ) 1.0 -47.0 30 2
 !! 62
 assign (resid   62 and  name N    ) (resid   62 and  name CA   ) 
        (resid   62 and  name C    ) (resid   63 and  name N    ) 1.0 -47.0 30 2
 !! 63
 assign (resid   63 and  name N    ) (resid   63 and  name CA   ) 
        (resid   63 and  name C    ) (resid   64 and  name N    ) 1.0 -47.0 30 2
 !! 64
 assign (resid   64 and  name N    ) (resid   64 and  name CA   ) 
        (resid   64 and  name C    ) (resid   65 and  name N    ) 1.0 -47.0 30 2
 !! 65
 assign (resid   65 and  name N    ) (resid   65 and  name CA   ) 
        (resid   65 and  name C    ) (resid   66 and  name N    ) 1.0 -47.0 30 2
 !! 66
 assign (resid   66 and  name N    ) (resid   66 and  name CA   ) 
        (resid   66 and  name C    ) (resid   67 and  name N    ) 1.0 -47.0 30 2
 !! 67
 assign (resid   67 and  name N    ) (resid   67 and  name CA   ) 
        (resid   67 and  name C    ) (resid   68 and  name N    ) 1.0 -47.0 30 2
 !! 68
 assign (resid   68 and  name N    ) (resid   68 and  name CA   ) 
        (resid   68 and  name C    ) (resid   69 and  name N    ) 1.0 -47.0 30 2
 !! 69
 assign (resid   69 and  name N    ) (resid   69 and  name CA   ) 
        (resid   69 and  name C    ) (resid   70 and  name N    ) 1.0 -47.0 30 2
 !! 70
 assign (resid   70 and  name N    ) (resid   70 and  name CA   ) 
        (resid   70 and  name C    ) (resid   71 and  name N    ) 1.0 -47.0 30 2
 !! 71
 assign (resid   71 and  name N    ) (resid   71 and  name CA   ) 
        (resid   71 and  name C    ) (resid   72 and  name N    ) 1.0 -47.0 30 2
 !! 72
 assign (resid   72 and  name N    ) (resid   72 and  name CA   ) 
        (resid   72 and  name C    ) (resid   73 and  name N    ) 1.0 -47.0 30 2
 !! 73
 assign (resid   73 and  name N    ) (resid   73 and  name CA   ) 
        (resid   73 and  name C    ) (resid   74 and  name N    ) 1.0 -47.0 30 2
 !! 74
 assign (resid   74 and  name N    ) (resid   74 and  name CA   ) 
        (resid   74 and  name C    ) (resid   75 and  name N    ) 1.0 -47.0 30 2
END


























































































































































































  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    MET   1           H        MET   1   8.773   2.048   0.146
    2    HA   MET   1           HA       MET   1   6.630   1.075  -0.247
    3   1HB   MET   1          1HB       MET   1   6.650   1.596  -2.705
    4   2HB   MET   1          2HB       MET   1   7.766   0.260  -2.937
    5   1HG   MET   1          1HG       MET   1   5.098  -0.168  -1.655
    6   2HG   MET   1          2HG       MET   1   5.264  -0.094  -3.405
    7   1HE   MET   1          1HE       MET   1   4.204  -2.501  -3.634
    8   2HE   MET   1          2HE       MET   1   4.015  -2.588  -1.882
    9   3HE   MET   1          3HE       MET   1   4.780  -3.917  -2.754
   10    H    HIS   2           H        HIS   2   6.471  -0.836   0.774
   11    HA   HIS   2           HA       HIS   2   8.677  -2.768   0.474
   12   1HB   HIS   2          1HB       HIS   2   8.856  -1.524   2.643
   13   2HB   HIS   2          2HB       HIS   2   7.262  -2.129   3.078
   14    HD1  HIS   2           HD1      HIS   2  10.851  -3.141   2.823
   15    HD2  HIS   2           HD2      HIS   2   7.189  -4.864   3.811
   16    HE1  HIS   2           HE1      HIS   2  11.401  -5.331   3.927
   17    HE2  HIS   2           HE2      HIS   2   9.179  -6.428   4.367
   18    H    ALA   3           H        ALA   3   8.025  -4.801   0.067
   19    HA   ALA   3           HA       ALA   3   5.127  -5.165  -0.183
   20   1HB   ALA   3          1HB       ALA   3   7.366  -6.736  -1.450
   21   2HB   ALA   3          2HB       ALA   3   6.482  -5.413  -2.210
   22   3HB   ALA   3          3HB       ALA   3   5.643  -6.906  -1.789
   23    H    LYS   4           H        LYS   4   4.238  -7.309   0.202
   24    HA   LYS   4           HA       LYS   4   5.688  -9.041   2.027
   25   1HB   LYS   4          1HB       LYS   4   4.570  -7.359   3.482
   26   2HB   LYS   4          2HB       LYS   4   3.024  -7.806   2.777
   27   1HG   LYS   4          1HG       LYS   4   3.217 -10.040   3.694
   28   2HG   LYS   4          2HG       LYS   4   4.813  -9.656   4.341
   29   1HD   LYS   4          1HD       LYS   4   2.236  -8.286   5.109
   30   2HD   LYS   4          2HD       LYS   4   3.062  -9.519   6.064
   31   1HE   LYS   4          1HE       LYS   4   4.987  -8.076   6.317
   32   2HE   LYS   4          2HE       LYS   4   4.251  -6.865   5.267
   33   1HZ   LYS   4          1HZ       LYS   4   4.072  -6.450   7.720
   34   2HZ   LYS   4          2HZ       LYS   4   3.002  -7.758   7.803
   35   3HZ   LYS   4          3HZ       LYS   4   2.608  -6.400   6.872
   36    H    VAL   5           H        VAL   5   4.826 -11.153   2.071
   37    HA   VAL   5           HA       VAL   5   3.196 -11.771  -0.254
   38    HB   VAL   5           HB       VAL   5   5.182 -13.135   0.094
   39   1HG1  VAL   5          1HG1      VAL   5   3.946 -13.951   2.719
   40   2HG1  VAL   5          2HG1      VAL   5   5.376 -12.940   2.512
   41   3HG1  VAL   5          3HG1      VAL   5   5.413 -14.632   2.016
   42   1HG2  VAL   5          1HG2      VAL   5   2.664 -14.706   0.625
   43   2HG2  VAL   5          2HG2      VAL   5   4.185 -15.377   0.035
   44   3HG2  VAL   5          3HG2      VAL   5   3.283 -14.227  -0.955
   45    H    GLY   6           H        GLY   6   1.213 -12.768  -0.217
   46   1HA   GLY   6          1HA       GLY   6  -0.723 -13.669   0.789
   47   2HA   GLY   6          2HA       GLY   6  -0.078 -13.235   2.370
   48    H    ASP   7           H        ASP   7   0.402 -10.752   0.257
   49    HA   ASP   7           HA       ASP   7  -2.095  -9.371   1.141
   50   1HB   ASP   7          1HB       ASP   7   0.761  -8.399   1.147
   51   2HB   ASP   7          2HB       ASP   7  -0.579  -7.265   1.013
   52    H    TYR   8           H        TYR   8  -2.357  -7.308  -0.255
   53    HA   TYR   8           HA       TYR   8  -2.071  -8.266  -3.014
   54   1HB   TYR   8          1HB       TYR   8  -4.235  -6.577  -1.758
   55   2HB   TYR   8          2HB       TYR   8  -4.130  -6.932  -3.482
   56    HD1  TYR   8           HD1      TYR   8  -4.389  -9.270  -4.268
   57    HD2  TYR   8           HD2      TYR   8  -5.105  -8.188  -0.223
   58    HE1  TYR   8           HE1      TYR   8  -5.626 -11.369  -3.940
   59    HE2  TYR   8           HE2      TYR   8  -6.348 -10.287   0.116
   60    HH   TYR   8           HH       TYR   8  -6.177 -12.864  -1.974
   61    H    LEU   9           H        LEU   9  -1.599  -6.875  -4.645
   62    HA   LEU   9           HA       LEU   9  -0.084  -4.522  -3.809
   63   1HB   LEU   9          1HB       LEU   9   1.068  -6.308  -5.082
   64   2HB   LEU   9          2HB       LEU   9  -0.043  -6.061  -6.411
   65    HG   LEU   9           HG       LEU   9   1.605  -3.744  -5.492
   66   1HD1  LEU   9          1HD1      LEU   9   3.195  -5.597  -5.632
   67   2HD1  LEU   9          2HD1      LEU   9   3.431  -4.454  -6.955
   68   3HD1  LEU   9          3HD1      LEU   9   2.605  -5.985  -7.250
   69   1HD2  LEU   9          1HD2      LEU   9  -0.101  -3.441  -7.225
   70   2HD2  LEU   9          2HD2      LEU   9   0.664  -4.697  -8.197
   71   3HD2  LEU   9          3HD2      LEU   9   1.521  -3.191  -7.870
   72    H    VAL  10           H        VAL  10  -0.496  -2.559  -4.538
   73    HA   VAL  10           HA       VAL  10  -2.654  -2.108  -6.490
   74    HB   VAL  10           HB       VAL  10  -2.195  -0.682  -3.855
   75   1HG1  VAL  10          1HG1      VAL  10  -4.057   0.123  -6.088
   76   2HG1  VAL  10          2HG1      VAL  10  -2.612   0.996  -5.574
   77   3HG1  VAL  10          3HG1      VAL  10  -3.990   0.852  -4.483
   78   1HG2  VAL  10          1HG2      VAL  10  -3.525  -2.685  -3.706
   79   2HG2  VAL  10          2HG2      VAL  10  -4.569  -2.116  -5.007
   80   3HG2  VAL  10          3HG2      VAL  10  -4.540  -1.263  -3.464
   81    H    VAL  11           H        VAL  11  -2.350  -0.258  -7.797
   82    HA   VAL  11           HA       VAL  11   0.114   1.287  -7.382
   83    HB   VAL  11           HB       VAL  11  -0.857   0.143 -10.015
   84   1HG1  VAL  11          1HG1      VAL  11   1.431   2.043  -9.518
   85   2HG1  VAL  11          2HG1      VAL  11  -0.075   2.422 -10.355
   86   3HG1  VAL  11          3HG1      VAL  11   1.053   1.260 -11.053
   87   1HG2  VAL  11          1HG2      VAL  11   1.707  -0.274  -8.488
   88   2HG2  VAL  11          2HG2      VAL  11   1.325  -0.957 -10.068
   89   3HG2  VAL  11          3HG2      VAL  11   0.391  -1.436  -8.651
   90    H    LYS  12           H        LYS  12  -0.045   3.464  -8.046
   91    HA   LYS  12           HA       LYS  12  -0.942   5.392  -8.856
   92   1HB   LYS  12          1HB       LYS  12  -3.252   3.656  -9.731
   93   2HB   LYS  12          2HB       LYS  12  -3.117   5.375 -10.072
   94   1HG   LYS  12          1HG       LYS  12  -1.219   5.036 -11.453
   95   2HG   LYS  12          2HG       LYS  12  -1.069   3.356 -10.939
   96   1HD   LYS  12          1HD       LYS  12  -2.048   3.298 -13.088
   97   2HD   LYS  12          2HD       LYS  12  -3.351   2.972 -11.950
   98   1HE   LYS  12          1HE       LYS  12  -2.801   5.716 -13.052
   99   2HE   LYS  12          2HE       LYS  12  -3.859   4.565 -13.859
  100   1HZ   LYS  12          1HZ       LYS  12  -5.169   6.027 -12.531
  101   2HZ   LYS  12          2HZ       LYS  12  -4.231   5.734 -11.153
  102   3HZ   LYS  12          3HZ       LYS  12  -5.204   4.495 -11.793
  103    H    GLY  13           H        GLY  13  -1.827   7.010  -7.781
  104   1HA   GLY  13          1HA       GLY  13  -3.408   8.231  -6.661
  105   2HA   GLY  13          2HA       GLY  13  -4.454   6.827  -6.688
  106    H    THR  14           H        THR  14  -1.333   7.649  -5.102
  107    HA   THR  14           HA       THR  14  -2.026   6.212  -2.745
  108    HB   THR  14           HB       THR  14  -0.096   7.505  -1.710
  109    HG1  THR  14           HG1      THR  14   0.624   8.255  -4.330
  110   1HG2  THR  14          1HG2      THR  14   0.437   5.971  -4.254
  111   2HG2  THR  14          2HG2      THR  14   0.171   5.267  -2.659
  112   3HG2  THR  14          3HG2      THR  14   1.597   6.260  -2.958
  113    H    THR  15           H        THR  15  -2.821   9.332  -3.904
  114    HA   THR  15           HA       THR  15  -3.335  10.654  -1.458
  115    HB   THR  15           HB       THR  15  -4.900  11.120  -3.991
  116    HG1  THR  15           HG1      THR  15  -2.237  12.002  -3.396
  117   1HG2  THR  15          1HG2      THR  15  -4.796  13.461  -3.269
  118   2HG2  THR  15          2HG2      THR  15  -3.841  12.989  -1.862
  119   3HG2  THR  15          3HG2      THR  15  -5.513  12.446  -2.016
  120    H    THR  16           H        THR  16  -4.826   8.061  -3.014
  121    HA   THR  16           HA       THR  16  -6.536   6.710  -2.441
  122    HB   THR  16           HB       THR  16  -7.145   8.616  -0.176
  123    HG1  THR  16           HG1      THR  16  -4.991   7.585  -0.212
  124   1HG2  THR  16          1HG2      THR  16  -8.282   6.678   0.817
  125   2HG2  THR  16          2HG2      THR  16  -7.926   5.730  -0.627
  126   3HG2  THR  16          3HG2      THR  16  -9.009   7.118  -0.729
  127    H    GLU  17           H        GLU  17  -7.356   7.331  -4.441
  128    HA   GLU  17           HA       GLU  17 -10.083   8.259  -4.182
  129   1HB   GLU  17          1HB       GLU  17  -8.650  10.270  -4.847
  130   2HB   GLU  17          2HB       GLU  17  -8.307   9.422  -6.345
  131   1HG   GLU  17          1HG       GLU  17 -11.101  10.080  -5.451
  132   2HG   GLU  17          2HG       GLU  17 -10.120  11.178  -6.414
  133    H    ARG  18           H        ARG  18  -7.638   7.465  -6.632
  134    HA   ARG  18           HA       ARG  18  -9.340   5.218  -7.460
  135   1HB   ARG  18          1HB       ARG  18  -8.522   5.555  -9.770
  136   2HB   ARG  18          2HB       ARG  18  -9.430   6.935  -9.171
  137   1HG   ARG  18          1HG       ARG  18  -7.213   8.004  -8.624
  138   2HG   ARG  18          2HG       ARG  18  -6.457   6.692  -9.527
  139   1HD   ARG  18          1HD       ARG  18  -6.666   8.475 -11.051
  140   2HD   ARG  18          2HD       ARG  18  -7.957   7.346 -11.461
  141    HE   ARG  18           HE       ARG  18  -9.061   9.151  -9.680
  142   1HH1  ARG  18          1HH1      ARG  18  -7.611   9.257 -12.874
  143   2HH1  ARG  18          2HH1      ARG  18  -8.469  10.691 -13.346
  144   1HH2  ARG  18          1HH2      ARG  18 -10.171  11.018 -10.299
  145   2HH2  ARG  18          2HH2      ARG  18  -9.918  11.702 -11.876
  146    H    HIS  19           H        HIS  19  -8.386   3.489  -6.625
  147    HA   HIS  19           HA       HIS  19  -5.465   3.224  -6.824
  148   1HB   HIS  19          1HB       HIS  19  -7.521   1.897  -5.074
  149   2HB   HIS  19          2HB       HIS  19  -5.952   1.149  -5.337
  150    HD1  HIS  19           HD1      HIS  19  -3.891   3.065  -4.826
  151    HD2  HIS  19           HD2      HIS  19  -7.523   3.369  -2.827
  152    HE1  HIS  19           HE1      HIS  19  -3.394   4.320  -2.708
  153    HE2  HIS  19           HE2      HIS  19  -5.550   4.262  -1.405
  154    H    ASP  20           H        ASP  20  -4.774   2.173  -8.567
  155    HA   ASP  20           HA       ASP  20  -6.540   0.141  -9.749
  156   1HB   ASP  20          1HB       ASP  20  -4.433   1.897 -11.019
  157   2HB   ASP  20          2HB       ASP  20  -5.164   0.530 -11.847
  158    H    GLN  21           H        GLN  21  -4.783  -1.044 -11.435
  159    HA   GLN  21           HA       GLN  21  -3.582  -2.966 -11.479
  160   1HB   GLN  21          1HB       GLN  21  -1.569  -1.147 -10.162
  161   2HB   GLN  21          2HB       GLN  21  -1.211  -2.584 -11.115
  162   1HG   GLN  21          1HG       GLN  21  -2.392  -1.474 -13.035
  163   2HG   GLN  21          2HG       GLN  21  -2.434  -0.008 -12.063
  164   1HE2  GLN  21          1HE2      GLN  21   0.230  -2.282 -12.066
  165   2HE2  GLN  21          2HE2      GLN  21   1.364  -1.238 -12.857
  166    H    HIS  22           H        HIS  22  -4.690  -4.341 -10.159
  167    HA   HIS  22           HA       HIS  22  -3.765  -4.587  -7.366
  168   1HB   HIS  22          1HB       HIS  22  -6.459  -4.669  -8.601
  169   2HB   HIS  22          2HB       HIS  22  -6.149  -5.825  -7.320
  170    HD1  HIS  22           HD1      HIS  22  -6.169  -2.081  -7.899
  171    HD2  HIS  22           HD2      HIS  22  -6.472  -4.855  -4.824
  172    HE1  HIS  22           HE1      HIS  22  -6.906  -0.772  -5.888
  173    HE2  HIS  22           HE2      HIS  22  -7.270  -2.508  -4.096
  174    H    ALA  23           H        ALA  23  -3.273  -6.604  -6.605
  175    HA   ALA  23           HA       ALA  23  -4.388  -9.026  -7.616
  176   1HB   ALA  23          1HB       ALA  23  -2.425 -10.085  -8.556
  177   2HB   ALA  23          2HB       ALA  23  -1.503  -8.595  -8.361
  178   3HB   ALA  23          3HB       ALA  23  -2.859  -8.653  -9.488
  179    H    GLU  24           H        GLU  24  -3.049 -10.975  -6.742
  180    HA   GLU  24           HA       GLU  24  -2.305 -10.259  -3.995
  181   1HB   GLU  24          1HB       GLU  24  -3.979 -12.028  -4.178
  182   2HB   GLU  24          2HB       GLU  24  -2.892 -12.979  -5.184
  183   1HG   GLU  24          1HG       GLU  24  -1.354 -13.252  -3.352
  184   2HG   GLU  24          2HG       GLU  24  -2.305 -12.170  -2.341
  185    H    ILE  25           H        ILE  25  -0.323 -10.252  -3.321
  186    HA   ILE  25           HA       ILE  25   1.819 -11.224  -5.028
  187    HB   ILE  25           HB       ILE  25   2.113  -9.964  -2.299
  188   1HG1  ILE  25          1HG1      ILE  25   2.041  -8.535  -4.969
  189   2HG1  ILE  25          2HG1      ILE  25   0.751  -8.489  -3.772
  190   1HG2  ILE  25          1HG2      ILE  25   4.076 -11.079  -3.219
  191   2HG2  ILE  25          2HG2      ILE  25   4.314  -9.333  -3.146
  192   3HG2  ILE  25          3HG2      ILE  25   3.950 -10.109  -4.687
  193   1HD1  ILE  25          1HD1      ILE  25   3.555  -7.469  -3.373
  194   2HD1  ILE  25          2HD1      ILE  25   2.251  -7.408  -2.187
  195   3HD1  ILE  25          3HD1      ILE  25   2.124  -6.484  -3.684
  196    H    ILE  26           H        ILE  26   1.954 -13.390  -4.919
  197    HA   ILE  26           HA       ILE  26   2.031 -14.664  -2.272
  198    HB   ILE  26           HB       ILE  26   1.558 -16.762  -3.266
  199   1HG1  ILE  26          1HG1      ILE  26   3.022 -16.519  -5.284
  200   2HG1  ILE  26          2HG1      ILE  26   1.443 -17.195  -5.656
  201   1HG2  ILE  26          1HG2      ILE  26  -0.573 -16.345  -4.460
  202   2HG2  ILE  26          2HG2      ILE  26  -0.131 -14.646  -4.623
  203   3HG2  ILE  26          3HG2      ILE  26  -0.397 -15.337  -3.023
  204   1HD1  ILE  26          1HD1      ILE  26   2.164 -15.609  -7.344
  205   2HD1  ILE  26          2HD1      ILE  26   2.290 -14.348  -6.117
  206   3HD1  ILE  26          3HD1      ILE  26   0.717 -15.040  -6.513
  207    H    GLU  27           H        GLU  27   3.912 -13.758  -4.956
  208    HA   GLU  27           HA       GLU  27   6.258 -15.047  -3.764
  209   1HB   GLU  27          1HB       GLU  27   5.457 -15.032  -6.669
  210   2HB   GLU  27          2HB       GLU  27   7.124 -15.272  -6.168
  211   1HG   GLU  27          1HG       GLU  27   4.821 -17.001  -5.297
  212   2HG   GLU  27          2HG       GLU  27   5.892 -17.365  -6.649
  213    H    VAL  28           H        VAL  28   7.458 -13.435  -3.046
  214    HA   VAL  28           HA       VAL  28   7.386 -10.878  -4.472
  215    HB   VAL  28           HB       VAL  28   8.601 -11.477  -1.769
  216   1HG1  VAL  28          1HG1      VAL  28   7.914  -8.865  -3.111
  217   2HG1  VAL  28          2HG1      VAL  28   9.535  -9.504  -2.843
  218   3HG1  VAL  28          3HG1      VAL  28   8.529  -9.046  -1.469
  219   1HG2  VAL  28          1HG2      VAL  28   6.601 -10.440  -0.818
  220   2HG2  VAL  28          2HG2      VAL  28   6.201 -11.893  -1.732
  221   3HG2  VAL  28          3HG2      VAL  28   5.904 -10.301  -2.431
  222    H    ARG  29           H        ARG  29   8.958 -10.528  -5.909
  223    HA   ARG  29           HA       ARG  29  11.442 -12.031  -5.759
  224   1HB   ARG  29          1HB       ARG  29   9.981 -10.555  -7.847
  225   2HB   ARG  29          2HB       ARG  29  11.730 -10.413  -7.933
  226   1HG   ARG  29          1HG       ARG  29  10.274 -13.046  -7.805
  227   2HG   ARG  29          2HG       ARG  29  10.736 -12.250  -9.309
  228   1HD   ARG  29          1HD       ARG  29  12.457 -13.793  -8.893
  229   2HD   ARG  29          2HD       ARG  29  13.110 -12.238  -8.392
  230    HE   ARG  29           HE       ARG  29  12.131 -14.327  -6.550
  231   1HH1  ARG  29          1HH1      ARG  29  14.228 -11.607  -7.263
  232   2HH1  ARG  29          2HH1      ARG  29  15.019 -11.653  -5.714
  233   1HH2  ARG  29          1HH2      ARG  29  13.198 -14.419  -4.545
  234   2HH2  ARG  29          2HH2      ARG  29  14.442 -13.262  -4.175
  235    H    SER  30           H        SER  30  10.909 -10.023  -3.762
  236    HA   SER  30           HA       SER  30  13.405  -8.573  -4.025
  237   1HB   SER  30          1HB       SER  30  11.703  -7.005  -4.923
  238   2HB   SER  30          2HB       SER  30  10.798  -7.144  -3.418
  239    HG   SER  30           HG       SER  30  12.974  -5.614  -4.005
  240    H    ALA  31           H        ALA  31  14.296  -8.027  -2.008
  241    HA   ALA  31           HA       ALA  31  13.208  -9.547   0.214
  242   1HB   ALA  31          1HB       ALA  31  15.272  -8.946   1.364
  243   2HB   ALA  31          2HB       ALA  31  15.702  -7.853   0.049
  244   3HB   ALA  31          3HB       ALA  31  15.615  -9.591  -0.240
  245    H    ASP  32           H        ASP  32  12.941  -6.429  -1.017
  246    HA   ASP  32           HA       ASP  32  11.956  -5.431   1.562
  247   1HB   ASP  32          1HB       ASP  32  14.072  -4.372   1.331
  248   2HB   ASP  32          2HB       ASP  32  13.792  -4.019  -0.370
  249    H    GLY  33           H        GLY  33  12.127  -4.170  -1.786
  250   1HA   GLY  33          1HA       GLY  33   9.395  -4.411  -2.346
  251   2HA   GLY  33          2HA       GLY  33   9.649  -2.849  -1.585
  252    H    SER  34           H        SER  34  10.757  -4.885  -4.244
  253    HA   SER  34           HA       SER  34  10.771  -2.550  -5.966
  254   1HB   SER  34          1HB       SER  34  13.021  -3.212  -6.894
  255   2HB   SER  34          2HB       SER  34  13.067  -2.567  -5.254
  256    HG   SER  34           HG       SER  34  13.723  -5.066  -6.188
  257    HA   PRO  35           HA       PRO  35   8.831  -5.555  -8.647
  258   1HB   PRO  35          1HB       PRO  35   9.632  -3.663 -10.780
  259   2HB   PRO  35          2HB       PRO  35   8.025  -4.261 -10.353
  260   1HG   PRO  35          1HG       PRO  35   8.756  -1.754  -9.790
  261   2HG   PRO  35          2HG       PRO  35   7.741  -2.688  -8.677
  262   1HD   PRO  35          1HD       PRO  35  10.670  -2.085  -8.520
  263   2HD   PRO  35          2HD       PRO  35   9.452  -2.110  -7.227
  264    HA   PRO  36           HA       PRO  36   8.333  -6.336 -10.725
  265   1HB   PRO  36          1HB       PRO  36   8.343  -8.721 -11.914
  266   2HB   PRO  36          2HB       PRO  36   8.973  -7.289 -12.735
  267   1HG   PRO  36          1HG       PRO  36  10.452  -9.509 -11.396
  268   2HG   PRO  36          2HG       PRO  36  10.841  -8.641 -12.891
  269   1HD   PRO  36          1HD       PRO  36  11.956  -8.129 -10.392
  270   2HD   PRO  36          2HD       PRO  36  11.968  -7.015 -11.772
  271    H    TYR  37           H        TYR  37   6.733  -8.208 -10.368
  272    HA   TYR  37           HA       TYR  37   7.412  -9.779  -7.968
  273   1HB   TYR  37          1HB       TYR  37   4.905  -8.135  -8.397
  274   2HB   TYR  37          2HB       TYR  37   5.117  -9.310  -7.103
  275    HD1  TYR  37           HD1      TYR  37   5.719  -5.931  -8.185
  276    HD2  TYR  37           HD2      TYR  37   6.895  -8.896  -5.370
  277    HE1  TYR  37           HE1      TYR  37   6.701  -4.183  -6.760
  278    HE2  TYR  37           HE2      TYR  37   7.878  -7.159  -3.940
  279    HH   TYR  37           HH       TYR  37   7.307  -3.839  -4.420
  280    H    VAL  38           H        VAL  38   6.228 -11.746  -7.773
  281    HA   VAL  38           HA       VAL  38   4.880 -12.553 -10.249
  282    HB   VAL  38           HB       VAL  38   5.748 -14.289  -7.920
  283   1HG1  VAL  38          1HG1      VAL  38   4.574 -15.018 -10.607
  284   2HG1  VAL  38          2HG1      VAL  38   3.791 -15.198  -9.038
  285   3HG1  VAL  38          3HG1      VAL  38   5.210 -16.167  -9.429
  286   1HG2  VAL  38          1HG2      VAL  38   7.453 -15.144  -9.452
  287   2HG2  VAL  38          2HG2      VAL  38   7.647 -13.410  -9.188
  288   3HG2  VAL  38          3HG2      VAL  38   6.923 -14.000 -10.684
  289    H    VAL  39           H        VAL  39   2.774 -12.580 -10.304
  290    HA   VAL  39           HA       VAL  39   1.381 -12.044  -7.779
  291    HB   VAL  39           HB       VAL  39   1.995 -10.232  -9.844
  292   1HG1  VAL  39          1HG1      VAL  39  -0.965 -10.775  -9.771
  293   2HG1  VAL  39          2HG1      VAL  39   0.114 -11.039 -11.141
  294   3HG1  VAL  39          3HG1      VAL  39  -0.186  -9.402 -10.557
  295   1HG2  VAL  39          1HG2      VAL  39   1.851  -9.682  -7.503
  296   2HG2  VAL  39          2HG2      VAL  39   0.113  -9.978  -7.510
  297   3HG2  VAL  39          3HG2      VAL  39   0.782  -8.635  -8.437
  298    H    ARG  40           H        ARG  40  -0.750 -12.694  -7.660
  299    HA   ARG  40           HA       ARG  40  -1.709 -14.341  -9.906
  300   1HB   ARG  40          1HB       ARG  40  -2.187 -14.612  -6.946
  301   2HB   ARG  40          2HB       ARG  40  -3.158 -15.446  -8.145
  302   1HG   ARG  40          1HG       ARG  40  -1.113 -16.565  -8.960
  303   2HG   ARG  40          2HG       ARG  40  -0.213 -15.791  -7.650
  304   1HD   ARG  40          1HD       ARG  40  -1.732 -16.839  -6.024
  305   2HD   ARG  40          2HD       ARG  40  -2.563 -17.654  -7.345
  306    HE   ARG  40           HE       ARG  40   0.059 -18.397  -7.616
  307   1HH1  ARG  40          1HH1      ARG  40  -2.350 -18.547  -5.075
  308   2HH1  ARG  40          2HH1      ARG  40  -1.694 -19.993  -4.360
  309   1HH2  ARG  40          1HH2      ARG  40   0.923 -20.295  -6.692
  310   2HH2  ARG  40          2HH2      ARG  40   0.176 -20.995  -5.285
  311    H    TRP  41           H        TRP  41  -3.512 -13.705 -10.873
  312    HA   TRP  41           HA       TRP  41  -5.213 -11.674  -9.681
  313   1HB   TRP  41          1HB       TRP  41  -5.963 -13.271 -12.113
  314   2HB   TRP  41          2HB       TRP  41  -6.354 -11.602 -11.729
  315    HD1  TRP  41           HD1      TRP  41  -4.271 -13.547 -13.973
  316    HE1  TRP  41           HE1      TRP  41  -2.412 -12.109 -15.020
  317    HE3  TRP  41           HE3      TRP  41  -4.493  -9.507 -10.846
  318    HZ2  TRP  41           HZ2      TRP  41  -1.200  -9.609 -14.580
  319    HZ3  TRP  41           HZ3      TRP  41  -2.946  -7.637 -11.231
  320    HH2  TRP  41           HH2      TRP  41  -1.332  -7.689 -13.061
  321    H    LEU  42           H        LEU  42  -6.390 -12.475  -7.974
  322    HA   LEU  42           HA       LEU  42  -7.083 -15.301  -7.931
  323   1HB   LEU  42          1HB       LEU  42  -7.963 -13.242  -5.931
  324   2HB   LEU  42          2HB       LEU  42  -7.796 -14.969  -5.702
  325    HG   LEU  42           HG       LEU  42  -5.620 -12.909  -5.884
  326   1HD1  LEU  42          1HD1      LEU  42  -6.697 -13.185  -3.733
  327   2HD1  LEU  42          2HD1      LEU  42  -5.049 -13.812  -3.690
  328   3HD1  LEU  42          3HD1      LEU  42  -6.411 -14.925  -3.795
  329   1HD2  LEU  42          1HD2      LEU  42  -5.326 -15.911  -5.899
  330   2HD2  LEU  42          2HD2      LEU  42  -4.015 -14.745  -5.710
  331   3HD2  LEU  42          3HD2      LEU  42  -4.923 -14.817  -7.221
  332    H    VAL  43           H        VAL  43  -8.845 -12.245  -7.646
  333    HA   VAL  43           HA       VAL  43 -11.386 -13.520  -7.929
  334    HB   VAL  43           HB       VAL  43 -12.112 -11.044  -8.158
  335   1HG1  VAL  43          1HG1      VAL  43 -11.963 -10.765  -5.729
  336   2HG1  VAL  43          2HG1      VAL  43 -10.775 -12.065  -5.666
  337   3HG1  VAL  43          3HG1      VAL  43 -12.430 -12.411  -6.165
  338   1HG2  VAL  43          1HG2      VAL  43 -10.529  -9.444  -7.204
  339   2HG2  VAL  43          2HG2      VAL  43  -9.909 -10.138  -8.701
  340   3HG2  VAL  43          3HG2      VAL  43  -9.297 -10.704  -7.147
  341    H    ASN  44           H        ASN  44  -8.988 -12.692 -10.043
  342    HA   ASN  44           HA       ASN  44 -10.845 -12.435 -12.274
  343   1HB   ASN  44          1HB       ASN  44  -7.836 -12.115 -12.188
  344   2HB   ASN  44          2HB       ASN  44  -8.810 -11.968 -13.646
  345   1HD2  ASN  44          1HD2      ASN  44  -7.906 -10.491 -10.642
  346   2HD2  ASN  44          2HD2      ASN  44  -8.602  -8.943 -10.965
  347    H    GLY  45           H        GLY  45  -7.783 -14.217 -11.697
  348   1HA   GLY  45          1HA       GLY  45  -8.079 -16.664 -11.403
  349   2HA   GLY  45          2HA       GLY  45  -9.149 -16.596 -12.788
  350    H    HIS  46           H        HIS  46  -5.766 -15.736 -11.931
  351    HA   HIS  46           HA       HIS  46  -4.646 -17.646 -13.634
  352   1HB   HIS  46          1HB       HIS  46  -5.618 -15.954 -15.331
  353   2HB   HIS  46          2HB       HIS  46  -4.278 -14.922 -14.857
  354    HD1  HIS  46           HD1      HIS  46  -4.776 -18.496 -16.093
  355    HD2  HIS  46           HD2      HIS  46  -2.084 -15.335 -16.404
  356    HE1  HIS  46           HE1      HIS  46  -2.999 -19.269 -17.693
  357    HE2  HIS  46           HE2      HIS  46  -1.463 -17.294 -17.983
  358    H    GLU  47           H        GLU  47  -2.323 -17.561 -13.693
  359    HA   GLU  47           HA       GLU  47  -1.181 -15.781 -11.633
  360   1HB   GLU  47          1HB       GLU  47  -0.190 -18.477 -12.594
  361   2HB   GLU  47          2HB       GLU  47   0.621 -17.470 -11.406
  362   1HG   GLU  47          1HG       GLU  47  -0.510 -19.153 -10.212
  363   2HG   GLU  47          2HG       GLU  47  -1.434 -17.671  -9.981
  364    H    THR  48           H        THR  48   0.876 -14.796 -12.044
  365    HA   THR  48           HA       THR  48   2.334 -15.160 -14.433
  366    HB   THR  48           HB       THR  48   0.330 -14.137 -15.422
  367    HG1  THR  48           HG1      THR  48   1.626 -13.298 -16.836
  368   1HG2  THR  48          1HG2      THR  48   1.084 -11.714 -13.798
  369   2HG2  THR  48          2HG2      THR  48  -0.369 -12.692 -13.592
  370   3HG2  THR  48          3HG2      THR  48  -0.142 -11.751 -15.067
  371    H    THR  49           H        THR  49   3.637 -13.062 -14.890
  372    HA   THR  49           HA       THR  49   4.544 -11.931 -12.313
  373    HB   THR  49           HB       THR  49   6.278 -12.537 -14.726
  374    HG1  THR  49           HG1      THR  49   5.358 -14.198 -12.921
  375   1HG2  THR  49          1HG2      THR  49   7.079 -10.640 -13.395
  376   2HG2  THR  49          2HG2      THR  49   8.148 -12.033 -13.227
  377   3HG2  THR  49          3HG2      THR  49   7.013 -11.631 -11.937
  378    H    VAL  50           H        VAL  50   4.450  -9.732 -12.224
  379    HA   VAL  50           HA       VAL  50   4.034  -8.321 -14.780
  380    HB   VAL  50           HB       VAL  50   2.341  -6.892 -13.677
  381   1HG1  VAL  50          1HG1      VAL  50   0.523  -8.528 -13.733
  382   2HG1  VAL  50          2HG1      VAL  50   1.702  -9.839 -13.672
  383   3HG1  VAL  50          3HG1      VAL  50   1.649  -8.766 -15.070
  384   1HG2  VAL  50          1HG2      VAL  50   3.020  -7.210 -11.359
  385   2HG2  VAL  50          2HG2      VAL  50   2.542  -8.906 -11.437
  386   3HG2  VAL  50          3HG2      VAL  50   1.322  -7.638 -11.573
  387    H    TYR  51           H        TYR  51   4.401  -6.050 -14.754
  388    HA   TYR  51           HA       TYR  51   6.225  -5.128 -12.635
  389   1HB   TYR  51          1HB       TYR  51   5.934  -4.095 -15.469
  390   2HB   TYR  51          2HB       TYR  51   7.062  -3.485 -14.265
  391    HD1  TYR  51           HD1      TYR  51   9.061  -4.747 -13.685
  392    HD2  TYR  51           HD2      TYR  51   6.333  -6.187 -16.609
  393    HE1  TYR  51           HE1      TYR  51  10.754  -6.349 -14.469
  394    HE2  TYR  51           HE2      TYR  51   8.013  -7.794 -17.397
  395    HH   TYR  51           HH       TYR  51  10.399  -8.105 -17.391
  396    HA   PRO  52           HA       PRO  52   2.610  -2.471 -11.790
  397   1HB   PRO  52          1HB       PRO  52   4.072  -1.898  -9.314
  398   2HB   PRO  52          2HB       PRO  52   2.492  -2.653  -9.525
  399   1HG   PRO  52          1HG       PRO  52   4.651  -4.026  -8.653
  400   2HG   PRO  52          2HG       PRO  52   3.372  -4.776  -9.626
  401   1HD   PRO  52          1HD       PRO  52   6.072  -3.792 -10.478
  402   2HD   PRO  52          2HD       PRO  52   5.212  -5.276 -10.946
  403    H    GLY  53           H        GLY  53   2.733  -0.108 -10.708
  404   1HA   GLY  53          1HA       GLY  53   5.010   1.267 -11.991
  405   2HA   GLY  53          2HA       GLY  53   3.359   1.842 -12.154
  406    H    SER  54           H        SER  54   3.993   3.849 -11.317
  407    HA   SER  54           HA       SER  54   5.219   4.139  -8.764
  408   1HB   SER  54          1HB       SER  54   5.426   5.884 -10.460
  409   2HB   SER  54          2HB       SER  54   3.681   6.122 -10.464
  410    HG   SER  54           HG       SER  54   3.772   7.091  -8.528
  411    H    ASP  55           H        ASP  55   4.260   5.080  -6.868
  412    HA   ASP  55           HA       ASP  55   2.706   5.343  -5.240
  413   1HB   ASP  55          1HB       ASP  55   0.817   5.449  -7.602
  414   2HB   ASP  55          2HB       ASP  55   0.312   5.733  -5.939
  415    H    ALA  56           H        ALA  56   3.608   2.773  -5.841
  416    HA   ALA  56           HA       ALA  56   1.406   0.940  -5.865
  417   1HB   ALA  56          1HB       ALA  56   3.584   0.337  -6.815
  418   2HB   ALA  56          2HB       ALA  56   3.081  -0.791  -5.554
  419   3HB   ALA  56          3HB       ALA  56   4.304   0.432  -5.207
  420    H    VAL  57           H        VAL  57   0.319   0.115  -4.217
  421    HA   VAL  57           HA       VAL  57   1.229   0.664  -1.465
  422    HB   VAL  57           HB       VAL  57  -1.669   0.749  -2.328
  423   1HG1  VAL  57          1HG1      VAL  57  -1.294   0.323   0.043
  424   2HG1  VAL  57          2HG1      VAL  57  -2.007   1.917  -0.204
  425   3HG1  VAL  57          3HG1      VAL  57  -0.287   1.767   0.152
  426   1HG2  VAL  57          1HG2      VAL  57  -0.506   2.528  -3.508
  427   2HG2  VAL  57          2HG2      VAL  57   0.209   3.086  -1.995
  428   3HG2  VAL  57          3HG2      VAL  57  -1.534   3.197  -2.239
  429    H    VAL  58           H        VAL  58   0.134  -0.819   0.144
  430    HA   VAL  58           HA       VAL  58  -0.351  -3.467  -1.064
  431    HB   VAL  58           HB       VAL  58   0.792  -2.866   1.673
  432   1HG1  VAL  58          1HG1      VAL  58   0.444  -5.484   0.217
  433   2HG1  VAL  58          2HG1      VAL  58  -0.471  -4.943   1.625
  434   3HG1  VAL  58          3HG1      VAL  58   1.257  -5.268   1.768
  435   1HG2  VAL  58          1HG2      VAL  58   2.164  -3.888  -0.810
  436   2HG2  VAL  58          2HG2      VAL  58   2.903  -3.725   0.782
  437   3HG2  VAL  58          3HG2      VAL  58   2.368  -2.291  -0.094
  438    H    VAL  59           H        VAL  59  -2.395  -4.166  -0.852
  439    HA   VAL  59           HA       VAL  59  -4.040  -3.158   1.342
  440    HB   VAL  59           HB       VAL  59  -5.884  -3.938  -0.235
  441   1HG1  VAL  59          1HG1      VAL  59  -5.883  -1.803  -1.450
  442   2HG1  VAL  59          2HG1      VAL  59  -4.216  -1.545  -0.931
  443   3HG1  VAL  59          3HG1      VAL  59  -5.512  -1.609   0.263
  444   1HG2  VAL  59          1HG2      VAL  59  -4.536  -5.185  -1.789
  445   2HG2  VAL  59          2HG2      VAL  59  -3.641  -3.724  -2.201
  446   3HG2  VAL  59          3HG2      VAL  59  -5.350  -3.856  -2.616
  447    H    THR  60           H        THR  60  -5.990  -4.713   1.624
  448    HA   THR  60           HA       THR  60  -4.965  -7.465   1.917
  449    HB   THR  60           HB       THR  60  -6.566  -7.560   3.911
  450    HG1  THR  60           HG1      THR  60  -7.784  -5.839   4.094
  451   1HG2  THR  60          1HG2      THR  60  -4.977  -6.452   5.418
  452   2HG2  THR  60          2HG2      THR  60  -4.224  -5.658   4.034
  453   3HG2  THR  60          3HG2      THR  60  -4.151  -7.413   4.192
  454    H    ALA  61           H        ALA  61  -7.294  -8.689   2.726
  455    HA   ALA  61           HA       ALA  61  -8.237  -9.678   0.387
  456   1HB   ALA  61          1HB       ALA  61  -9.976 -10.765   1.660
  457   2HB   ALA  61          2HB       ALA  61  -9.747  -9.625   2.986
  458   3HB   ALA  61          3HB       ALA  61  -8.461 -10.756   2.562
  459    H    THR  62           H        THR  62  -9.962  -7.127   2.271
  460    HA   THR  62           HA       THR  62 -12.266  -7.343   0.600
  461    HB   THR  62           HB       THR  62 -12.673  -4.965   1.676
  462    HG1  THR  62           HG1      THR  62 -10.922  -4.509   2.811
  463   1HG2  THR  62          1HG2      THR  62 -13.743  -6.107   3.562
  464   2HG2  THR  62          2HG2      THR  62 -12.855  -7.574   3.152
  465   3HG2  THR  62          3HG2      THR  62 -14.047  -6.922   2.028
  466    H    GLU  63           H        GLU  63  -9.521  -5.195   0.718
  467    HA   GLU  63           HA       GLU  63 -10.418  -3.367  -1.247
  468   1HB   GLU  63          1HB       GLU  63  -7.507  -3.911  -0.886
  469   2HB   GLU  63          2HB       GLU  63  -8.344  -2.375  -1.037
  470   1HG   GLU  63          1HG       GLU  63  -8.237  -4.137   1.401
  471   2HG   GLU  63          2HG       GLU  63  -7.413  -2.600   1.169
  472    H    HIS  64           H        HIS  64  -9.310  -6.533  -1.326
  473    HA   HIS  64           HA       HIS  64  -8.136  -6.475  -3.936
  474   1HB   HIS  64          1HB       HIS  64  -7.082  -8.210  -3.048
  475   2HB   HIS  64          2HB       HIS  64  -8.200  -8.264  -1.699
  476    HD1  HIS  64           HD1      HIS  64  -7.469  -9.873  -5.013
  477    HD2  HIS  64           HD2      HIS  64 -10.144 -10.266  -1.837
  478    HE1  HIS  64           HE1      HIS  64  -8.598 -12.098  -5.331
  479    HE2  HIS  64           HE2      HIS  64 -10.138 -12.364  -3.353
  480    H    ALA  65           H        ALA  65 -11.375  -7.480  -2.717
  481    HA   ALA  65           HA       ALA  65 -11.854  -9.336  -4.767
  482   1HB   ALA  65          1HB       ALA  65 -13.901  -7.688  -3.291
  483   2HB   ALA  65          2HB       ALA  65 -13.183  -9.188  -2.703
  484   3HB   ALA  65          3HB       ALA  65 -14.190  -9.200  -4.150
  485    H    GLU  66           H        GLU  66 -13.499  -6.261  -4.483
  486    HA   GLU  66           HA       GLU  66 -14.393  -6.227  -7.171
  487   1HB   GLU  66          1HB       GLU  66 -14.847  -3.731  -6.456
  488   2HB   GLU  66          2HB       GLU  66 -15.774  -5.050  -5.752
  489   1HG   GLU  66          1HG       GLU  66 -14.222  -5.059  -3.818
  490   2HG   GLU  66          2HG       GLU  66 -13.405  -3.658  -4.508
  491    H    ALA  67           H        ALA  67 -11.880  -4.422  -5.473
  492    HA   ALA  67           HA       ALA  67 -11.243  -2.755  -7.653
  493   1HB   ALA  67          1HB       ALA  67  -9.599  -3.381  -5.213
  494   2HB   ALA  67          2HB       ALA  67 -10.823  -2.118  -5.340
  495   3HB   ALA  67          3HB       ALA  67  -9.357  -2.026  -6.315
  496    H    GLU  68           H        GLU  68 -10.009  -5.921  -6.655
  497    HA   GLU  68           HA       GLU  68  -7.717  -5.731  -8.383
  498   1HB   GLU  68          1HB       GLU  68  -7.650  -7.195  -6.421
  499   2HB   GLU  68          2HB       GLU  68  -8.931  -8.181  -7.106
  500   1HG   GLU  68          1HG       GLU  68  -7.389  -8.649  -9.036
  501   2HG   GLU  68          2HG       GLU  68  -6.115  -7.864  -8.099
  502    H    LYS  69           H        LYS  69 -10.988  -7.092  -8.653
  503    HA   LYS  69           HA       LYS  69 -10.678  -8.316 -11.133
  504   1HB   LYS  69          1HB       LYS  69 -13.006  -6.673 -10.122
  505   2HB   LYS  69          2HB       LYS  69 -13.059  -7.695 -11.555
  506   1HG   LYS  69          1HG       LYS  69 -12.595  -9.655 -10.193
  507   2HG   LYS  69          2HG       LYS  69 -12.504  -8.641  -8.751
  508   1HD   LYS  69          1HD       LYS  69 -14.839  -7.981  -9.081
  509   2HD   LYS  69          2HD       LYS  69 -14.923  -9.013 -10.510
  510   1HE   LYS  69          1HE       LYS  69 -14.431 -10.969  -9.120
  511   2HE   LYS  69          2HE       LYS  69 -14.356  -9.934  -7.694
  512   1HZ   LYS  69          1HZ       LYS  69 -16.667  -9.374  -7.994
  513   2HZ   LYS  69          2HZ       LYS  69 -16.498 -11.061  -7.925
  514   3HZ   LYS  69          3HZ       LYS  69 -16.748 -10.292  -9.417
  515    H    ARG  70           H        ARG  70 -11.700  -4.931 -10.596
  516    HA   ARG  70           HA       ARG  70 -11.521  -4.260 -13.355
  517   1HB   ARG  70          1HB       ARG  70 -11.349  -2.325 -11.045
  518   2HB   ARG  70          2HB       ARG  70 -11.899  -1.988 -12.680
  519   1HG   ARG  70          1HG       ARG  70 -13.801  -3.550 -12.283
  520   2HG   ARG  70          2HG       ARG  70 -13.281  -3.664 -10.599
  521   1HD   ARG  70          1HD       ARG  70 -14.219  -1.210 -12.073
  522   2HD   ARG  70          2HD       ARG  70 -15.026  -2.032 -10.740
  523    HE   ARG  70           HE       ARG  70 -12.378  -1.011 -10.139
  524   1HH1  ARG  70          1HH1      ARG  70 -15.836  -0.396 -10.113
  525   2HH1  ARG  70          2HH1      ARG  70 -15.729   0.868  -8.918
  526   1HH2  ARG  70          1HH2      ARG  70 -12.232   0.655  -8.583
  527   2HH2  ARG  70          2HH2      ARG  70 -13.670   1.496  -8.073
  528    H    ALA  71           H        ALA  71  -9.288  -3.799 -10.654
  529    HA   ALA  71           HA       ALA  71  -7.507  -2.181 -12.210
  530   1HB   ALA  71          1HB       ALA  71  -7.834  -1.781  -9.828
  531   2HB   ALA  71          2HB       ALA  71  -6.140  -2.067 -10.230
  532   3HB   ALA  71          3HB       ALA  71  -7.094  -3.341  -9.470
  533    H    ALA  72           H        ALA  72  -7.766  -5.600 -11.661
  534    HA   ALA  72           HA       ALA  72  -5.040  -6.124 -12.441
  535   1HB   ALA  72          1HB       ALA  72  -7.412  -7.989 -12.510
  536   2HB   ALA  72          2HB       ALA  72  -6.272  -7.817 -11.174
  537   3HB   ALA  72          3HB       ALA  72  -5.723  -8.446 -12.728
  538    H    ALA  73           H        ALA  73  -8.209  -5.967 -14.022
  539    HA   ALA  73           HA       ALA  73  -7.345  -6.446 -16.640
  540   1HB   ALA  73          1HB       ALA  73  -9.701  -6.211 -16.030
  541   2HB   ALA  73          2HB       ALA  73  -9.273  -5.131 -17.357
  542   3HB   ALA  73          3HB       ALA  73  -9.451  -4.494 -15.722
  543    H    ARG  74           H        ARG  74  -7.005  -3.627 -14.587
  544    HA   ARG  74           HA       ARG  74  -5.863  -1.917 -16.585
  545   1HB   ARG  74          1HB       ARG  74  -5.598  -1.819 -13.573
  546   2HB   ARG  74          2HB       ARG  74  -5.173  -0.520 -14.677
  547   1HG   ARG  74          1HG       ARG  74  -7.954  -1.626 -14.604
  548   2HG   ARG  74          2HG       ARG  74  -7.422  -0.416 -13.437
  549   1HD   ARG  74          1HD       ARG  74  -6.700   0.316 -16.145
  550   2HD   ARG  74          2HD       ARG  74  -8.436   0.052 -15.982
  551    HE   ARG  74           HE       ARG  74  -7.668   1.616 -13.817
  552   1HH1  ARG  74          1HH1      ARG  74  -7.669   1.899 -17.312
  553   2HH1  ARG  74          2HH1      ARG  74  -7.896   3.616 -17.302
  554   1HH2  ARG  74          1HH2      ARG  74  -8.007   3.878 -13.803
  555   2HH2  ARG  74          2HH2      ARG  74  -8.086   4.749 -15.309
  556    H    ALA  75           H        ALA  75  -4.364  -3.651 -13.847
  557    HA   ALA  75           HA       ALA  75  -1.664  -3.049 -14.385
  558   1HB   ALA  75          1HB       ALA  75  -2.525  -3.892 -12.244
  559   2HB   ALA  75          2HB       ALA  75  -1.148  -4.822 -12.833
  560   3HB   ALA  75          3HB       ALA  75  -2.780  -5.474 -12.978
  561    H    GLY  76           H        GLY  76  -3.317  -6.189 -14.915
  562   1HA   GLY  76          1HA       GLY  76  -0.973  -7.137 -16.336
  563   2HA   GLY  76          2HA       GLY  76  -2.371  -8.091 -15.881
  564    H    HIS  77           H        HIS  77  -2.698  -5.079 -17.572
  565    HA   HIS  77           HA       HIS  77  -3.879  -6.439 -19.842
  566   1HB   HIS  77          1HB       HIS  77  -4.538  -4.130 -18.703
  567   2HB   HIS  77          2HB       HIS  77  -3.334  -3.497 -19.817
  568    HD1  HIS  77           HD1      HIS  77  -6.807  -3.998 -19.593
  569    HD2  HIS  77           HD2      HIS  77  -4.010  -4.528 -22.624
  570    HE1  HIS  77           HE1      HIS  77  -8.126  -4.020 -21.734
  571    HE2  HIS  77           HE2      HIS  77  -6.400  -4.191 -23.564
  572    H    ALA  78           H        ALA  78  -0.912  -5.045 -18.860
  573    HA   ALA  78           HA       ALA  78   0.405  -5.908 -21.283
  574   1HB   ALA  78          1HB       ALA  78   1.496  -3.745 -21.690
  575   2HB   ALA  78          2HB       ALA  78   0.514  -3.013 -20.420
  576   3HB   ALA  78          3HB       ALA  78  -0.253  -3.631 -21.883
  577    H    ALA  79           H        ALA  79   2.892  -5.044 -20.930
  578    HA   ALA  79           HA       ALA  79   4.812  -5.228 -19.733
  579   1HB   ALA  79          1HB       ALA  79   4.841  -4.607 -17.389
  580   2HB   ALA  79          2HB       ALA  79   3.085  -4.756 -17.305
  581   3HB   ALA  79          3HB       ALA  79   3.817  -3.497 -18.301
  582    H    THR  80           H        THR  80   2.638  -7.493 -19.908
  583    HA   THR  80           HA       THR  80   3.803  -9.312 -17.944
  584    HB   THR  80           HB       THR  80   2.041 -10.906 -18.825
  585    HG1  THR  80           HG1      THR  80   1.829  -9.441 -20.809
  586   1HG2  THR  80          1HG2      THR  80   0.190  -9.801 -17.646
  587   2HG2  THR  80          2HG2      THR  80   1.082  -8.280 -17.680
  588   3HG2  THR  80          3HG2      THR  80   1.705  -9.647 -16.756
  Start of MODEL    2
    1    H    MET   1           H        MET   1   9.136   0.328  -2.728
    2    HA   MET   1           HA       MET   1   6.792   0.283  -0.927
    3   1HB   MET   1          1HB       MET   1   6.318   0.130  -3.367
    4   2HB   MET   1          2HB       MET   1   7.387  -1.261  -3.467
    5   1HG   MET   1          1HG       MET   1   5.905  -2.429  -1.845
    6   2HG   MET   1          2HG       MET   1   4.795  -1.066  -1.953
    7   1HE   MET   1          1HE       MET   1   4.083  -4.172  -2.523
    8   2HE   MET   1          2HE       MET   1   3.008  -3.980  -3.907
    9   3HE   MET   1          3HE       MET   1   2.899  -2.865  -2.545
   10    H    HIS   2           H        HIS   2   6.343  -1.851  -0.065
   11    HA   HIS   2           HA       HIS   2   8.576  -3.724   0.087
   12   1HB   HIS   2          1HB       HIS   2   7.306  -2.315   2.400
   13   2HB   HIS   2          2HB       HIS   2   7.781  -4.000   2.604
   14    HD1  HIS   2           HD1      HIS   2  10.222  -4.465   2.996
   15    HD2  HIS   2           HD2      HIS   2   9.516  -0.549   1.795
   16    HE1  HIS   2           HE1      HIS   2  12.429  -3.284   3.216
   17    HE2  HIS   2           HE2      HIS   2  12.026  -0.976   2.284
   18    H    ALA   3           H        ALA   3   7.869  -5.918   0.390
   19    HA   ALA   3           HA       ALA   3   4.996  -6.254  -0.089
   20   1HB   ALA   3          1HB       ALA   3   6.043  -5.885  -2.275
   21   2HB   ALA   3          2HB       ALA   3   5.370  -7.509  -2.128
   22   3HB   ALA   3          3HB       ALA   3   7.110  -7.261  -1.987
   23    H    LYS   4           H        LYS   4   4.173  -8.172   0.381
   24    HA   LYS   4           HA       LYS   4   5.849 -10.258   1.530
   25   1HB   LYS   4          1HB       LYS   4   4.127 -10.303   3.474
   26   2HB   LYS   4          2HB       LYS   4   5.431  -9.129   3.520
   27   1HG   LYS   4          1HG       LYS   4   2.863  -8.288   2.294
   28   2HG   LYS   4          2HG       LYS   4   2.925  -8.480   4.046
   29   1HD   LYS   4          1HD       LYS   4   4.697  -6.888   4.233
   30   2HD   LYS   4          2HD       LYS   4   4.902  -6.829   2.482
   31   1HE   LYS   4          1HE       LYS   4   3.688  -4.873   3.450
   32   2HE   LYS   4          2HE       LYS   4   2.798  -5.740   2.201
   33   1HZ   LYS   4          1HZ       LYS   4   1.436  -6.772   3.832
   34   2HZ   LYS   4          2HZ       LYS   4   1.463  -5.119   4.186
   35   3HZ   LYS   4          3HZ       LYS   4   2.397  -6.194   5.108
   36    H    VAL   5           H        VAL   5   4.955 -12.304   1.335
   37    HA   VAL   5           HA       VAL   5   2.878 -12.656  -0.578
   38    HB   VAL   5           HB       VAL   5   4.625 -14.335  -0.280
   39   1HG1  VAL   5          1HG1      VAL   5   4.701 -15.793   1.697
   40   2HG1  VAL   5          2HG1      VAL   5   3.466 -14.794   2.464
   41   3HG1  VAL   5          3HG1      VAL   5   5.045 -14.107   2.085
   42   1HG2  VAL   5          1HG2      VAL   5   3.288 -16.378  -0.190
   43   2HG2  VAL   5          2HG2      VAL   5   2.499 -15.131  -1.154
   44   3HG2  VAL   5          3HG2      VAL   5   1.937 -15.466   0.484
   45    H    GLY   6           H        GLY   6   0.725 -13.541  -0.268
   46   1HA   GLY   6          1HA       GLY   6  -1.322 -13.790   0.840
   47   2HA   GLY   6          2HA       GLY   6  -0.480 -13.603   2.376
   48    H    ASP   7           H        ASP   7   0.145 -11.422  -0.064
   49    HA   ASP   7           HA       ASP   7  -1.417  -9.199   1.185
   50   1HB   ASP   7          1HB       ASP   7   1.073  -9.601   2.128
   51   2HB   ASP   7          2HB       ASP   7   1.498  -8.704   0.672
   52    H    TYR   8           H        TYR   8  -1.257  -7.250  -0.272
   53    HA   TYR   8           HA       TYR   8  -1.967  -8.442  -2.874
   54   1HB   TYR   8          1HB       TYR   8  -3.661  -7.392  -0.587
   55   2HB   TYR   8          2HB       TYR   8  -4.166  -6.964  -2.199
   56    HD1  TYR   8           HD1      TYR   8  -4.934  -8.780  -3.739
   57    HD2  TYR   8           HD2      TYR   8  -4.240  -9.447   0.404
   58    HE1  TYR   8           HE1      TYR   8  -6.447 -10.728  -3.810
   59    HE2  TYR   8           HE2      TYR   8  -5.736 -11.410   0.328
   60    HH   TYR   8           HH       TYR   8  -6.675 -12.922  -2.375
   61    H    LEU   9           H        LEU   9  -2.402  -6.560  -4.416
   62    HA   LEU   9           HA       LEU   9  -0.832  -4.226  -3.514
   63   1HB   LEU   9          1HB       LEU   9   0.563  -6.163  -4.358
   64   2HB   LEU   9          2HB       LEU   9  -0.241  -6.005  -5.896
   65    HG   LEU   9           HG       LEU   9   1.664  -3.998  -4.666
   66   1HD1  LEU   9          1HD1      LEU   9   2.744  -6.014  -5.471
   67   2HD1  LEU   9          2HD1      LEU   9   3.106  -4.654  -6.534
   68   3HD1  LEU   9          3HD1      LEU   9   1.915  -5.861  -7.019
   69   1HD2  LEU   9          1HD2      LEU   9   1.581  -2.840  -6.810
   70   2HD2  LEU   9          2HD2      LEU   9   0.000  -2.836  -6.031
   71   3HD2  LEU   9          3HD2      LEU   9   0.320  -3.941  -7.367
   72    H    VAL  10           H        VAL  10  -1.059  -2.451  -4.695
   73    HA   VAL  10           HA       VAL  10  -3.241  -2.233  -6.646
   74    HB   VAL  10           HB       VAL  10  -3.235  -1.170  -3.841
   75   1HG1  VAL  10          1HG1      VAL  10  -4.546   0.279  -6.143
   76   2HG1  VAL  10          2HG1      VAL  10  -3.197   0.876  -5.176
   77   3HG1  VAL  10          3HG1      VAL  10  -4.777   0.635  -4.430
   78   1HG2  VAL  10          1HG2      VAL  10  -5.412  -2.056  -5.716
   79   2HG2  VAL  10          2HG2      VAL  10  -5.627  -1.594  -4.027
   80   3HG2  VAL  10          3HG2      VAL  10  -4.676  -3.021  -4.438
   81    H    VAL  11           H        VAL  11  -2.914  -0.452  -8.087
   82    HA   VAL  11           HA       VAL  11  -0.861   1.456  -7.093
   83    HB   VAL  11           HB       VAL  11   0.107  -0.282  -8.726
   84   1HG1  VAL  11          1HG1      VAL  11  -0.152   0.212 -11.100
   85   2HG1  VAL  11          2HG1      VAL  11  -1.374   1.425 -10.715
   86   3HG1  VAL  11          3HG1      VAL  11  -1.681  -0.277 -10.368
   87   1HG2  VAL  11          1HG2      VAL  11   1.545   1.392  -9.772
   88   2HG2  VAL  11          2HG2      VAL  11   1.264   1.743  -8.065
   89   3HG2  VAL  11          3HG2      VAL  11   0.405   2.655  -9.308
   90    H    LYS  12           H        LYS  12  -1.159   3.586  -7.804
   91    HA   LYS  12           HA       LYS  12  -3.954   3.974  -8.543
   92   1HB   LYS  12          1HB       LYS  12  -2.017   5.801  -7.126
   93   2HB   LYS  12          2HB       LYS  12  -3.644   6.275  -7.595
   94   1HG   LYS  12          1HG       LYS  12  -4.438   4.278  -6.216
   95   2HG   LYS  12          2HG       LYS  12  -2.802   4.243  -5.555
   96   1HD   LYS  12          1HD       LYS  12  -4.240   5.520  -4.087
   97   2HD   LYS  12          2HD       LYS  12  -3.074   6.603  -4.852
   98   1HE   LYS  12          1HE       LYS  12  -4.756   7.299  -6.466
   99   2HE   LYS  12          2HE       LYS  12  -5.918   6.179  -5.761
  100   1HZ   LYS  12          1HZ       LYS  12  -6.301   8.416  -4.979
  101   2HZ   LYS  12          2HZ       LYS  12  -4.716   8.533  -4.400
  102   3HZ   LYS  12          3HZ       LYS  12  -5.801   7.440  -3.687
  103    H    GLY  13           H        GLY  13  -4.324   4.373 -10.585
  104   1HA   GLY  13          1HA       GLY  13  -2.581   5.909 -12.259
  105   2HA   GLY  13          2HA       GLY  13  -4.257   5.478 -12.604
  106    H    THR  14           H        THR  14  -2.136   7.926 -11.553
  107    HA   THR  14           HA       THR  14  -3.952   9.457 -10.003
  108    HB   THR  14           HB       THR  14  -1.531   9.709  -9.750
  109    HG1  THR  14           HG1      THR  14  -3.034  11.993 -10.525
  110   1HG2  THR  14          1HG2      THR  14  -0.201  10.907 -11.407
  111   2HG2  THR  14          2HG2      THR  14  -1.596  10.991 -12.482
  112   3HG2  THR  14          3HG2      THR  14  -0.876   9.428 -12.092
  113    H    THR  15           H        THR  15  -4.196   8.747 -13.147
  114    HA   THR  15           HA       THR  15  -4.878  11.104 -14.462
  115    HB   THR  15           HB       THR  15  -6.562   8.676 -14.870
  116    HG1  THR  15           HG1      THR  15  -3.763   8.786 -15.493
  117   1HG2  THR  15          1HG2      THR  15  -6.732  10.578 -16.394
  118   2HG2  THR  15          2HG2      THR  15  -6.084   9.164 -17.226
  119   3HG2  THR  15          3HG2      THR  15  -5.004  10.469 -16.735
  120    H    THR  16           H        THR  16  -7.105   8.790 -12.909
  121    HA   THR  16           HA       THR  16  -8.997  10.974 -12.418
  122    HB   THR  16           HB       THR  16  -9.549   8.041 -11.971
  123    HG1  THR  16           HG1      THR  16  -9.610   9.544 -14.398
  124   1HG2  THR  16          1HG2      THR  16 -11.181   9.656 -11.092
  125   2HG2  THR  16          2HG2      THR  16 -11.859   8.714 -12.420
  126   3HG2  THR  16          3HG2      THR  16 -11.334  10.373 -12.699
  127    H    GLU  17           H        GLU  17  -6.514   9.444 -10.902
  128    HA   GLU  17           HA       GLU  17  -5.693   9.543  -8.792
  129   1HB   GLU  17          1HB       GLU  17  -8.155  11.194  -8.192
  130   2HB   GLU  17          2HB       GLU  17  -6.755  11.023  -7.140
  131   1HG   GLU  17          1HG       GLU  17  -5.369  12.216  -8.598
  132   2HG   GLU  17          2HG       GLU  17  -6.508  12.073  -9.935
  133    H    ARG  18           H        ARG  18  -7.614   7.487  -9.700
  134    HA   ARG  18           HA       ARG  18  -8.694   6.570  -7.128
  135   1HB   ARG  18          1HB       ARG  18  -9.785   4.813  -8.726
  136   2HB   ARG  18          2HB       ARG  18 -10.444   6.442  -8.643
  137   1HG   ARG  18          1HG       ARG  18  -9.419   7.059 -10.689
  138   2HG   ARG  18          2HG       ARG  18  -8.441   5.591 -10.716
  139   1HD   ARG  18          1HD       ARG  18 -11.431   5.450 -10.711
  140   2HD   ARG  18          2HD       ARG  18 -10.539   5.724 -12.208
  141    HE   ARG  18           HE       ARG  18  -9.346   3.594 -11.686
  142   1HH1  ARG  18          1HH1      ARG  18 -12.489   4.205 -10.252
  143   2HH1  ARG  18          2HH1      ARG  18 -12.946   2.528 -10.244
  144   1HH2  ARG  18          1HH2      ARG  18  -9.916   1.412 -11.662
  145   2HH2  ARG  18          2HH2      ARG  18 -11.460   0.930 -11.011
  146    H    HIS  19           H        HIS  19  -8.673   3.949  -7.155
  147    HA   HIS  19           HA       HIS  19  -5.833   3.319  -7.502
  148   1HB   HIS  19          1HB       HIS  19  -6.185   1.441  -5.933
  149   2HB   HIS  19          2HB       HIS  19  -6.546   3.002  -5.224
  150    HD1  HIS  19           HD1      HIS  19  -8.804   3.268  -4.148
  151    HD2  HIS  19           HD2      HIS  19  -8.535  -0.176  -6.467
  152    HE1  HIS  19           HE1      HIS  19 -10.859   1.922  -3.613
  153    HE2  HIS  19           HE2      HIS  19 -10.616  -0.218  -4.918
  154    H    ASP  20           H        ASP  20  -5.237   2.220  -9.178
  155    HA   ASP  20           HA       ASP  20  -7.133   0.343 -10.400
  156   1HB   ASP  20          1HB       ASP  20  -5.431   2.440 -11.690
  157   2HB   ASP  20          2HB       ASP  20  -5.810   0.968 -12.578
  158    H    GLN  21           H        GLN  21  -6.284  -1.372  -9.398
  159    HA   GLN  21           HA       GLN  21  -4.986  -3.174 -10.795
  160   1HB   GLN  21          1HB       GLN  21  -2.894  -1.944 -10.953
  161   2HB   GLN  21          2HB       GLN  21  -2.865  -1.688  -9.213
  162   1HG   GLN  21          1HG       GLN  21  -2.614  -4.104  -8.867
  163   2HG   GLN  21          2HG       GLN  21  -2.614  -4.346 -10.611
  164   1HE2  GLN  21          1HE2      GLN  21  -0.577  -5.235 -10.664
  165   2HE2  GLN  21          2HE2      GLN  21   0.854  -4.316 -10.375
  166    H    HIS  22           H        HIS  22  -5.755  -4.985  -9.596
  167    HA   HIS  22           HA       HIS  22  -4.214  -5.055  -7.098
  168   1HB   HIS  22          1HB       HIS  22  -6.939  -4.932  -7.074
  169   2HB   HIS  22          2HB       HIS  22  -6.670  -6.672  -7.076
  170    HD1  HIS  22           HD1      HIS  22  -7.136  -4.009  -4.835
  171    HD2  HIS  22           HD2      HIS  22  -4.623  -7.309  -4.915
  172    HE1  HIS  22           HE1      HIS  22  -6.367  -4.322  -2.468
  173    HE2  HIS  22           HE2      HIS  22  -4.996  -6.424  -2.514
  174    H    ALA  23           H        ALA  23  -3.154  -6.681  -6.792
  175    HA   ALA  23           HA       ALA  23  -3.416  -9.208  -8.142
  176   1HB   ALA  23          1HB       ALA  23  -0.841  -7.681  -8.246
  177   2HB   ALA  23          2HB       ALA  23  -1.955  -7.925  -9.593
  178   3HB   ALA  23          3HB       ALA  23  -1.148  -9.307  -8.855
  179    H    GLU  24           H        GLU  24  -2.481 -10.993  -6.841
  180    HA   GLU  24           HA       GLU  24  -1.493  -9.904  -4.289
  181   1HB   GLU  24          1HB       GLU  24  -3.885 -10.499  -4.014
  182   2HB   GLU  24          2HB       GLU  24  -3.490 -12.154  -4.461
  183   1HG   GLU  24          1HG       GLU  24  -1.764 -11.196  -2.344
  184   2HG   GLU  24          2HG       GLU  24  -3.459 -11.047  -1.908
  185    H    ILE  25           H        ILE  25  -0.340 -11.184  -3.080
  186    HA   ILE  25           HA       ILE  25   1.564 -12.149  -5.034
  187    HB   ILE  25           HB       ILE  25   2.059 -10.885  -2.338
  188   1HG1  ILE  25          1HG1      ILE  25   1.830  -9.510  -5.029
  189   2HG1  ILE  25          2HG1      ILE  25   0.650  -9.391  -3.729
  190   1HG2  ILE  25          1HG2      ILE  25   4.176 -10.277  -3.312
  191   2HG2  ILE  25          2HG2      ILE  25   3.718 -11.073  -4.819
  192   3HG2  ILE  25          3HG2      ILE  25   3.930 -12.022  -3.346
  193   1HD1  ILE  25          1HD1      ILE  25   3.504  -8.440  -3.606
  194   2HD1  ILE  25          2HD1      ILE  25   2.309  -8.302  -2.316
  195   3HD1  ILE  25          3HD1      ILE  25   2.079  -7.426  -3.829
  196    H    ILE  26           H        ILE  26   2.044 -14.160  -4.986
  197    HA   ILE  26           HA       ILE  26   2.142 -15.608  -2.435
  198    HB   ILE  26           HB       ILE  26   2.021 -17.672  -3.997
  199   1HG1  ILE  26          1HG1      ILE  26   0.493 -17.118  -6.004
  200   2HG1  ILE  26          2HG1      ILE  26   1.072 -15.467  -5.823
  201   1HG2  ILE  26          1HG2      ILE  26   0.293 -17.065  -2.413
  202   2HG2  ILE  26          2HG2      ILE  26  -0.429 -17.630  -3.919
  203   3HG2  ILE  26          3HG2      ILE  26  -0.378 -15.904  -3.560
  204   1HD1  ILE  26          1HD1      ILE  26   2.770 -17.889  -6.369
  205   2HD1  ILE  26          2HD1      ILE  26   3.361 -16.238  -6.180
  206   3HD1  ILE  26          3HD1      ILE  26   2.309 -16.650  -7.536
  207    H    GLU  27           H        GLU  27   3.955 -14.251  -4.866
  208    HA   GLU  27           HA       GLU  27   6.339 -15.627  -3.898
  209   1HB   GLU  27          1HB       GLU  27   5.564 -15.245  -6.783
  210   2HB   GLU  27          2HB       GLU  27   7.246 -15.407  -6.303
  211   1HG   GLU  27          1HG       GLU  27   5.078 -17.438  -5.819
  212   2HG   GLU  27          2HG       GLU  27   6.310 -17.518  -7.078
  213    H    VAL  28           H        VAL  28   8.031 -14.298  -3.550
  214    HA   VAL  28           HA       VAL  28   7.632 -11.443  -4.111
  215    HB   VAL  28           HB       VAL  28   8.165 -12.591  -1.365
  216   1HG1  VAL  28          1HG1      VAL  28   8.031 -10.259  -0.602
  217   2HG1  VAL  28          2HG1      VAL  28   7.905  -9.725  -2.278
  218   3HG1  VAL  28          3HG1      VAL  28   9.376 -10.516  -1.710
  219   1HG2  VAL  28          1HG2      VAL  28   5.839 -12.837  -2.021
  220   2HG2  VAL  28          2HG2      VAL  28   5.762 -11.129  -2.446
  221   3HG2  VAL  28          3HG2      VAL  28   6.004 -11.609  -0.766
  222    H    ARG  29           H        ARG  29   9.475 -11.170  -5.304
  223    HA   ARG  29           HA       ARG  29  12.031 -12.193  -4.247
  224   1HB   ARG  29          1HB       ARG  29  11.194 -11.467  -7.058
  225   2HB   ARG  29          2HB       ARG  29  12.847 -11.846  -6.601
  226   1HG   ARG  29          1HG       ARG  29  12.212 -14.096  -6.012
  227   2HG   ARG  29          2HG       ARG  29  10.512 -13.723  -6.327
  228   1HD   ARG  29          1HD       ARG  29  10.926 -13.400  -8.644
  229   2HD   ARG  29          2HD       ARG  29  12.669 -13.432  -8.402
  230    HE   ARG  29           HE       ARG  29  11.265 -15.869  -7.697
  231   1HH1  ARG  29          1HH1      ARG  29  12.986 -14.058 -10.154
  232   2HH1  ARG  29          2HH1      ARG  29  13.465 -15.474 -11.051
  233   1HH2  ARG  29          1HH2      ARG  29  11.885 -17.745  -8.884
  234   2HH2  ARG  29          2HH2      ARG  29  12.803 -17.561 -10.348
  235    H    SER  30           H        SER  30  11.409 -10.037  -2.912
  236    HA   SER  30           HA       SER  30  12.803  -7.834  -4.252
  237   1HB   SER  30          1HB       SER  30  10.279  -7.514  -2.617
  238   2HB   SER  30          2HB       SER  30  11.143  -6.248  -3.491
  239    HG   SER  30           HG       SER  30  10.387  -6.979  -5.363
  240    H    ALA  31           H        ALA  31  14.583  -7.484  -3.085
  241    HA   ALA  31           HA       ALA  31  14.639  -7.912  -0.223
  242   1HB   ALA  31          1HB       ALA  31  16.586  -8.474  -1.617
  243   2HB   ALA  31          2HB       ALA  31  16.988  -7.285  -0.377
  244   3HB   ALA  31          3HB       ALA  31  16.757  -6.772  -2.049
  245    H    ASP  32           H        ASP  32  14.826  -5.197  -2.470
  246    HA   ASP  32           HA       ASP  32  14.676  -3.245  -0.309
  247   1HB   ASP  32          1HB       ASP  32  14.694  -2.896  -3.320
  248   2HB   ASP  32          2HB       ASP  32  14.706  -1.576  -2.156
  249    H    GLY  33           H        GLY  33  12.565  -5.169  -1.945
  250   1HA   GLY  33          1HA       GLY  33  10.231  -5.167  -1.896
  251   2HA   GLY  33          2HA       GLY  33  10.274  -3.514  -1.291
  252    H    SER  34           H        SER  34  12.225  -4.189  -4.009
  253    HA   SER  34           HA       SER  34  10.570  -2.446  -5.637
  254   1HB   SER  34          1HB       SER  34  12.624  -2.698  -7.196
  255   2HB   SER  34          2HB       SER  34  12.833  -1.814  -5.683
  256    HG   SER  34           HG       SER  34  13.908  -4.226  -6.493
  257    HA   PRO  35           HA       PRO  35   8.889  -5.628  -8.271
  258   1HB   PRO  35          1HB       PRO  35   9.381  -3.780 -10.528
  259   2HB   PRO  35          2HB       PRO  35   7.861  -4.472  -9.954
  260   1HG   PRO  35          1HG       PRO  35   8.436  -1.892  -9.568
  261   2HG   PRO  35          2HG       PRO  35   7.570  -2.838  -8.343
  262   1HD   PRO  35          1HD       PRO  35  10.455  -2.032  -8.423
  263   2HD   PRO  35          2HD       PRO  35   9.330  -2.056  -7.048
  264    HA   PRO  36           HA       PRO  36   8.368  -6.423 -10.537
  265   1HB   PRO  36          1HB       PRO  36   8.539  -8.914 -11.507
  266   2HB   PRO  36          2HB       PRO  36   9.038  -7.510 -12.458
  267   1HG   PRO  36          1HG       PRO  36  10.714  -9.459 -10.929
  268   2HG   PRO  36          2HG       PRO  36  10.998  -8.750 -12.530
  269   1HD   PRO  36          1HD       PRO  36  12.184  -7.853 -10.220
  270   2HD   PRO  36          2HD       PRO  36  11.919  -6.846 -11.654
  271    H    TYR  37           H        TYR  37   6.948  -8.463 -10.201
  272    HA   TYR  37           HA       TYR  37   7.599  -9.908  -7.703
  273   1HB   TYR  37          1HB       TYR  37   4.894  -8.678  -8.264
  274   2HB   TYR  37          2HB       TYR  37   5.402  -9.511  -6.800
  275    HD1  TYR  37           HD1      TYR  37   5.335  -6.371  -8.591
  276    HD2  TYR  37           HD2      TYR  37   7.012  -8.400  -5.250
  277    HE1  TYR  37           HE1      TYR  37   5.984  -4.214  -7.617
  278    HE2  TYR  37           HE2      TYR  37   7.668  -6.244  -4.263
  279    HH   TYR  37           HH       TYR  37   8.067  -3.967  -4.885
  280    H    VAL  38           H        VAL  38   5.928 -11.759  -7.438
  281    HA   VAL  38           HA       VAL  38   4.889 -12.567 -10.070
  282    HB   VAL  38           HB       VAL  38   6.499 -14.438  -8.307
  283   1HG1  VAL  38          1HG1      VAL  38   4.543 -15.535  -9.290
  284   2HG1  VAL  38          2HG1      VAL  38   6.021 -16.106 -10.064
  285   3HG1  VAL  38          3HG1      VAL  38   4.992 -14.932 -10.885
  286   1HG2  VAL  38          1HG2      VAL  38   6.995 -13.410 -11.101
  287   2HG2  VAL  38          2HG2      VAL  38   7.975 -14.612 -10.260
  288   3HG2  VAL  38          3HG2      VAL  38   7.899 -12.956  -9.656
  289    H    VAL  39           H        VAL  39   2.950 -13.239  -9.938
  290    HA   VAL  39           HA       VAL  39   1.790 -13.133  -7.271
  291    HB   VAL  39           HB       VAL  39   2.419 -10.909  -8.791
  292   1HG1  VAL  39          1HG1      VAL  39   0.699 -11.285 -10.407
  293   2HG1  VAL  39          2HG1      VAL  39   0.317  -9.862  -9.440
  294   3HG1  VAL  39          3HG1      VAL  39  -0.521 -11.384  -9.138
  295   1HG2  VAL  39          1HG2      VAL  39   1.107  -9.639  -7.186
  296   2HG2  VAL  39          2HG2      VAL  39   2.088 -10.895  -6.428
  297   3HG2  VAL  39          3HG2      VAL  39   0.354 -11.136  -6.637
  298    H    ARG  40           H        ARG  40  -0.690 -13.049  -7.615
  299    HA   ARG  40           HA       ARG  40  -1.477 -14.339 -10.112
  300   1HB   ARG  40          1HB       ARG  40  -2.363 -15.268  -7.366
  301   2HB   ARG  40          2HB       ARG  40  -3.017 -15.843  -8.888
  302   1HG   ARG  40          1HG       ARG  40  -0.389 -16.355  -9.249
  303   2HG   ARG  40          2HG       ARG  40  -0.538 -16.563  -7.503
  304   1HD   ARG  40          1HD       ARG  40  -2.150 -17.952  -9.640
  305   2HD   ARG  40          2HD       ARG  40  -0.917 -18.675  -8.610
  306    HE   ARG  40           HE       ARG  40  -2.606 -17.889  -6.753
  307   1HH1  ARG  40          1HH1      ARG  40  -3.352 -19.273  -9.878
  308   2HH1  ARG  40          2HH1      ARG  40  -4.763 -20.116  -9.325
  309   1HH2  ARG  40          1HH2      ARG  40  -4.473 -19.009  -6.009
  310   2HH2  ARG  40          2HH2      ARG  40  -5.413 -19.956  -7.128
  311    H    TRP  41           H        TRP  41  -3.508 -13.799 -10.741
  312    HA   TRP  41           HA       TRP  41  -4.611 -11.518  -9.289
  313   1HB   TRP  41          1HB       TRP  41  -4.944 -12.356 -12.190
  314   2HB   TRP  41          2HB       TRP  41  -5.717 -10.949 -11.454
  315    HD1  TRP  41           HD1      TRP  41  -2.105 -11.845 -10.593
  316    HE1  TRP  41           HE1      TRP  41  -0.543 -10.005 -11.442
  317    HE3  TRP  41           HE3      TRP  41  -5.458  -9.108 -13.287
  318    HZ2  TRP  41           HZ2      TRP  41  -0.682  -7.723 -13.029
  319    HZ3  TRP  41           HZ3      TRP  41  -4.631  -7.106 -14.408
  320    HH2  TRP  41           HH2      TRP  41  -2.310  -6.425 -14.310
  321    H    LEU  42           H        LEU  42  -5.767 -12.442  -7.801
  322    HA   LEU  42           HA       LEU  42  -6.257 -15.188  -7.953
  323   1HB   LEU  42          1HB       LEU  42  -7.590 -13.484  -5.909
  324   2HB   LEU  42          2HB       LEU  42  -6.860 -15.065  -5.734
  325    HG   LEU  42           HG       LEU  42  -5.440 -12.399  -5.933
  326   1HD1  LEU  42          1HD1      LEU  42  -5.587 -14.532  -3.804
  327   2HD1  LEU  42          2HD1      LEU  42  -6.424 -12.979  -3.782
  328   3HD1  LEU  42          3HD1      LEU  42  -4.662 -13.033  -3.709
  329   1HD2  LEU  42          1HD2      LEU  42  -4.220 -15.160  -5.840
  330   2HD2  LEU  42          2HD2      LEU  42  -3.355 -13.630  -5.692
  331   3HD2  LEU  42          3HD2      LEU  42  -4.167 -14.040  -7.202
  332    H    VAL  43           H        VAL  43  -8.700 -12.679  -7.318
  333    HA   VAL  43           HA       VAL  43 -10.835 -14.444  -7.626
  334    HB   VAL  43           HB       VAL  43 -12.123 -12.195  -7.980
  335   1HG1  VAL  43          1HG1      VAL  43 -12.194 -13.599  -5.990
  336   2HG1  VAL  43          2HG1      VAL  43 -12.113 -11.893  -5.549
  337   3HG1  VAL  43          3HG1      VAL  43 -10.671 -12.900  -5.441
  338   1HG2  VAL  43          1HG2      VAL  43  -9.484 -11.246  -6.876
  339   2HG2  VAL  43          2HG2      VAL  43 -10.962 -10.287  -6.969
  340   3HG2  VAL  43          3HG2      VAL  43 -10.154 -10.811  -8.449
  341    H    ASN  44           H        ASN  44  -9.174 -12.398  -9.910
  342    HA   ASN  44           HA       ASN  44 -10.828 -12.828 -12.122
  343   1HB   ASN  44          1HB       ASN  44  -7.821 -12.465 -12.025
  344   2HB   ASN  44          2HB       ASN  44  -8.791 -12.399 -13.495
  345   1HD2  ASN  44          1HD2      ASN  44  -7.951 -10.783 -10.538
  346   2HD2  ASN  44          2HD2      ASN  44  -8.674  -9.266 -10.929
  347    H    GLY  45           H        GLY  45  -7.763 -14.510 -11.392
  348   1HA   GLY  45          1HA       GLY  45  -7.891 -16.963 -11.105
  349   2HA   GLY  45          2HA       GLY  45  -8.955 -16.980 -12.501
  350    H    HIS  46           H        HIS  46  -5.756 -15.458 -11.865
  351    HA   HIS  46           HA       HIS  46  -4.654 -17.068 -14.056
  352   1HB   HIS  46          1HB       HIS  46  -5.464 -14.837 -14.932
  353   2HB   HIS  46          2HB       HIS  46  -4.239 -14.075 -13.924
  354    HD1  HIS  46           HD1      HIS  46  -4.156 -16.953 -16.448
  355    HD2  HIS  46           HD2      HIS  46  -2.112 -13.463 -15.451
  356    HE1  HIS  46           HE1      HIS  46  -2.238 -16.798 -18.067
  357    HE2  HIS  46           HE2      HIS  46  -0.903 -14.800 -17.310
  358    H    GLU  47           H        GLU  47  -2.186 -16.667 -14.230
  359    HA   GLU  47           HA       GLU  47  -0.939 -16.297 -11.584
  360   1HB   GLU  47          1HB       GLU  47  -0.372 -18.628 -13.440
  361   2HB   GLU  47          2HB       GLU  47   0.369 -18.342 -11.878
  362   1HG   GLU  47          1HG       GLU  47  -1.169 -20.054 -11.524
  363   2HG   GLU  47          2HG       GLU  47  -1.954 -18.610 -10.891
  364    H    THR  48           H        THR  48   0.566 -14.727 -11.914
  365    HA   THR  48           HA       THR  48   1.953 -14.616 -14.475
  366    HB   THR  48           HB       THR  48  -0.119 -13.401 -14.754
  367    HG1  THR  48           HG1      THR  48   0.943 -12.147 -16.061
  368   1HG2  THR  48          1HG2      THR  48   0.942 -11.550 -12.644
  369   2HG2  THR  48          2HG2      THR  48  -0.480 -12.585 -12.514
  370   3HG2  THR  48          3HG2      THR  48  -0.470 -11.244 -13.653
  371    H    THR  49           H        THR  49   3.239 -12.464 -14.544
  372    HA   THR  49           HA       THR  49   4.591 -11.857 -12.010
  373    HB   THR  49           HB       THR  49   5.983 -12.525 -14.630
  374    HG1  THR  49           HG1      THR  49   5.200 -14.111 -12.655
  375   1HG2  THR  49          1HG2      THR  49   8.074 -12.206 -13.412
  376   2HG2  THR  49          2HG2      THR  49   7.177 -11.744 -11.965
  377   3HG2  THR  49          3HG2      THR  49   7.117 -10.726 -13.407
  378    H    VAL  50           H        VAL  50   4.662  -9.645 -11.814
  379    HA   VAL  50           HA       VAL  50   4.033  -8.048 -14.216
  380    HB   VAL  50           HB       VAL  50   2.152  -6.949 -12.983
  381   1HG1  VAL  50          1HG1      VAL  50   1.768  -8.558 -14.775
  382   2HG1  VAL  50          2HG1      VAL  50   0.527  -8.682 -13.526
  383   3HG1  VAL  50          3HG1      VAL  50   1.823  -9.877 -13.605
  384   1HG2  VAL  50          1HG2      VAL  50   1.075  -8.217 -11.171
  385   2HG2  VAL  50          2HG2      VAL  50   2.687  -7.656 -10.724
  386   3HG2  VAL  50          3HG2      VAL  50   2.435  -9.343 -11.171
  387    H    TYR  51           H        TYR  51   3.579  -5.724 -13.504
  388    HA   TYR  51           HA       TYR  51   5.311  -4.773 -11.337
  389   1HB   TYR  51          1HB       TYR  51   5.283  -3.396 -14.023
  390   2HB   TYR  51          2HB       TYR  51   6.429  -3.197 -12.708
  391    HD1  TYR  51           HD1      TYR  51   8.361  -4.619 -12.531
  392    HD2  TYR  51           HD2      TYR  51   5.421  -5.344 -15.517
  393    HE1  TYR  51           HE1      TYR  51   9.905  -6.158 -13.674
  394    HE2  TYR  51           HE2      TYR  51   6.950  -6.890 -16.663
  395    HH   TYR  51           HH       TYR  51   9.448  -7.224 -16.814
  396    HA   PRO  52           HA       PRO  52   1.642  -2.179 -10.912
  397   1HB   PRO  52          1HB       PRO  52   3.110  -0.444  -9.108
  398   2HB   PRO  52          2HB       PRO  52   1.848  -1.618  -8.729
  399   1HG   PRO  52          1HG       PRO  52   4.460  -1.912  -7.985
  400   2HG   PRO  52          2HG       PRO  52   3.357  -3.272  -8.250
  401   1HD   PRO  52          1HD       PRO  52   5.465  -2.159 -10.060
  402   2HD   PRO  52          2HD       PRO  52   5.025  -3.852  -9.745
  403    H    GLY  53           H        GLY  53   4.769  -0.416 -11.021
  404   1HA   GLY  53          1HA       GLY  53   5.239   0.991 -12.948
  405   2HA   GLY  53          2HA       GLY  53   3.527   1.382 -13.002
  406    H    SER  54           H        SER  54   2.746   2.361 -10.797
  407    HA   SER  54           HA       SER  54   4.296   4.752 -10.428
  408   1HB   SER  54          1HB       SER  54   1.743   3.896  -9.075
  409   2HB   SER  54          2HB       SER  54   2.427   5.521  -9.071
  410    HG   SER  54           HG       SER  54   2.181   4.579 -11.597
  411    H    ASP  55           H        ASP  55   3.884   5.465  -7.832
  412    HA   ASP  55           HA       ASP  55   6.051   4.210  -6.530
  413   1HB   ASP  55          1HB       ASP  55   5.363   6.571  -6.167
  414   2HB   ASP  55          2HB       ASP  55   3.930   6.002  -5.320
  415    H    ALA  56           H        ALA  56   2.976   3.117  -6.990
  416    HA   ALA  56           HA       ALA  56   2.053   1.126  -6.387
  417   1HB   ALA  56          1HB       ALA  56   4.454   0.738  -4.608
  418   2HB   ALA  56          2HB       ALA  56   4.360   0.279  -6.308
  419   3HB   ALA  56          3HB       ALA  56   3.312  -0.500  -5.122
  420    H    VAL  57           H        VAL  57   0.852   0.093  -4.711
  421    HA   VAL  57           HA       VAL  57   0.710   1.470  -2.122
  422    HB   VAL  57           HB       VAL  57  -1.766   0.656  -3.670
  423   1HG1  VAL  57          1HG1      VAL  57  -2.055   0.705  -1.267
  424   2HG1  VAL  57          2HG1      VAL  57  -2.943   2.033  -2.015
  425   3HG1  VAL  57          3HG1      VAL  57  -1.410   2.346  -1.199
  426   1HG2  VAL  57          1HG2      VAL  57  -2.185   3.026  -4.104
  427   2HG2  VAL  57          2HG2      VAL  57  -0.698   2.478  -4.879
  428   3HG2  VAL  57          3HG2      VAL  57  -0.621   3.431  -3.397
  429    H    VAL  58           H        VAL  58  -0.629   0.026  -0.581
  430    HA   VAL  58           HA       VAL  58  -0.063  -2.804  -1.131
  431    HB   VAL  58           HB       VAL  58   0.915  -1.366   1.350
  432   1HG1  VAL  58          1HG1      VAL  58   1.338  -4.197   0.411
  433   2HG1  VAL  58          2HG1      VAL  58   0.314  -3.684   1.753
  434   3HG1  VAL  58          3HG1      VAL  58   2.063  -3.470   1.845
  435   1HG2  VAL  58          1HG2      VAL  58   2.529  -2.416  -0.970
  436   2HG2  VAL  58          2HG2      VAL  58   3.180  -1.727   0.517
  437   3HG2  VAL  58          3HG2      VAL  58   2.251  -0.717  -0.592
  438    H    VAL  59           H        VAL  59  -1.655  -4.025  -0.465
  439    HA   VAL  59           HA       VAL  59  -3.668  -2.977   1.375
  440    HB   VAL  59           HB       VAL  59  -5.168  -4.025  -0.650
  441   1HG1  VAL  59          1HG1      VAL  59  -5.768  -1.703  -1.162
  442   2HG1  VAL  59          2HG1      VAL  59  -4.353  -1.152  -0.265
  443   3HG1  VAL  59          3HG1      VAL  59  -5.661  -1.985   0.575
  444   1HG2  VAL  59          1HG2      VAL  59  -3.271  -4.184  -2.143
  445   2HG2  VAL  59          2HG2      VAL  59  -2.907  -2.477  -1.893
  446   3HG2  VAL  59          3HG2      VAL  59  -4.394  -2.950  -2.714
  447    H    THR  60           H        THR  60  -5.555  -4.631   1.303
  448    HA   THR  60           HA       THR  60  -4.435  -7.354   1.775
  449    HB   THR  60           HB       THR  60  -6.266  -7.332   3.624
  450    HG1  THR  60           HG1      THR  60  -6.022  -4.573   3.782
  451   1HG2  THR  60          1HG2      THR  60  -3.929  -5.446   3.880
  452   2HG2  THR  60          2HG2      THR  60  -3.869  -7.194   4.108
  453   3HG2  THR  60          3HG2      THR  60  -4.808  -6.192   5.216
  454    H    ALA  61           H        ALA  61  -6.881  -8.546   2.479
  455    HA   ALA  61           HA       ALA  61  -7.901  -9.391   0.060
  456   1HB   ALA  61          1HB       ALA  61  -7.991 -10.648   2.160
  457   2HB   ALA  61          2HB       ALA  61  -9.549 -10.589   1.336
  458   3HB   ALA  61          3HB       ALA  61  -9.253  -9.561   2.737
  459    H    THR  62           H        THR  62  -9.425  -6.992   2.274
  460    HA   THR  62           HA       THR  62 -11.904  -6.959   0.903
  461    HB   THR  62           HB       THR  62 -11.723  -4.400   1.771
  462    HG1  THR  62           HG1      THR  62 -10.632  -4.504   3.792
  463   1HG2  THR  62          1HG2      THR  62 -12.485  -6.843   3.364
  464   2HG2  THR  62          2HG2      THR  62 -13.523  -5.953   2.250
  465   3HG2  THR  62          3HG2      THR  62 -12.963  -5.188   3.739
  466    H    GLU  63           H        GLU  63  -9.271  -4.611   0.675
  467    HA   GLU  63           HA       GLU  63 -10.340  -3.135  -1.443
  468   1HB   GLU  63          1HB       GLU  63  -7.418  -3.651  -0.874
  469   2HB   GLU  63          2HB       GLU  63  -8.086  -2.288  -1.763
  470   1HG   GLU  63          1HG       GLU  63  -8.640  -2.863   1.139
  471   2HG   GLU  63          2HG       GLU  63  -7.403  -1.751   0.560
  472    H    HIS  64           H        HIS  64  -8.835  -6.195  -1.327
  473    HA   HIS  64           HA       HIS  64  -7.773  -6.440  -3.871
  474   1HB   HIS  64          1HB       HIS  64  -7.077  -8.312  -2.932
  475   2HB   HIS  64          2HB       HIS  64  -8.210  -8.102  -1.611
  476    HD1  HIS  64           HD1      HIS  64  -7.848  -9.863  -4.932
  477    HD2  HIS  64           HD2      HIS  64 -10.282  -9.925  -1.557
  478    HE1  HIS  64           HE1      HIS  64  -9.189 -11.978  -5.092
  479    HE2  HIS  64           HE2      HIS  64 -10.402 -12.129  -2.893
  480    H    ALA  65           H        ALA  65 -11.107  -7.043  -2.813
  481    HA   ALA  65           HA       ALA  65 -11.820  -8.801  -4.850
  482   1HB   ALA  65          1HB       ALA  65 -14.123  -8.296  -4.177
  483   2HB   ALA  65          2HB       ALA  65 -13.550  -6.882  -3.290
  484   3HB   ALA  65          3HB       ALA  65 -13.071  -8.499  -2.776
  485    H    GLU  66           H        GLU  66 -13.071  -5.557  -4.546
  486    HA   GLU  66           HA       GLU  66 -14.157  -5.317  -7.096
  487   1HB   GLU  66          1HB       GLU  66 -13.898  -2.773  -6.447
  488   2HB   GLU  66          2HB       GLU  66 -15.003  -3.821  -5.564
  489   1HG   GLU  66          1HG       GLU  66 -13.874  -3.573  -3.644
  490   2HG   GLU  66          2HG       GLU  66 -12.319  -3.860  -4.425
  491    H    ALA  67           H        ALA  67 -11.211  -3.853  -5.819
  492    HA   ALA  67           HA       ALA  67 -10.331  -2.580  -8.117
  493   1HB   ALA  67          1HB       ALA  67  -9.440  -2.122  -5.884
  494   2HB   ALA  67          2HB       ALA  67  -8.154  -2.468  -7.040
  495   3HB   ALA  67          3HB       ALA  67  -8.649  -3.698  -5.879
  496    H    GLU  68           H        GLU  68  -9.683  -5.888  -6.986
  497    HA   GLU  68           HA       GLU  68  -7.675  -6.473  -8.831
  498   1HB   GLU  68          1HB       GLU  68  -8.710  -7.867  -6.814
  499   2HB   GLU  68          2HB       GLU  68  -9.599  -8.628  -8.128
  500   1HG   GLU  68          1HG       GLU  68  -7.730  -9.574  -9.031
  501   2HG   GLU  68          2HG       GLU  68  -6.656  -8.329  -8.390
  502    H    LYS  69           H        LYS  69 -11.196  -7.028  -9.058
  503    HA   LYS  69           HA       LYS  69 -11.143  -8.145 -11.626
  504   1HB   LYS  69          1HB       LYS  69 -13.095  -7.675  -9.868
  505   2HB   LYS  69          2HB       LYS  69 -13.359  -6.281 -10.904
  506   1HG   LYS  69          1HG       LYS  69 -14.778  -7.830 -11.825
  507   2HG   LYS  69          2HG       LYS  69 -13.333  -8.045 -12.816
  508   1HD   LYS  69          1HD       LYS  69 -12.655  -9.932 -11.425
  509   2HD   LYS  69          2HD       LYS  69 -14.085  -9.710 -10.416
  510   1HE   LYS  69          1HE       LYS  69 -14.587 -11.465 -11.918
  511   2HE   LYS  69          2HE       LYS  69 -15.471 -10.045 -12.480
  512   1HZ   LYS  69          1HZ       LYS  69 -13.457  -9.696 -14.003
  513   2HZ   LYS  69          2HZ       LYS  69 -14.546 -10.931 -14.395
  514   3HZ   LYS  69          3HZ       LYS  69 -13.073 -11.314 -13.655
  515    H    ARG  70           H        ARG  70 -12.341  -4.848 -10.995
  516    HA   ARG  70           HA       ARG  70 -12.153  -3.991 -13.644
  517   1HB   ARG  70          1HB       ARG  70 -13.655  -3.073 -12.077
  518   2HB   ARG  70          2HB       ARG  70 -12.367  -2.698 -10.950
  519   1HG   ARG  70          1HG       ARG  70 -11.578  -0.945 -12.377
  520   2HG   ARG  70          2HG       ARG  70 -12.794  -1.365 -13.596
  521   1HD   ARG  70          1HD       ARG  70 -13.367   0.511 -12.049
  522   2HD   ARG  70          2HD       ARG  70 -14.571  -0.747 -12.184
  523    HE   ARG  70           HE       ARG  70 -12.662  -0.631  -9.932
  524   1HH1  ARG  70          1HH1      ARG  70 -15.954  -0.808 -11.158
  525   2HH1  ARG  70          2HH1      ARG  70 -16.655  -0.998  -9.575
  526   1HH2  ARG  70          1HH2      ARG  70 -13.613  -0.868  -7.856
  527   2HH2  ARG  70          2HH2      ARG  70 -15.340  -1.068  -7.720
  528    H    ALA  71           H        ALA  71 -10.288  -2.897 -10.896
  529    HA   ALA  71           HA       ALA  71  -8.558  -1.270 -12.324
  530   1HB   ALA  71          1HB       ALA  71  -8.175  -2.453  -9.594
  531   2HB   ALA  71          2HB       ALA  71  -9.107  -1.002  -9.970
  532   3HB   ALA  71          3HB       ALA  71  -7.365  -1.031 -10.252
  533    H    ALA  72           H        ALA  72  -7.954  -4.673 -11.113
  534    HA   ALA  72           HA       ALA  72  -5.264  -4.672 -11.977
  535   1HB   ALA  72          1HB       ALA  72  -7.061  -7.079 -11.864
  536   2HB   ALA  72          2HB       ALA  72  -6.091  -6.448 -10.532
  537   3HB   ALA  72          3HB       ALA  72  -5.302  -7.083 -11.975
  538    H    ALA  73           H        ALA  73  -8.281  -5.346 -13.759
  539    HA   ALA  73           HA       ALA  73  -7.083  -6.287 -16.104
  540   1HB   ALA  73          1HB       ALA  73  -9.514  -6.232 -15.786
  541   2HB   ALA  73          2HB       ALA  73  -9.054  -5.444 -17.295
  542   3HB   ALA  73          3HB       ALA  73  -9.493  -4.472 -15.890
  543    H    ARG  74           H        ARG  74  -7.611  -2.964 -14.994
  544    HA   ARG  74           HA       ARG  74  -6.227  -1.645 -17.066
  545   1HB   ARG  74          1HB       ARG  74  -6.591  -0.937 -14.174
  546   2HB   ARG  74          2HB       ARG  74  -5.628   0.068 -15.247
  547   1HG   ARG  74          1HG       ARG  74  -7.847  -0.166 -16.730
  548   2HG   ARG  74          2HG       ARG  74  -8.544  -0.314 -15.114
  549   1HD   ARG  74          1HD       ARG  74  -8.527   2.014 -15.824
  550   2HD   ARG  74          2HD       ARG  74  -7.443   1.773 -14.454
  551    HE   ARG  74           HE       ARG  74  -6.268   1.677 -17.127
  552   1HH1  ARG  74          1HH1      ARG  74  -6.818   3.509 -14.189
  553   2HH1  ARG  74          2HH1      ARG  74  -5.546   4.640 -14.517
  554   1HH2  ARG  74          1HH2      ARG  74  -4.589   3.160 -17.550
  555   2HH2  ARG  74          2HH2      ARG  74  -4.267   4.445 -16.417
  556    H    ALA  75           H        ALA  75  -4.897  -2.808 -13.958
  557    HA   ALA  75           HA       ALA  75  -2.294  -2.002 -14.025
  558   1HB   ALA  75          1HB       ALA  75  -3.238  -3.303 -12.187
  559   2HB   ALA  75          2HB       ALA  75  -1.702  -3.983 -12.725
  560   3HB   ALA  75          3HB       ALA  75  -3.219  -4.752 -13.190
  561    H    GLY  76           H        GLY  76  -3.565  -4.891 -15.667
  562   1HA   GLY  76          1HA       GLY  76  -0.861  -5.161 -16.863
  563   2HA   GLY  76          2HA       GLY  76  -1.888  -6.544 -16.515
  564    H    HIS  77           H        HIS  77  -2.928  -3.490 -17.900
  565    HA   HIS  77           HA       HIS  77  -4.236  -4.696 -20.103
  566   1HB   HIS  77          1HB       HIS  77  -4.892  -2.516 -19.128
  567   2HB   HIS  77          2HB       HIS  77  -3.400  -1.808 -19.732
  568    HD1  HIS  77           HD1      HIS  77  -6.716  -3.148 -20.907
  569    HD2  HIS  77           HD2      HIS  77  -3.441  -1.060 -22.398
  570    HE1  HIS  77           HE1      HIS  77  -7.407  -2.331 -23.184
  571    HE2  HIS  77           HE2      HIS  77  -5.337  -1.268 -24.150
  572    H    ALA  78           H        ALA  78  -1.002  -3.612 -19.592
  573    HA   ALA  78           HA       ALA  78  -0.404  -3.990 -22.455
  574   1HB   ALA  78          1HB       ALA  78   0.039  -1.707 -21.679
  575   2HB   ALA  78          2HB       ALA  78   1.529  -2.532 -22.137
  576   3HB   ALA  78          3HB       ALA  78   1.115  -2.341 -20.433
  577    H    ALA  79           H        ALA  79  -0.498  -5.845 -19.977
  578    HA   ALA  79           HA       ALA  79   2.197  -6.971 -20.347
  579   1HB   ALA  79          1HB       ALA  79   2.207  -7.692 -18.025
  580   2HB   ALA  79          2HB       ALA  79   0.623  -6.958 -17.777
  581   3HB   ALA  79          3HB       ALA  79   2.021  -5.940 -18.130
  582    H    THR  80           H        THR  80   1.686  -8.561 -21.775
  583    HA   THR  80           HA       THR  80   0.110 -10.765 -20.702
  584    HB   THR  80           HB       THR  80  -0.352  -9.749 -23.515
  585    HG1  THR  80           HG1      THR  80  -1.462  -9.016 -21.103
  586   1HG2  THR  80          1HG2      THR  80  -0.721 -12.154 -23.221
  587   2HG2  THR  80          2HG2      THR  80  -2.247 -11.311 -23.480
  588   3HG2  THR  80          3HG2      THR  80  -1.792 -11.828 -21.857
  Start of MODEL    3
    1    H    MET   1           H        MET   1   9.772   1.600   2.313
    2    HA   MET   1           HA       MET   1   7.866   1.237   0.953
    3   1HB   MET   1          1HB       MET   1   9.290   1.595  -1.180
    4   2HB   MET   1          2HB       MET   1   9.675  -0.114  -1.052
    5   1HG   MET   1          1HG       MET   1   6.858   0.924  -1.201
    6   2HG   MET   1          2HG       MET   1   7.809   0.509  -2.624
    7   1HE   MET   1          1HE       MET   1   5.246  -2.446  -2.396
    8   2HE   MET   1          2HE       MET   1   5.921  -1.178  -3.422
    9   3HE   MET   1          3HE       MET   1   4.954  -0.749  -2.011
   10    H    HIS   2           H        HIS   2   6.737  -0.691   1.313
   11    HA   HIS   2           HA       HIS   2   8.328  -3.017   2.073
   12   1HB   HIS   2          1HB       HIS   2   7.211  -3.298   4.197
   13   2HB   HIS   2          2HB       HIS   2   7.939  -1.698   4.149
   14    HD1  HIS   2           HD1      HIS   2   4.966  -3.301   5.181
   15    HD2  HIS   2           HD2      HIS   2   5.782   0.299   3.272
   16    HE1  HIS   2           HE1      HIS   2   2.927  -1.871   5.535
   17    HE2  HIS   2           HE2      HIS   2   3.356   0.212   4.178
   18    H    ALA   3           H        ALA   3   7.545  -4.743   1.126
   19    HA   ALA   3           HA       ALA   3   4.646  -5.068   0.839
   20   1HB   ALA   3          1HB       ALA   3   5.455  -4.224  -1.318
   21   2HB   ALA   3          2HB       ALA   3   4.902  -5.892  -1.450
   22   3HB   ALA   3          3HB       ALA   3   6.628  -5.538  -1.393
   23    H    LYS   4           H        LYS   4   3.965  -7.203   1.050
   24    HA   LYS   4           HA       LYS   4   6.044  -9.236   1.299
   25   1HB   LYS   4          1HB       LYS   4   5.165 -10.077   3.398
   26   2HB   LYS   4          2HB       LYS   4   5.643  -8.396   3.575
   27   1HG   LYS   4          1HG       LYS   4   3.288  -7.722   3.403
   28   2HG   LYS   4          2HG       LYS   4   2.825  -9.421   3.262
   29   1HD   LYS   4          1HD       LYS   4   3.880  -9.843   5.468
   30   2HD   LYS   4          2HD       LYS   4   4.210  -8.116   5.606
   31   1HE   LYS   4          1HE       LYS   4   1.479  -9.381   5.378
   32   2HE   LYS   4          2HE       LYS   4   2.207  -8.768   6.861
   33   1HZ   LYS   4          1HZ       LYS   4   2.315  -6.554   5.717
   34   2HZ   LYS   4          2HZ       LYS   4   0.758  -7.106   6.072
   35   3HZ   LYS   4          3HZ       LYS   4   1.346  -7.211   4.485
   36    H    VAL   5           H        VAL   5   5.217 -11.410   1.301
   37    HA   VAL   5           HA       VAL   5   3.129 -11.822  -0.610
   38    HB   VAL   5           HB       VAL   5   5.003 -13.342  -0.588
   39   1HG1  VAL   5          1HG1      VAL   5   5.540 -14.778   1.327
   40   2HG1  VAL   5          2HG1      VAL   5   4.286 -13.977   2.273
   41   3HG1  VAL   5          3HG1      VAL   5   5.693 -13.067   1.725
   42   1HG2  VAL   5          1HG2      VAL   5   2.889 -14.386  -1.183
   43   2HG2  VAL   5          2HG2      VAL   5   2.587 -14.777   0.510
   44   3HG2  VAL   5          3HG2      VAL   5   3.931 -15.535  -0.344
   45    H    GLY   6           H        GLY   6   1.130 -13.008  -0.202
   46   1HA   GLY   6          1HA       GLY   6  -0.710 -13.641   1.109
   47   2HA   GLY   6          2HA       GLY   6   0.203 -13.216   2.556
   48    H    ASP   7           H        ASP   7   0.257 -11.040   0.013
   49    HA   ASP   7           HA       ASP   7  -1.794  -9.185   1.179
   50   1HB   ASP   7          1HB       ASP   7   1.185  -8.754   0.915
   51   2HB   ASP   7          2HB       ASP   7   0.085  -7.401   0.699
   52    H    TYR   8           H        TYR   8  -1.532  -7.157  -0.324
   53    HA   TYR   8           HA       TYR   8  -1.702  -8.164  -3.092
   54   1HB   TYR   8          1HB       TYR   8  -3.807  -6.568  -1.595
   55   2HB   TYR   8          2HB       TYR   8  -3.824  -6.829  -3.326
   56    HD1  TYR   8           HD1      TYR   8  -4.180  -8.531  -0.045
   57    HD2  TYR   8           HD2      TYR   8  -4.783  -8.747  -4.248
   58    HE1  TYR   8           HE1      TYR   8  -5.651 -10.489   0.255
   59    HE2  TYR   8           HE2      TYR   8  -6.241 -10.708  -3.955
   60    HH   TYR   8           HH       TYR   8  -6.425 -12.571  -2.073
   61    H    LEU   9           H        LEU   9  -2.185  -6.204  -4.562
   62    HA   LEU   9           HA       LEU   9  -0.554  -3.942  -3.671
   63   1HB   LEU   9          1HB       LEU   9   1.000  -5.549  -4.601
   64   2HB   LEU   9          2HB       LEU   9   0.006  -5.748  -6.026
   65    HG   LEU   9           HG       LEU   9   1.171  -3.050  -5.448
   66   1HD1  LEU   9          1HD1      LEU   9   2.645  -5.349  -6.722
   67   2HD1  LEU   9          2HD1      LEU   9   3.038  -4.597  -5.177
   68   3HD1  LEU   9          3HD1      LEU   9   3.192  -3.674  -6.671
   69   1HD2  LEU   9          1HD2      LEU   9   1.216  -2.936  -7.893
   70   2HD2  LEU   9          2HD2      LEU   9  -0.402  -3.299  -7.299
   71   3HD2  LEU   9          3HD2      LEU   9   0.592  -4.584  -7.984
   72    H    VAL  10           H        VAL  10  -1.092  -2.065  -4.539
   73    HA   VAL  10           HA       VAL  10  -2.703  -1.963  -6.982
   74    HB   VAL  10           HB       VAL  10  -3.354  -0.210  -4.597
   75   1HG1  VAL  10          1HG1      VAL  10  -4.855  -0.787  -7.146
   76   2HG1  VAL  10          2HG1      VAL  10  -3.987   0.700  -6.761
   77   3HG1  VAL  10          3HG1      VAL  10  -5.419   0.248  -5.834
   78   1HG2  VAL  10          1HG2      VAL  10  -5.357  -1.564  -4.247
   79   2HG2  VAL  10          2HG2      VAL  10  -3.887  -2.502  -3.986
   80   3HG2  VAL  10          3HG2      VAL  10  -4.804  -2.698  -5.479
   81    H    VAL  11           H        VAL  11  -2.704   0.359  -7.806
   82    HA   VAL  11           HA       VAL  11  -0.310   1.857  -6.967
   83    HB   VAL  11           HB       VAL  11  -1.012   1.163  -9.834
   84   1HG1  VAL  11          1HG1      VAL  11  -0.139   3.421  -9.676
   85   2HG1  VAL  11          2HG1      VAL  11   1.042   2.355 -10.437
   86   3HG1  VAL  11          3HG1      VAL  11   1.246   2.840  -8.753
   87   1HG2  VAL  11          1HG2      VAL  11   0.033  -0.706  -8.675
   88   2HG2  VAL  11          2HG2      VAL  11   1.354   0.340  -8.151
   89   3HG2  VAL  11          3HG2      VAL  11   1.138  -0.018  -9.865
   90    H    LYS  12           H        LYS  12  -0.486   4.069  -7.193
   91    HA   LYS  12           HA       LYS  12  -3.115   5.102  -7.033
   92   1HB   LYS  12          1HB       LYS  12  -1.150   6.032  -5.836
   93   2HB   LYS  12          2HB       LYS  12  -0.520   6.614  -7.370
   94   1HG   LYS  12          1HG       LYS  12  -2.558   8.001  -7.619
   95   2HG   LYS  12          2HG       LYS  12  -3.056   7.481  -6.010
   96   1HD   LYS  12          1HD       LYS  12  -0.487   8.933  -6.636
   97   2HD   LYS  12          2HD       LYS  12  -1.954   9.700  -6.028
   98   1HE   LYS  12          1HE       LYS  12  -0.993   9.376  -4.020
   99   2HE   LYS  12          2HE       LYS  12  -1.622   7.739  -4.196
  100   1HZ   LYS  12          1HZ       LYS  12   0.536   7.062  -5.109
  101   2HZ   LYS  12          2HZ       LYS  12   0.694   7.709  -3.549
  102   3HZ   LYS  12          3HZ       LYS  12   1.125   8.636  -4.896
  103    H    GLY  13           H        GLY  13  -0.562   6.097  -9.328
  104   1HA   GLY  13          1HA       GLY  13  -0.692   6.534 -11.594
  105   2HA   GLY  13          2HA       GLY  13  -2.303   5.833 -11.595
  106    H    THR  14           H        THR  14  -3.771   7.380 -10.025
  107    HA   THR  14           HA       THR  14  -3.523  10.075 -11.196
  108    HB   THR  14           HB       THR  14  -6.094   8.810 -10.234
  109    HG1  THR  14           HG1      THR  14  -4.701   7.928 -12.226
  110   1HG2  THR  14          1HG2      THR  14  -7.123  10.483 -11.697
  111   2HG2  THR  14          2HG2      THR  14  -5.528  11.071 -12.162
  112   3HG2  THR  14          3HG2      THR  14  -6.085  11.254 -10.500
  113    H    THR  15           H        THR  15  -3.619  11.813  -9.827
  114    HA   THR  15           HA       THR  15  -2.758  11.418  -7.194
  115    HB   THR  15           HB       THR  15  -3.904  13.955  -8.377
  116    HG1  THR  15           HG1      THR  15  -2.220  13.766  -9.654
  117   1HG2  THR  15          1HG2      THR  15  -3.601  14.073  -5.949
  118   2HG2  THR  15          2HG2      THR  15  -2.417  15.082  -6.779
  119   3HG2  THR  15          3HG2      THR  15  -1.936  13.518  -6.122
  120    H    THR  16           H        THR  16  -5.968  11.665  -8.461
  121    HA   THR  16           HA       THR  16  -7.220  12.369  -5.974
  122    HB   THR  16           HB       THR  16  -8.212  12.890  -8.210
  123    HG1  THR  16           HG1      THR  16  -9.447  12.394  -6.069
  124   1HG2  THR  16          1HG2      THR  16  -9.423  11.132  -9.412
  125   2HG2  THR  16          2HG2      THR  16  -8.785   9.928  -8.289
  126   3HG2  THR  16          3HG2      THR  16  -7.689  10.804  -9.360
  127    H    GLU  17           H        GLU  17  -9.315  10.567  -5.703
  128    HA   GLU  17           HA       GLU  17  -7.959   8.475  -4.281
  129   1HB   GLU  17          1HB       GLU  17 -10.893   9.082  -4.657
  130   2HB   GLU  17          2HB       GLU  17 -10.289   7.776  -3.651
  131   1HG   GLU  17          1HG       GLU  17 -10.809   9.587  -2.223
  132   2HG   GLU  17          2HG       GLU  17  -9.053   9.484  -2.313
  133    H    ARG  18           H        ARG  18  -7.684   8.309  -7.178
  134    HA   ARG  18           HA       ARG  18  -9.240   5.915  -7.822
  135   1HB   ARG  18          1HB       ARG  18  -9.193   7.628  -9.555
  136   2HB   ARG  18          2HB       ARG  18  -7.435   7.616  -9.554
  137   1HG   ARG  18          1HG       ARG  18  -7.358   5.436 -10.484
  138   2HG   ARG  18          2HG       ARG  18  -9.088   5.199 -10.233
  139   1HD   ARG  18          1HD       ARG  18  -7.858   7.235 -12.089
  140   2HD   ARG  18          2HD       ARG  18  -8.533   5.682 -12.583
  141    HE   ARG  18           HE       ARG  18 -10.340   7.385 -11.092
  142   1HH1  ARG  18          1HH1      ARG  18  -9.189   6.430 -14.257
  143   2HH1  ARG  18          2HH1      ARG  18 -10.617   6.974 -15.082
  144   1HH2  ARG  18          1HH2      ARG  18 -12.202   8.104 -12.155
  145   2HH2  ARG  18          2HH2      ARG  18 -12.329   7.969 -13.885
  146    H    HIS  19           H        HIS  19  -8.354   3.935  -7.935
  147    HA   HIS  19           HA       HIS  19  -5.444   3.675  -7.845
  148   1HB   HIS  19          1HB       HIS  19  -7.351   2.353  -5.900
  149   2HB   HIS  19          2HB       HIS  19  -5.661   1.906  -6.087
  150    HD1  HIS  19           HD1      HIS  19  -3.884   3.669  -5.267
  151    HD2  HIS  19           HD2      HIS  19  -7.831   4.573  -4.342
  152    HE1  HIS  19           HE1      HIS  19  -3.771   5.460  -3.506
  153    HE2  HIS  19           HE2      HIS  19  -6.171   5.840  -2.820
  154    H    ASP  20           H        ASP  20  -4.881   2.393  -9.452
  155    HA   ASP  20           HA       ASP  20  -6.619   0.107 -10.085
  156   1HB   ASP  20          1HB       ASP  20  -5.309   2.041 -11.971
  157   2HB   ASP  20          2HB       ASP  20  -5.645   0.390 -12.484
  158    H    GLN  21           H        GLN  21  -5.131  -1.334 -11.744
  159    HA   GLN  21           HA       GLN  21  -3.577  -2.982 -11.718
  160   1HB   GLN  21          1HB       GLN  21  -1.830  -1.027 -10.208
  161   2HB   GLN  21          2HB       GLN  21  -1.296  -2.494 -11.013
  162   1HG   GLN  21          1HG       GLN  21  -2.158  -1.468 -13.159
  163   2HG   GLN  21          2HG       GLN  21  -2.308   0.041 -12.258
  164   1HE2  GLN  21          1HE2      GLN  21  -0.755   1.112 -13.447
  165   2HE2  GLN  21          2HE2      GLN  21   0.925   0.730 -13.341
  166    H    HIS  22           H        HIS  22  -4.556  -4.539 -10.434
  167    HA   HIS  22           HA       HIS  22  -3.720  -4.542  -7.631
  168   1HB   HIS  22          1HB       HIS  22  -6.025  -3.548  -7.808
  169   2HB   HIS  22          2HB       HIS  22  -6.585  -5.106  -8.401
  170    HD1  HIS  22           HD1      HIS  22  -7.246  -3.516  -5.609
  171    HD2  HIS  22           HD2      HIS  22  -4.999  -6.969  -6.136
  172    HE1  HIS  22           HE1      HIS  22  -7.329  -4.720  -3.407
  173    HE2  HIS  22           HE2      HIS  22  -6.103  -6.885  -3.810
  174    H    ALA  23           H        ALA  23  -2.872  -6.325  -7.123
  175    HA   ALA  23           HA       ALA  23  -3.758  -8.951  -8.122
  176   1HB   ALA  23          1HB       ALA  23  -1.465  -9.618  -8.543
  177   2HB   ALA  23          2HB       ALA  23  -0.892  -8.002  -8.131
  178   3HB   ALA  23          3HB       ALA  23  -1.900  -8.244  -9.558
  179    H    GLU  24           H        GLU  24  -2.323 -10.630  -6.898
  180    HA   GLU  24           HA       GLU  24  -1.822  -9.724  -4.134
  181   1HB   GLU  24          1HB       GLU  24  -3.993 -10.923  -4.117
  182   2HB   GLU  24          2HB       GLU  24  -3.210 -12.322  -4.846
  183   1HG   GLU  24          1HG       GLU  24  -1.603 -12.134  -2.795
  184   2HG   GLU  24          2HG       GLU  24  -2.927 -11.220  -2.086
  185    H    ILE  25           H        ILE  25  -0.173 -10.532  -3.198
  186    HA   ILE  25           HA       ILE  25   1.816 -11.628  -4.993
  187    HB   ILE  25           HB       ILE  25   2.077 -10.395  -2.247
  188   1HG1  ILE  25          1HG1      ILE  25   2.503  -9.132  -4.965
  189   2HG1  ILE  25          2HG1      ILE  25   1.107  -8.847  -3.930
  190   1HG2  ILE  25          1HG2      ILE  25   3.964 -11.792  -2.825
  191   2HG2  ILE  25          2HG2      ILE  25   4.421 -10.090  -2.851
  192   3HG2  ILE  25          3HG2      ILE  25   4.138 -10.950  -4.364
  193   1HD1  ILE  25          1HD1      ILE  25   2.584  -7.894  -2.225
  194   2HD1  ILE  25          2HD1      ILE  25   2.694  -7.030  -3.758
  195   3HD1  ILE  25          3HD1      ILE  25   3.965  -8.157  -3.288
  196    H    ILE  26           H        ILE  26   2.036 -13.766  -4.977
  197    HA   ILE  26           HA       ILE  26   2.139 -15.142  -2.385
  198    HB   ILE  26           HB       ILE  26   2.030 -17.272  -3.575
  199   1HG1  ILE  26          1HG1      ILE  26   3.084 -16.360  -5.731
  200   2HG1  ILE  26          2HG1      ILE  26   1.751 -17.486  -5.934
  201   1HG2  ILE  26          1HG2      ILE  26  -0.313 -17.099  -4.359
  202   2HG2  ILE  26          2HG2      ILE  26  -0.172 -15.342  -4.377
  203   3HG2  ILE  26          3HG2      ILE  26  -0.058 -16.220  -2.851
  204   1HD1  ILE  26          1HD1      ILE  26   1.615 -15.648  -7.509
  205   2HD1  ILE  26          2HD1      ILE  26   1.582 -14.493  -6.177
  206   3HD1  ILE  26          3HD1      ILE  26   0.249 -15.626  -6.394
  207    H    GLU  27           H        GLU  27   3.994 -13.942  -4.971
  208    HA   GLU  27           HA       GLU  27   6.388 -14.837  -3.563
  209   1HB   GLU  27          1HB       GLU  27   5.910 -15.086  -6.526
  210   2HB   GLU  27          2HB       GLU  27   7.534 -14.971  -5.860
  211   1HG   GLU  27          1HG       GLU  27   6.923 -16.944  -4.402
  212   2HG   GLU  27          2HG       GLU  27   5.500 -17.128  -5.427
  213    H    VAL  28           H        VAL  28   8.228 -13.456  -3.917
  214    HA   VAL  28           HA       VAL  28   7.481 -10.705  -4.650
  215    HB   VAL  28           HB       VAL  28   8.924 -11.378  -2.076
  216   1HG1  VAL  28          1HG1      VAL  28   8.421  -9.046  -1.506
  217   2HG1  VAL  28          2HG1      VAL  28   7.671  -8.831  -3.089
  218   3HG1  VAL  28          3HG1      VAL  28   9.397  -9.180  -2.969
  219   1HG2  VAL  28          1HG2      VAL  28   6.663 -12.247  -1.892
  220   2HG2  VAL  28          2HG2      VAL  28   6.007 -10.695  -2.413
  221   3HG2  VAL  28          3HG2      VAL  28   6.863 -10.818  -0.876
  222    H    ARG  29           H        ARG  29   9.046 -10.384  -6.254
  223    HA   ARG  29           HA       ARG  29  11.503 -11.960  -6.028
  224   1HB   ARG  29          1HB       ARG  29  10.121 -10.736  -8.408
  225   2HB   ARG  29          2HB       ARG  29  11.672 -11.554  -8.497
  226   1HG   ARG  29          1HG       ARG  29   9.111 -12.827  -7.556
  227   2HG   ARG  29          2HG       ARG  29   9.776 -12.970  -9.182
  228   1HD   ARG  29          1HD       ARG  29  10.498 -14.918  -8.139
  229   2HD   ARG  29          2HD       ARG  29  11.892 -13.850  -8.007
  230    HE   ARG  29           HE       ARG  29  10.009 -14.082  -5.763
  231   1HH1  ARG  29          1HH1      ARG  29  13.230 -14.485  -7.074
  232   2HH1  ARG  29          2HH1      ARG  29  13.943 -14.883  -5.541
  233   1HH2  ARG  29          1HH2      ARG  29  10.940 -14.618  -3.743
  234   2HH2  ARG  29          2HH2      ARG  29  12.642 -14.966  -3.655
  235    H    SER  30           H        SER  30  11.273  -9.356  -4.682
  236    HA   SER  30           HA       SER  30  13.587  -8.143  -6.022
  237   1HB   SER  30          1HB       SER  30  12.829  -6.002  -4.767
  238   2HB   SER  30          2HB       SER  30  11.979  -6.470  -6.240
  239    HG   SER  30           HG       SER  30  10.236  -6.668  -5.114
  240    H    ALA  31           H        ALA  31  12.333  -7.219  -2.894
  241    HA   ALA  31           HA       ALA  31  13.791  -8.856  -1.192
  242   1HB   ALA  31          1HB       ALA  31  15.803  -7.952  -2.269
  243   2HB   ALA  31          2HB       ALA  31  15.709  -7.473  -0.575
  244   3HB   ALA  31          3HB       ALA  31  15.297  -6.317  -1.843
  245    H    ASP  32           H        ASP  32  13.561  -5.329  -1.474
  246    HA   ASP  32           HA       ASP  32  12.338  -5.184   1.172
  247   1HB   ASP  32          1HB       ASP  32  13.299  -3.010  -0.708
  248   2HB   ASP  32          2HB       ASP  32  12.636  -2.727   0.897
  249    H    GLY  33           H        GLY  33  11.778  -3.796  -2.049
  250   1HA   GLY  33          1HA       GLY  33   9.097  -4.490  -2.282
  251   2HA   GLY  33          2HA       GLY  33   9.141  -2.934  -1.464
  252    H    SER  34           H        SER  34  10.180  -4.642  -4.361
  253    HA   SER  34           HA       SER  34   9.516  -2.337  -5.972
  254   1HB   SER  34          1HB       SER  34  12.336  -3.463  -5.949
  255   2HB   SER  34          2HB       SER  34  11.725  -2.282  -7.109
  256    HG   SER  34           HG       SER  34  11.266  -1.531  -4.532
  257    HA   PRO  35           HA       PRO  35   8.621  -5.556  -8.958
  258   1HB   PRO  35          1HB       PRO  35   9.502  -4.459 -11.305
  259   2HB   PRO  35          2HB       PRO  35   7.982  -4.010 -10.525
  260   1HG   PRO  35          1HG       PRO  35  10.629  -2.617 -10.464
  261   2HG   PRO  35          2HG       PRO  35   9.003  -1.925 -10.623
  262   1HD   PRO  35          1HD       PRO  35  10.350  -1.906  -8.285
  263   2HD   PRO  35          2HD       PRO  35   8.584  -2.068  -8.357
  264    HA   PRO  36           HA       PRO  36   8.588  -6.738 -10.723
  265   1HB   PRO  36          1HB       PRO  36   8.928  -9.269 -11.490
  266   2HB   PRO  36          2HB       PRO  36   9.618  -7.935 -12.422
  267   1HG   PRO  36          1HG       PRO  36  10.949  -9.822 -10.537
  268   2HG   PRO  36          2HG       PRO  36  11.561  -9.121 -12.044
  269   1HD   PRO  36          1HD       PRO  36  12.128  -8.216  -9.458
  270   2HD   PRO  36          2HD       PRO  36  12.410  -7.317 -10.960
  271    H    TYR  37           H        TYR  37   7.105  -8.707 -10.371
  272    HA   TYR  37           HA       TYR  37   7.477  -9.967  -7.752
  273   1HB   TYR  37          1HB       TYR  37   4.945  -8.568  -8.655
  274   2HB   TYR  37          2HB       TYR  37   5.084  -9.570  -7.219
  275    HD1  TYR  37           HD1      TYR  37   6.490  -8.774  -5.304
  276    HD2  TYR  37           HD2      TYR  37   5.598  -6.296  -8.643
  277    HE1  TYR  37           HE1      TYR  37   7.071  -6.787  -3.976
  278    HE2  TYR  37           HE2      TYR  37   6.181  -4.304  -7.328
  279    HH   TYR  37           HH       TYR  37   7.812  -4.462  -4.377
  280    H    VAL  38           H        VAL  38   5.683 -11.680  -7.501
  281    HA   VAL  38           HA       VAL  38   4.761 -12.684 -10.097
  282    HB   VAL  38           HB       VAL  38   6.127 -14.437  -8.033
  283   1HG1  VAL  38          1HG1      VAL  38   4.667 -15.178 -10.580
  284   2HG1  VAL  38          2HG1      VAL  38   4.110 -15.506  -8.939
  285   3HG1  VAL  38          3HG1      VAL  38   5.564 -16.295  -9.551
  286   1HG2  VAL  38          1HG2      VAL  38   7.632 -14.996  -9.887
  287   2HG2  VAL  38          2HG2      VAL  38   7.681 -13.272  -9.514
  288   3HG2  VAL  38          3HG2      VAL  38   6.781 -13.846 -10.918
  289    H    VAL  39           H        VAL  39   2.737 -13.114  -9.995
  290    HA   VAL  39           HA       VAL  39   1.481 -12.669  -7.402
  291    HB   VAL  39           HB       VAL  39   2.337 -10.644  -9.070
  292   1HG1  VAL  39          1HG1      VAL  39   0.340  -9.566  -9.982
  293   2HG1  VAL  39          2HG1      VAL  39  -0.603 -11.000  -9.575
  294   3HG1  VAL  39          3HG1      VAL  39   0.700 -11.108 -10.759
  295   1HG2  VAL  39          1HG2      VAL  39   1.014  -9.150  -7.664
  296   2HG2  VAL  39          2HG2      VAL  39   1.851 -10.393  -6.734
  297   3HG2  VAL  39          3HG2      VAL  39   0.120 -10.539  -7.044
  298    H    ARG  40           H        ARG  40  -0.975 -12.578  -7.776
  299    HA   ARG  40           HA       ARG  40  -1.740 -14.045 -10.182
  300   1HB   ARG  40          1HB       ARG  40  -1.442 -15.744  -8.461
  301   2HB   ARG  40          2HB       ARG  40  -2.454 -14.838  -7.347
  302   1HG   ARG  40          1HG       ARG  40  -4.369 -15.172  -8.858
  303   2HG   ARG  40          2HG       ARG  40  -3.339 -16.138  -9.911
  304   1HD   ARG  40          1HD       ARG  40  -3.914 -16.770  -7.021
  305   2HD   ARG  40          2HD       ARG  40  -4.756 -17.491  -8.390
  306    HE   ARG  40           HE       ARG  40  -1.878 -17.783  -8.421
  307   1HH1  ARG  40          1HH1      ARG  40  -4.953 -19.169  -7.486
  308   2HH1  ARG  40          2HH1      ARG  40  -4.338 -20.800  -7.409
  309   1HH2  ARG  40          1HH2      ARG  40  -1.058 -19.899  -8.312
  310   2HH2  ARG  40          2HH2      ARG  40  -2.114 -21.212  -7.850
  311    H    TRP  41           H        TRP  41  -3.479 -13.186 -11.100
  312    HA   TRP  41           HA       TRP  41  -5.091 -11.227  -9.726
  313   1HB   TRP  41          1HB       TRP  41  -5.993 -12.579 -12.248
  314   2HB   TRP  41          2HB       TRP  41  -6.207 -10.907 -11.752
  315    HD1  TRP  41           HD1      TRP  41  -4.238 -13.002 -14.033
  316    HE1  TRP  41           HE1      TRP  41  -2.294 -11.675 -15.077
  317    HE3  TRP  41           HE3      TRP  41  -4.307  -8.932 -10.935
  318    HZ2  TRP  41           HZ2      TRP  41  -0.976  -9.209 -14.631
  319    HZ3  TRP  41           HZ3      TRP  41  -2.673  -7.136 -11.314
  320    HH2  TRP  41           HH2      TRP  41  -1.041  -7.271 -13.125
  321    H    LEU  42           H        LEU  42  -5.869 -12.374  -7.945
  322    HA   LEU  42           HA       LEU  42  -6.524 -15.127  -8.030
  323   1HB   LEU  42          1HB       LEU  42  -7.836 -13.346  -6.038
  324   2HB   LEU  42          2HB       LEU  42  -7.188 -14.957  -5.829
  325    HG   LEU  42           HG       LEU  42  -5.598 -12.412  -6.049
  326   1HD1  LEU  42          1HD1      LEU  42  -6.835 -12.689  -3.978
  327   2HD1  LEU  42          2HD1      LEU  42  -5.100 -12.860  -3.718
  328   3HD1  LEU  42          3HD1      LEU  42  -6.131 -14.291  -3.767
  329   1HD2  LEU  42          1HD2      LEU  42  -4.392 -14.295  -7.036
  330   2HD2  LEU  42          2HD2      LEU  42  -4.672 -15.242  -5.574
  331   3HD2  LEU  42          3HD2      LEU  42  -3.668 -13.794  -5.510
  332    H    VAL  43           H        VAL  43  -8.714 -12.431  -7.440
  333    HA   VAL  43           HA       VAL  43 -11.057 -13.924  -7.680
  334    HB   VAL  43           HB       VAL  43 -12.037 -11.509  -8.099
  335   1HG1  VAL  43          1HG1      VAL  43 -10.634 -12.308  -5.551
  336   2HG1  VAL  43          2HG1      VAL  43 -12.258 -12.800  -6.032
  337   3HG1  VAL  43          3HG1      VAL  43 -11.917 -11.106  -5.680
  338   1HG2  VAL  43          1HG2      VAL  43 -10.576  -9.755  -7.215
  339   2HG2  VAL  43          2HG2      VAL  43  -9.879 -10.476  -8.666
  340   3HG2  VAL  43          3HG2      VAL  43  -9.258 -10.919  -7.076
  341    H    ASN  44           H        ASN  44  -9.233 -12.061 -10.030
  342    HA   ASN  44           HA       ASN  44 -10.941 -12.346 -12.222
  343   1HB   ASN  44          1HB       ASN  44  -7.930 -12.147 -12.100
  344   2HB   ASN  44          2HB       ASN  44  -8.856 -12.074 -13.597
  345   1HD2  ASN  44          1HD2      ASN  44  -8.112 -10.449 -10.604
  346   2HD2  ASN  44          2HD2      ASN  44  -8.716  -8.898 -11.068
  347    H    GLY  45           H        GLY  45  -7.967 -14.278 -11.656
  348   1HA   GLY  45          1HA       GLY  45  -8.497 -16.736 -11.387
  349   2HA   GLY  45          2HA       GLY  45  -9.388 -16.557 -12.884
  350    H    HIS  46           H        HIS  46  -6.245 -14.984 -12.393
  351    HA   HIS  46           HA       HIS  46  -4.954 -17.150 -13.897
  352   1HB   HIS  46          1HB       HIS  46  -5.761 -15.201 -15.427
  353   2HB   HIS  46          2HB       HIS  46  -4.401 -14.317 -14.738
  354    HD1  HIS  46           HD1      HIS  46  -2.387 -14.455 -16.201
  355    HD2  HIS  46           HD2      HIS  46  -4.719 -17.904 -16.393
  356    HE1  HIS  46           HE1      HIS  46  -1.184 -16.012 -17.768
  357    HE2  HIS  46           HE2      HIS  46  -2.529 -18.146 -17.742
  358    H    GLU  47           H        GLU  47  -2.489 -16.732 -14.021
  359    HA   GLU  47           HA       GLU  47  -1.522 -15.428 -11.576
  360   1HB   GLU  47          1HB       GLU  47  -1.956 -17.760 -10.993
  361   2HB   GLU  47          2HB       GLU  47  -1.000 -18.301 -12.362
  362   1HG   GLU  47          1HG       GLU  47   1.002 -17.357 -11.347
  363   2HG   GLU  47          2HG       GLU  47   0.042 -16.794  -9.976
  364    H    THR  48           H        THR  48   0.399 -14.439 -11.834
  365    HA   THR  48           HA       THR  48   1.710 -14.650 -14.439
  366    HB   THR  48           HB       THR  48  -0.188 -13.112 -14.624
  367    HG1  THR  48           HG1      THR  48   0.948 -11.524 -15.721
  368   1HG2  THR  48          1HG2      THR  48   1.331 -11.452 -12.645
  369   2HG2  THR  48          2HG2      THR  48  -0.231 -12.227 -12.380
  370   3HG2  THR  48          3HG2      THR  48  -0.084 -10.915 -13.549
  371    H    THR  49           H        THR  49   3.308 -12.766 -14.606
  372    HA   THR  49           HA       THR  49   4.692 -12.123 -12.098
  373    HB   THR  49           HB       THR  49   6.074 -13.131 -14.615
  374    HG1  THR  49           HG1      THR  49   6.699 -14.529 -12.423
  375   1HG2  THR  49          1HG2      THR  49   8.142 -12.969 -13.305
  376   2HG2  THR  49          2HG2      THR  49   7.234 -12.274 -11.962
  377   3HG2  THR  49          3HG2      THR  49   7.370 -11.393 -13.486
  378    H    VAL  50           H        VAL  50   4.939  -9.912 -12.075
  379    HA   VAL  50           HA       VAL  50   4.549  -8.503 -14.644
  380    HB   VAL  50           HB       VAL  50   2.754  -7.104 -13.560
  381   1HG1  VAL  50          1HG1      VAL  50   0.977  -8.722 -14.065
  382   2HG1  VAL  50          2HG1      VAL  50   2.176 -10.015 -14.087
  383   3HG1  VAL  50          3HG1      VAL  50   2.247  -8.725 -15.286
  384   1HG2  VAL  50          1HG2      VAL  50   1.485  -8.113 -11.729
  385   2HG2  VAL  50          2HG2      VAL  50   3.144  -7.766 -11.242
  386   3HG2  VAL  50          3HG2      VAL  50   2.667  -9.420 -11.627
  387    H    TYR  51           H        TYR  51   4.332  -6.081 -14.213
  388    HA   TYR  51           HA       TYR  51   6.162  -5.170 -12.107
  389   1HB   TYR  51          1HB       TYR  51   6.176  -4.084 -14.932
  390   2HB   TYR  51          2HB       TYR  51   7.314  -3.721 -13.641
  391    HD1  TYR  51           HD1      TYR  51   9.103  -5.282 -13.087
  392    HD2  TYR  51           HD2      TYR  51   6.337  -6.152 -16.201
  393    HE1  TYR  51           HE1      TYR  51  10.592  -7.058 -13.911
  394    HE2  TYR  51           HE2      TYR  51   7.814  -7.932 -17.030
  395    HH   TYR  51           HH       TYR  51  10.215  -8.515 -16.946
  396    HA   PRO  52           HA       PRO  52   2.465  -2.534 -11.802
  397   1HB   PRO  52          1HB       PRO  52   2.855  -1.762  -9.266
  398   2HB   PRO  52          2HB       PRO  52   2.288  -3.389  -9.658
  399   1HG   PRO  52          1HG       PRO  52   5.054  -2.468  -8.961
  400   2HG   PRO  52          2HG       PRO  52   4.173  -3.895  -8.383
  401   1HD   PRO  52          1HD       PRO  52   6.033  -3.986 -10.379
  402   2HD   PRO  52          2HD       PRO  52   4.669  -5.116 -10.260
  403    H    GLY  53           H        GLY  53   5.616  -1.769 -12.236
  404   1HA   GLY  53          1HA       GLY  53   6.605   0.227 -12.869
  405   2HA   GLY  53          2HA       GLY  53   5.108   1.055 -12.470
  406    H    SER  54           H        SER  54   4.770   1.822 -10.394
  407    HA   SER  54           HA       SER  54   6.523   1.361  -8.225
  408   1HB   SER  54          1HB       SER  54   7.999   2.762  -9.742
  409   2HB   SER  54          2HB       SER  54   6.850   4.080  -9.523
  410    HG   SER  54           HG       SER  54   8.861   3.426  -7.959
  411    H    ASP  55           H        ASP  55   6.152   3.342  -6.577
  412    HA   ASP  55           HA       ASP  55   4.644   4.285  -5.153
  413   1HB   ASP  55          1HB       ASP  55   4.419   5.838  -7.127
  414   2HB   ASP  55          2HB       ASP  55   3.031   4.888  -7.646
  415    H    ALA  56           H        ALA  56   4.513   1.625  -5.329
  416    HA   ALA  56           HA       ALA  56   1.798   0.731  -5.771
  417   1HB   ALA  56          1HB       ALA  56   2.673  -1.499  -5.338
  418   2HB   ALA  56          2HB       ALA  56   4.224  -0.811  -4.864
  419   3HB   ALA  56          3HB       ALA  56   3.663  -0.656  -6.528
  420    H    VAL  57           H        VAL  57   0.317   0.534  -4.251
  421    HA   VAL  57           HA       VAL  57   1.147   0.702  -1.435
  422    HB   VAL  57           HB       VAL  57  -1.216   1.269  -0.938
  423   1HG1  VAL  57          1HG1      VAL  57   0.410   3.052  -1.231
  424   2HG1  VAL  57          2HG1      VAL  57  -1.166   3.546  -1.853
  425   3HG1  VAL  57          3HG1      VAL  57   0.110   3.060  -2.970
  426   1HG2  VAL  57          1HG2      VAL  57  -1.533   1.343  -3.939
  427   2HG2  VAL  57          2HG2      VAL  57  -2.725   1.903  -2.764
  428   3HG2  VAL  57          3HG2      VAL  57  -2.296   0.193  -2.839
  429    H    VAL  58           H        VAL  58   0.406  -0.835   0.047
  430    HA   VAL  58           HA       VAL  58  -0.239  -3.381  -1.245
  431    HB   VAL  58           HB       VAL  58   0.811  -2.941   1.552
  432   1HG1  VAL  58          1HG1      VAL  58   0.723  -5.401  -0.190
  433   2HG1  VAL  58          2HG1      VAL  58  -0.308  -5.085   1.203
  434   3HG1  VAL  58          3HG1      VAL  58   1.428  -5.301   1.422
  435   1HG2  VAL  58          1HG2      VAL  58   2.413  -2.069  -0.054
  436   2HG2  VAL  58          2HG2      VAL  58   2.325  -3.564  -0.983
  437   3HG2  VAL  58          3HG2      VAL  58   3.010  -3.575   0.642
  438    H    VAL  59           H        VAL  59  -2.226  -4.115  -1.122
  439    HA   VAL  59           HA       VAL  59  -4.031  -3.128   0.961
  440    HB   VAL  59           HB       VAL  59  -5.722  -4.251  -0.716
  441   1HG1  VAL  59          1HG1      VAL  59  -6.011  -2.086  -1.824
  442   2HG1  VAL  59          2HG1      VAL  59  -4.434  -1.577  -1.217
  443   3HG1  VAL  59          3HG1      VAL  59  -5.752  -1.901  -0.090
  444   1HG2  VAL  59          1HG2      VAL  59  -3.410  -3.530  -2.488
  445   2HG2  VAL  59          2HG2      VAL  59  -5.030  -3.964  -3.037
  446   3HG2  VAL  59          3HG2      VAL  59  -4.033  -5.152  -2.199
  447    H    THR  60           H        THR  60  -5.926  -4.767   1.147
  448    HA   THR  60           HA       THR  60  -4.769  -7.388   1.893
  449    HB   THR  60           HB       THR  60  -6.513  -7.250   3.780
  450    HG1  THR  60           HG1      THR  60  -7.557  -5.388   4.097
  451   1HG2  THR  60          1HG2      THR  60  -4.301  -5.196   3.754
  452   2HG2  THR  60          2HG2      THR  60  -4.124  -6.896   4.187
  453   3HG2  THR  60          3HG2      THR  60  -5.103  -5.828   5.193
  454    H    ALA  61           H        ALA  61  -7.228  -8.527   2.756
  455    HA   ALA  61           HA       ALA  61  -8.060  -9.672   0.354
  456   1HB   ALA  61          1HB       ALA  61  -8.075 -10.809   2.519
  457   2HB   ALA  61          2HB       ALA  61  -9.624 -10.934   1.685
  458   3HB   ALA  61          3HB       ALA  61  -9.432  -9.805   3.026
  459    H    THR  62           H        THR  62  -9.757  -7.212   2.346
  460    HA   THR  62           HA       THR  62 -12.247  -7.533   1.027
  461    HB   THR  62           HB       THR  62 -12.369  -4.959   1.804
  462    HG1  THR  62           HG1      THR  62 -10.878  -4.496   3.243
  463   1HG2  THR  62          1HG2      THR  62 -13.357  -5.799   3.884
  464   2HG2  THR  62          2HG2      THR  62 -12.658  -7.385   3.565
  465   3HG2  THR  62          3HG2      THR  62 -13.885  -6.728   2.483
  466    H    GLU  63           H        GLU  63  -9.723  -5.095   0.599
  467    HA   GLU  63           HA       GLU  63 -10.975  -3.733  -1.520
  468   1HB   GLU  63          1HB       GLU  63  -8.002  -3.967  -1.024
  469   2HB   GLU  63          2HB       GLU  63  -8.834  -2.676  -1.882
  470   1HG   GLU  63          1HG       GLU  63  -8.877  -3.277   1.061
  471   2HG   GLU  63          2HG       GLU  63  -8.269  -1.834   0.253
  472    H    HIS  64           H        HIS  64  -9.504  -6.758  -1.364
  473    HA   HIS  64           HA       HIS  64  -8.364  -6.872  -3.947
  474   1HB   HIS  64          1HB       HIS  64  -7.420  -8.655  -3.035
  475   2HB   HIS  64          2HB       HIS  64  -8.458  -8.490  -1.634
  476    HD1  HIS  64           HD1      HIS  64 -10.400 -10.150  -1.394
  477    HD2  HIS  64           HD2      HIS  64  -8.138 -10.697  -4.840
  478    HE1  HIS  64           HE1      HIS  64 -11.001 -12.433  -2.242
  479    HE2  HIS  64           HE2      HIS  64  -9.450 -12.830  -4.182
  480    H    ALA  65           H        ALA  65 -11.620  -7.566  -2.767
  481    HA   ALA  65           HA       ALA  65 -12.363  -9.302  -4.862
  482   1HB   ALA  65          1HB       ALA  65 -14.659  -8.826  -4.188
  483   2HB   ALA  65          2HB       ALA  65 -14.107  -7.435  -3.253
  484   3HB   ALA  65          3HB       ALA  65 -13.631  -9.065  -2.775
  485    H    GLU  66           H        GLU  66 -13.648  -6.088  -4.428
  486    HA   GLU  66           HA       GLU  66 -14.507  -5.743  -7.073
  487   1HB   GLU  66          1HB       GLU  66 -14.442  -3.219  -6.110
  488   2HB   GLU  66          2HB       GLU  66 -15.699  -4.383  -5.713
  489   1HG   GLU  66          1HG       GLU  66 -14.546  -4.966  -3.641
  490   2HG   GLU  66          2HG       GLU  66 -13.236  -3.855  -4.041
  491    H    ALA  67           H        ALA  67 -11.799  -4.216  -5.348
  492    HA   ALA  67           HA       ALA  67 -11.012  -2.640  -7.533
  493   1HB   ALA  67          1HB       ALA  67  -9.036  -2.097  -6.253
  494   2HB   ALA  67          2HB       ALA  67  -9.366  -3.431  -5.145
  495   3HB   ALA  67          3HB       ALA  67 -10.471  -2.058  -5.226
  496    H    GLU  68           H        GLU  68 -10.015  -5.927  -6.547
  497    HA   GLU  68           HA       GLU  68  -7.747  -5.866  -8.300
  498   1HB   GLU  68          1HB       GLU  68  -7.877  -7.378  -6.355
  499   2HB   GLU  68          2HB       GLU  68  -9.153  -8.272  -7.162
  500   1HG   GLU  68          1HG       GLU  68  -7.651  -8.986  -8.877
  501   2HG   GLU  68          2HG       GLU  68  -6.372  -7.943  -8.247
  502    H    LYS  69           H        LYS  69 -11.121  -6.983  -8.614
  503    HA   LYS  69           HA       LYS  69 -10.921  -8.109 -11.145
  504   1HB   LYS  69          1HB       LYS  69 -13.089  -6.448  -9.884
  505   2HB   LYS  69          2HB       LYS  69 -13.254  -7.071 -11.519
  506   1HG   LYS  69          1HG       LYS  69 -13.019  -9.344 -10.705
  507   2HG   LYS  69          2HG       LYS  69 -12.781  -8.746  -9.062
  508   1HD   LYS  69          1HD       LYS  69 -15.006  -7.907  -8.960
  509   2HD   LYS  69          2HD       LYS  69 -15.251  -8.180 -10.686
  510   1HE   LYS  69          1HE       LYS  69 -14.718 -10.381  -8.696
  511   2HE   LYS  69          2HE       LYS  69 -16.334  -9.867  -9.180
  512   1HZ   LYS  69          1HZ       LYS  69 -15.567 -11.800 -10.438
  513   2HZ   LYS  69          2HZ       LYS  69 -14.247 -10.911 -11.027
  514   3HZ   LYS  69          3HZ       LYS  69 -15.828 -10.466 -11.455
  515    H    ARG  70           H        ARG  70 -11.767  -4.673 -10.537
  516    HA   ARG  70           HA       ARG  70 -11.510  -3.936 -13.267
  517   1HB   ARG  70          1HB       ARG  70 -11.439  -1.579 -12.424
  518   2HB   ARG  70          2HB       ARG  70 -12.792  -2.519 -11.818
  519   1HG   ARG  70          1HG       ARG  70 -11.816  -2.727  -9.676
  520   2HG   ARG  70          2HG       ARG  70 -10.254  -2.142 -10.253
  521   1HD   ARG  70          1HD       ARG  70 -12.746  -0.458 -10.302
  522   2HD   ARG  70          2HD       ARG  70 -11.657  -0.509  -8.919
  523    HE   ARG  70           HE       ARG  70 -10.078   0.055 -11.121
  524   1HH1  ARG  70          1HH1      ARG  70 -12.784   1.532  -9.472
  525   2HH1  ARG  70          2HH1      ARG  70 -12.313   3.156  -9.870
  526   1HH2  ARG  70          1HH2      ARG  70  -9.430   2.205 -11.629
  527   2HH2  ARG  70          2HH2      ARG  70 -10.426   3.528 -11.097
  528    H    ALA  71           H        ALA  71  -9.231  -3.691 -10.582
  529    HA   ALA  71           HA       ALA  71  -7.385  -2.144 -12.115
  530   1HB   ALA  71          1HB       ALA  71  -6.006  -2.181 -10.133
  531   2HB   ALA  71          2HB       ALA  71  -7.045  -3.411  -9.415
  532   3HB   ALA  71          3HB       ALA  71  -7.677  -1.795  -9.725
  533    H    ALA  72           H        ALA  72  -7.853  -5.556 -11.655
  534    HA   ALA  72           HA       ALA  72  -5.174  -6.245 -12.446
  535   1HB   ALA  72          1HB       ALA  72  -7.676  -7.917 -12.616
  536   2HB   ALA  72          2HB       ALA  72  -6.550  -7.878 -11.260
  537   3HB   ALA  72          3HB       ALA  72  -6.024  -8.495 -12.826
  538    H    ALA  73           H        ALA  73  -8.317  -5.907 -14.062
  539    HA   ALA  73           HA       ALA  73  -7.498  -6.446 -16.680
  540   1HB   ALA  73          1HB       ALA  73  -9.367  -5.052 -17.396
  541   2HB   ALA  73          2HB       ALA  73  -9.486  -4.359 -15.778
  542   3HB   ALA  73          3HB       ALA  73  -9.834  -6.070 -16.033
  543    H    ARG  74           H        ARG  74  -6.991  -3.641 -14.668
  544    HA   ARG  74           HA       ARG  74  -5.945  -1.988 -16.790
  545   1HB   ARG  74          1HB       ARG  74  -6.498  -1.707 -13.915
  546   2HB   ARG  74          2HB       ARG  74  -5.112  -0.787 -14.483
  547   1HG   ARG  74          1HG       ARG  74  -7.788  -0.648 -15.835
  548   2HG   ARG  74          2HG       ARG  74  -7.352   0.392 -14.477
  549   1HD   ARG  74          1HD       ARG  74  -5.424   1.220 -15.733
  550   2HD   ARG  74          2HD       ARG  74  -5.856   0.181 -17.089
  551    HE   ARG  74           HE       ARG  74  -7.903   1.516 -17.310
  552   1HH1  ARG  74          1HH1      ARG  74  -5.257   2.891 -15.466
  553   2HH1  ARG  74          2HH1      ARG  74  -5.735   4.525 -15.765
  554   1HH2  ARG  74          1HH2      ARG  74  -8.530   3.644 -17.702
  555   2HH2  ARG  74          2HH2      ARG  74  -7.612   4.967 -17.034
  556    H    ALA  75           H        ALA  75  -4.507  -3.647 -13.991
  557    HA   ALA  75           HA       ALA  75  -1.868  -2.779 -14.309
  558   1HB   ALA  75          1HB       ALA  75  -1.251  -4.646 -12.888
  559   2HB   ALA  75          2HB       ALA  75  -2.826  -5.392 -13.154
  560   3HB   ALA  75          3HB       ALA  75  -2.709  -3.862 -12.285
  561    H    GLY  76           H        GLY  76  -3.168  -5.990 -15.198
  562   1HA   GLY  76          1HA       GLY  76  -0.631  -6.428 -16.609
  563   2HA   GLY  76          2HA       GLY  76  -1.750  -7.688 -16.120
  564    H    HIS  77           H        HIS  77  -1.929  -4.719 -18.072
  565    HA   HIS  77           HA       HIS  77  -3.509  -6.101 -20.078
  566   1HB   HIS  77          1HB       HIS  77  -3.724  -3.945 -21.178
  567   2HB   HIS  77          2HB       HIS  77  -4.058  -3.761 -19.463
  568    HD1  HIS  77           HD1      HIS  77  -2.486  -2.260 -18.101
  569    HD2  HIS  77           HD2      HIS  77  -1.387  -2.671 -22.096
  570    HE1  HIS  77           HE1      HIS  77  -0.720  -0.515 -18.507
  571    HE2  HIS  77           HE2      HIS  77  -0.213  -0.658 -20.977
  572    H    ALA  78           H        ALA  78  -0.370  -5.996 -19.341
  573    HA   ALA  78           HA       ALA  78   0.477  -6.382 -22.133
  574   1HB   ALA  78          1HB       ALA  78   2.187  -5.676 -19.744
  575   2HB   ALA  78          2HB       ALA  78   1.673  -4.553 -21.004
  576   3HB   ALA  78          3HB       ALA  78   2.756  -5.890 -21.401
  577    H    ALA  79           H        ALA  79   1.530  -7.416 -18.885
  578    HA   ALA  79           HA       ALA  79   1.722 -10.169 -19.872
  579   1HB   ALA  79          1HB       ALA  79   3.059 -10.625 -17.882
  580   2HB   ALA  79          2HB       ALA  79   2.796  -8.977 -17.311
  581   3HB   ALA  79          3HB       ALA  79   3.729  -9.263 -18.780
  582    H    THR  80           H        THR  80  -0.226 -11.101 -19.706
  583    HA   THR  80           HA       THR  80  -1.912 -10.513 -17.384
  584    HB   THR  80           HB       THR  80  -2.680 -11.986 -19.910
  585    HG1  THR  80           HG1      THR  80  -2.850  -9.215 -19.233
  586   1HG2  THR  80          1HG2      THR  80  -4.164 -12.369 -17.996
  587   2HG2  THR  80          2HG2      THR  80  -4.966 -11.405 -19.235
  588   3HG2  THR  80          3HG2      THR  80  -4.342 -10.628 -17.780
  Start of MODEL    4
    1    H    MET   1           H        MET   1   6.972   2.496   1.124
    2    HA   MET   1           HA       MET   1   5.787   1.373  -0.566
    3   1HB   MET   1          1HB       MET   1   6.776   2.580  -2.470
    4   2HB   MET   1          2HB       MET   1   8.287   1.709  -2.230
    5   1HG   MET   1          1HG       MET   1   7.030  -0.411  -2.616
    6   2HG   MET   1          2HG       MET   1   5.631   0.568  -3.054
    7   1HE   MET   1          1HE       MET   1   6.839  -1.662  -4.940
    8   2HE   MET   1          2HE       MET   1   6.796  -0.832  -6.496
    9   3HE   MET   1          3HE       MET   1   5.455  -0.656  -5.364
   10    H    HIS   2           H        HIS   2   5.745  -0.437   0.638
   11    HA   HIS   2           HA       HIS   2   7.990  -2.285   0.284
   12   1HB   HIS   2          1HB       HIS   2   6.751  -1.538   2.934
   13   2HB   HIS   2          2HB       HIS   2   7.599  -3.063   2.694
   14    HD1  HIS   2           HD1      HIS   2  10.183  -2.851   2.032
   15    HD2  HIS   2           HD2      HIS   2   8.373   0.622   3.437
   16    HE1  HIS   2           HE1      HIS   2  12.068  -1.308   2.658
   17    HE2  HIS   2           HE2      HIS   2  10.958   0.810   3.453
   18    H    ALA   3           H        ALA   3   7.370  -4.505   0.311
   19    HA   ALA   3           HA       ALA   3   4.481  -5.000   0.317
   20   1HB   ALA   3          1HB       ALA   3   6.292  -5.796  -1.958
   21   2HB   ALA   3          2HB       ALA   3   5.121  -4.477  -1.998
   22   3HB   ALA   3          3HB       ALA   3   4.568  -6.142  -1.819
   23    H    LYS   4           H        LYS   4   3.882  -7.195   0.575
   24    HA   LYS   4           HA       LYS   4   6.013  -9.073   1.254
   25   1HB   LYS   4          1HB       LYS   4   3.970  -7.982   3.100
   26   2HB   LYS   4          2HB       LYS   4   4.284  -9.707   3.207
   27   1HG   LYS   4          1HG       LYS   4   6.638  -9.275   3.615
   28   2HG   LYS   4          2HG       LYS   4   6.360  -7.540   3.453
   29   1HD   LYS   4          1HD       LYS   4   5.131  -7.432   5.433
   30   2HD   LYS   4          2HD       LYS   4   4.843  -9.174   5.457
   31   1HE   LYS   4          1HE       LYS   4   7.523  -7.844   5.849
   32   2HE   LYS   4          2HE       LYS   4   6.493  -8.447   7.146
   33   1HZ   LYS   4          1HZ       LYS   4   7.809 -10.042   5.015
   34   2HZ   LYS   4          2HZ       LYS   4   6.649 -10.673   6.078
   35   3HZ   LYS   4          3HZ       LYS   4   8.121 -10.096   6.684
   36    H    VAL   5           H        VAL   5   4.999 -11.278   1.764
   37    HA   VAL   5           HA       VAL   5   3.163 -11.915  -0.418
   38    HB   VAL   5           HB       VAL   5   5.182 -13.249  -0.314
   39   1HG1  VAL   5          1HG1      VAL   5   4.385 -13.968   2.503
   40   2HG1  VAL   5          2HG1      VAL   5   5.732 -12.931   2.033
   41   3HG1  VAL   5          3HG1      VAL   5   5.750 -14.645   1.615
   42   1HG2  VAL   5          1HG2      VAL   5   3.164 -14.438  -1.002
   43   2HG2  VAL   5          2HG2      VAL   5   2.849 -14.889   0.673
   44   3HG2  VAL   5          3HG2      VAL   5   4.274 -15.515  -0.155
   45    H    GLY   6           H        GLY   6   1.218 -13.073  -0.090
   46   1HA   GLY   6          1HA       GLY   6  -0.629 -13.842   1.150
   47   2HA   GLY   6          2HA       GLY   6   0.231 -13.440   2.636
   48    H    ASP   7           H        ASP   7   0.281 -11.180   0.165
   49    HA   ASP   7           HA       ASP   7  -1.866  -9.428   1.329
   50   1HB   ASP   7          1HB       ASP   7   1.088  -8.747   1.014
   51   2HB   ASP   7          2HB       ASP   7  -0.178  -7.537   1.187
   52    H    TYR   8           H        TYR   8  -1.576  -7.352  -0.105
   53    HA   TYR   8           HA       TYR   8  -1.739  -8.308  -2.894
   54   1HB   TYR   8          1HB       TYR   8  -3.857  -6.807  -1.320
   55   2HB   TYR   8          2HB       TYR   8  -3.910  -7.050  -3.053
   56    HD1  TYR   8           HD1      TYR   8  -4.726  -9.082  -3.984
   57    HD2  TYR   8           HD2      TYR   8  -4.229  -8.738   0.228
   58    HE1  TYR   8           HE1      TYR   8  -6.106 -11.097  -3.671
   59    HE2  TYR   8           HE2      TYR   8  -5.600 -10.763   0.544
   60    HH   TYR   8           HH       TYR   8  -6.241 -12.927  -1.774
   61    H    LEU   9           H        LEU   9  -2.371  -6.305  -4.269
   62    HA   LEU   9           HA       LEU   9  -0.727  -4.025  -3.417
   63   1HB   LEU   9          1HB       LEU   9   0.756  -5.612  -4.540
   64   2HB   LEU   9          2HB       LEU   9  -0.329  -5.703  -5.906
   65    HG   LEU   9           HG       LEU   9   0.956  -3.081  -5.191
   66   1HD1  LEU   9          1HD1      LEU   9   2.777  -4.701  -5.296
   67   2HD1  LEU   9          2HD1      LEU   9   2.800  -3.639  -6.704
   68   3HD1  LEU   9          3HD1      LEU   9   2.180  -5.284  -6.852
   69   1HD2  LEU   9          1HD2      LEU   9   0.068  -4.314  -7.806
   70   2HD2  LEU   9          2HD2      LEU   9   0.741  -2.697  -7.600
   71   3HD2  LEU   9          3HD2      LEU   9  -0.821  -3.099  -6.886
   72    H    VAL  10           H        VAL  10  -1.227  -2.130  -4.347
   73    HA   VAL  10           HA       VAL  10  -3.325  -1.977  -6.388
   74    HB   VAL  10           HB       VAL  10  -3.457  -0.810  -3.612
   75   1HG1  VAL  10          1HG1      VAL  10  -5.204   0.744  -4.318
   76   2HG1  VAL  10          2HG1      VAL  10  -4.919   0.301  -6.001
   77   3HG1  VAL  10          3HG1      VAL  10  -3.661   1.126  -5.081
   78   1HG2  VAL  10          1HG2      VAL  10  -5.782  -1.525  -3.745
   79   2HG2  VAL  10          2HG2      VAL  10  -4.674  -2.861  -4.064
   80   3HG2  VAL  10          3HG2      VAL  10  -5.518  -2.076  -5.398
   81    H    VAL  11           H        VAL  11  -3.319   0.056  -7.521
   82    HA   VAL  11           HA       VAL  11  -1.117   1.895  -6.921
   83    HB   VAL  11           HB       VAL  11  -1.697   0.793  -9.682
   84   1HG1  VAL  11          1HG1      VAL  11   0.206   2.167 -10.409
   85   2HG1  VAL  11          2HG1      VAL  11   0.307   2.862  -8.791
   86   3HG1  VAL  11          3HG1      VAL  11  -1.122   3.146  -9.784
   87   1HG2  VAL  11          1HG2      VAL  11   0.575  -0.110  -9.587
   88   2HG2  VAL  11          2HG2      VAL  11  -0.438  -0.777  -8.307
   89   3HG2  VAL  11          3HG2      VAL  11   0.742   0.479  -7.932
   90    H    LYS  12           H        LYS  12  -1.659   3.990  -7.177
   91    HA   LYS  12           HA       LYS  12  -4.443   4.563  -7.797
   92   1HB   LYS  12          1HB       LYS  12  -2.254   6.336  -6.704
   93   2HB   LYS  12          2HB       LYS  12  -3.928   6.823  -6.926
   94   1HG   LYS  12          1HG       LYS  12  -4.636   5.167  -5.284
   95   2HG   LYS  12          2HG       LYS  12  -2.957   4.658  -5.073
   96   1HD   LYS  12          1HD       LYS  12  -2.365   6.908  -4.326
   97   2HD   LYS  12          2HD       LYS  12  -4.036   7.425  -4.543
   98   1HE   LYS  12          1HE       LYS  12  -4.752   5.832  -2.835
   99   2HE   LYS  12          2HE       LYS  12  -3.081   5.303  -2.624
  100   1HZ   LYS  12          1HZ       LYS  12  -2.510   7.571  -1.952
  101   2HZ   LYS  12          2HZ       LYS  12  -3.684   6.901  -0.926
  102   3HZ   LYS  12          3HZ       LYS  12  -4.134   8.036  -2.102
  103    H    GLY  13           H        GLY  13  -5.125   5.843  -9.461
  104   1HA   GLY  13          1HA       GLY  13  -3.160   6.596 -11.484
  105   2HA   GLY  13          2HA       GLY  13  -4.914   6.681 -11.647
  106    H    THR  14           H        THR  14  -2.319   8.596 -11.600
  107    HA   THR  14           HA       THR  14  -2.785  10.467  -9.567
  108    HB   THR  14           HB       THR  14  -1.426  12.019 -11.088
  109    HG1  THR  14           HG1      THR  14  -0.700  11.220 -12.959
  110   1HG2  THR  14          1HG2      THR  14  -0.428  10.732  -9.270
  111   2HG2  THR  14          2HG2      THR  14   0.648  10.765 -10.667
  112   3HG2  THR  14          3HG2      THR  14  -0.302   9.320 -10.320
  113    H    THR  15           H        THR  15  -4.425  10.007 -12.552
  114    HA   THR  15           HA       THR  15  -5.711  12.635 -12.295
  115    HB   THR  15           HB       THR  15  -6.457  12.107 -14.707
  116    HG1  THR  15           HG1      THR  15  -5.183  10.596 -15.784
  117   1HG2  THR  15          1HG2      THR  15  -3.542  12.616 -14.086
  118   2HG2  THR  15          2HG2      THR  15  -4.817  13.832 -14.154
  119   3HG2  THR  15          3HG2      THR  15  -4.340  12.971 -15.618
  120    H    THR  16           H        THR  16  -6.210   9.504 -11.487
  121    HA   THR  16           HA       THR  16  -9.126   9.749 -11.754
  122    HB   THR  16           HB       THR  16  -9.222   7.258 -12.135
  123    HG1  THR  16           HG1      THR  16  -6.872   7.084 -11.480
  124   1HG2  THR  16          1HG2      THR  16  -7.831   8.895 -14.257
  125   2HG2  THR  16          2HG2      THR  16  -9.571   8.815 -13.979
  126   3HG2  THR  16          3HG2      THR  16  -8.700   7.384 -14.531
  127    H    GLU  17           H        GLU  17  -9.887   9.860  -9.724
  128    HA   GLU  17           HA       GLU  17  -8.367   8.843  -7.516
  129   1HB   GLU  17          1HB       GLU  17 -11.109  10.092  -7.638
  130   2HB   GLU  17          2HB       GLU  17 -10.328   9.597  -6.141
  131   1HG   GLU  17          1HG       GLU  17  -8.438  11.119  -6.719
  132   2HG   GLU  17          2HG       GLU  17  -9.399  11.699  -8.077
  133    H    ARG  18           H        ARG  18  -8.293   6.691  -8.324
  134    HA   ARG  18           HA       ARG  18 -10.368   5.036  -7.112
  135   1HB   ARG  18          1HB       ARG  18 -10.391   5.407  -9.830
  136   2HB   ARG  18          2HB       ARG  18  -9.314   4.027  -9.685
  137   1HG   ARG  18          1HG       ARG  18 -11.307   2.956  -9.913
  138   2HG   ARG  18          2HG       ARG  18 -11.241   3.102  -8.154
  139   1HD   ARG  18          1HD       ARG  18 -13.428   3.761  -8.866
  140   2HD   ARG  18          2HD       ARG  18 -12.563   5.213  -8.358
  141    HE   ARG  18           HE       ARG  18 -12.931   4.422 -11.183
  142   1HH1  ARG  18          1HH1      ARG  18 -12.703   6.887  -8.690
  143   2HH1  ARG  18          2HH1      ARG  18 -12.987   8.198  -9.794
  144   1HH2  ARG  18          1HH2      ARG  18 -13.282   6.140 -12.615
  145   2HH2  ARG  18          2HH2      ARG  18 -13.276   7.782 -12.025
  146    H    HIS  19           H        HIS  19  -9.471   2.985  -6.427
  147    HA   HIS  19           HA       HIS  19  -6.554   2.930  -6.674
  148   1HB   HIS  19          1HB       HIS  19  -6.501   1.373  -4.776
  149   2HB   HIS  19          2HB       HIS  19  -7.275   2.889  -4.361
  150    HD1  HIS  19           HD1      HIS  19  -9.735   2.789  -3.599
  151    HD2  HIS  19           HD2      HIS  19  -8.152  -0.892  -4.713
  152    HE1  HIS  19           HE1      HIS  19 -11.351   1.063  -2.743
  153    HE2  HIS  19           HE2      HIS  19 -10.494  -1.128  -3.651
  154    H    ASP  20           H        ASP  20  -6.187   2.101  -8.578
  155    HA   ASP  20           HA       ASP  20  -7.635  -0.268  -9.488
  156   1HB   ASP  20          1HB       ASP  20  -5.792   1.684 -10.874
  157   2HB   ASP  20          2HB       ASP  20  -6.343   0.201 -11.640
  158    H    GLN  21           H        GLN  21  -5.993  -1.562 -11.047
  159    HA   GLN  21           HA       GLN  21  -4.313  -3.070 -11.203
  160   1HB   GLN  21          1HB       GLN  21  -2.797  -0.786  -9.922
  161   2HB   GLN  21          2HB       GLN  21  -2.036  -2.199 -10.646
  162   1HG   GLN  21          1HG       GLN  21  -3.008  -1.638 -12.801
  163   2HG   GLN  21          2HG       GLN  21  -3.817  -0.245 -12.091
  164   1HE2  GLN  21          1HE2      GLN  21  -0.756  -1.604 -13.065
  165   2HE2  GLN  21          2HE2      GLN  21   0.112  -0.111 -13.094
  166    H    HIS  22           H        HIS  22  -5.004  -4.741  -9.862
  167    HA   HIS  22           HA       HIS  22  -3.866  -4.732  -7.176
  168   1HB   HIS  22          1HB       HIS  22  -6.176  -3.874  -7.016
  169   2HB   HIS  22          2HB       HIS  22  -6.756  -5.388  -7.704
  170    HD1  HIS  22           HD1      HIS  22  -6.051  -3.810  -4.565
  171    HD2  HIS  22           HD2      HIS  22  -5.959  -7.692  -6.011
  172    HE1  HIS  22           HE1      HIS  22  -5.962  -5.276  -2.537
  173    HE2  HIS  22           HE2      HIS  22  -5.769  -7.614  -3.447
  174    H    ALA  23           H        ALA  23  -2.983  -6.459  -6.636
  175    HA   ALA  23           HA       ALA  23  -3.754  -9.121  -7.714
  176   1HB   ALA  23          1HB       ALA  23  -1.424  -9.632  -8.190
  177   2HB   ALA  23          2HB       ALA  23  -0.938  -8.001  -7.729
  178   3HB   ALA  23          3HB       ALA  23  -1.949  -8.252  -9.153
  179    H    GLU  24           H        GLU  24  -2.184 -10.721  -6.569
  180    HA   GLU  24           HA       GLU  24  -1.764  -9.907  -3.769
  181   1HB   GLU  24          1HB       GLU  24  -3.893 -11.175  -3.877
  182   2HB   GLU  24          2HB       GLU  24  -3.040 -12.512  -4.641
  183   1HG   GLU  24          1HG       GLU  24  -1.534 -12.397  -2.514
  184   2HG   GLU  24          2HG       GLU  24  -2.909 -11.542  -1.823
  185    H    ILE  25           H        ILE  25   0.081 -10.466  -3.059
  186    HA   ILE  25           HA       ILE  25   1.886 -11.667  -4.975
  187    HB   ILE  25           HB       ILE  25   2.911 -10.603  -2.401
  188   1HG1  ILE  25          1HG1      ILE  25   1.760  -8.793  -4.544
  189   2HG1  ILE  25          2HG1      ILE  25   1.080  -9.021  -2.936
  190   1HG2  ILE  25          1HG2      ILE  25   4.591  -9.638  -3.905
  191   2HG2  ILE  25          2HG2      ILE  25   3.676 -10.230  -5.293
  192   3HG2  ILE  25          3HG2      ILE  25   4.399 -11.373  -4.161
  193   1HD1  ILE  25          1HD1      ILE  25   3.771  -7.832  -3.568
  194   2HD1  ILE  25          2HD1      ILE  25   3.104  -8.074  -1.953
  195   3HD1  ILE  25          3HD1      ILE  25   2.327  -6.950  -3.069
  196    H    ILE  26           H        ILE  26   2.148 -13.741  -4.872
  197    HA   ILE  26           HA       ILE  26   2.399 -15.048  -2.258
  198    HB   ILE  26           HB       ILE  26   2.254 -17.163  -3.881
  199   1HG1  ILE  26          1HG1      ILE  26   0.329 -16.636  -5.507
  200   2HG1  ILE  26          2HG1      ILE  26   0.803 -14.953  -5.335
  201   1HG2  ILE  26          1HG2      ILE  26  -0.127 -17.296  -3.325
  202   2HG2  ILE  26          2HG2      ILE  26  -0.104 -15.592  -2.869
  203   3HG2  ILE  26          3HG2      ILE  26   0.849 -16.762  -1.955
  204   1HD1  ILE  26          1HD1      ILE  26   2.566 -17.165  -6.355
  205   2HD1  ILE  26          2HD1      ILE  26   2.996 -15.457  -6.234
  206   3HD1  ILE  26          3HD1      ILE  26   1.725 -15.974  -7.344
  207    H    GLU  27           H        GLU  27   4.114 -13.859  -4.849
  208    HA   GLU  27           HA       GLU  27   6.518 -15.166  -3.819
  209   1HB   GLU  27          1HB       GLU  27   5.578 -16.073  -6.126
  210   2HB   GLU  27          2HB       GLU  27   6.330 -14.618  -6.756
  211   1HG   GLU  27          1HG       GLU  27   7.795 -16.672  -5.123
  212   2HG   GLU  27          2HG       GLU  27   7.714 -16.698  -6.880
  213    H    VAL  28           H        VAL  28   8.117 -13.756  -3.468
  214    HA   VAL  28           HA       VAL  28   7.728 -10.957  -4.241
  215    HB   VAL  28           HB       VAL  28   8.200 -11.811  -1.385
  216   1HG1  VAL  28          1HG1      VAL  28   7.600  -9.114  -2.594
  217   2HG1  VAL  28          2HG1      VAL  28   9.148  -9.646  -1.940
  218   3HG1  VAL  28          3HG1      VAL  28   7.760  -9.448  -0.870
  219   1HG2  VAL  28          1HG2      VAL  28   5.942 -12.431  -1.994
  220   2HG2  VAL  28          2HG2      VAL  28   5.651 -10.816  -2.642
  221   3HG2  VAL  28          3HG2      VAL  28   5.920 -11.037  -0.913
  222    H    ARG  29           H        ARG  29   9.665 -10.458  -5.131
  223    HA   ARG  29           HA       ARG  29  11.950 -12.071  -4.778
  224   1HB   ARG  29          1HB       ARG  29  11.624  -9.378  -6.088
  225   2HB   ARG  29          2HB       ARG  29  13.095 -10.345  -6.173
  226   1HG   ARG  29          1HG       ARG  29  10.380 -11.175  -7.182
  227   2HG   ARG  29          2HG       ARG  29  11.736 -10.624  -8.169
  228   1HD   ARG  29          1HD       ARG  29  13.053 -12.521  -7.538
  229   2HD   ARG  29          2HD       ARG  29  11.853 -13.019  -6.347
  230    HE   ARG  29           HE       ARG  29  10.442 -13.755  -8.084
  231   1HH1  ARG  29          1HH1      ARG  29  13.529 -12.543  -9.221
  232   2HH1  ARG  29          2HH1      ARG  29  13.411 -13.317 -10.775
  233   1HH2  ARG  29          1HH2      ARG  29  10.266 -14.751 -10.136
  234   2HH2  ARG  29          2HH2      ARG  29  11.528 -14.542 -11.306
  235    H    SER  30           H        SER  30  11.187  -8.831  -3.644
  236    HA   SER  30           HA       SER  30  12.920  -9.220  -1.376
  237   1HB   SER  30          1HB       SER  30  13.479  -7.012  -3.372
  238   2HB   SER  30          2HB       SER  30  14.219  -7.139  -1.777
  239    HG   SER  30           HG       SER  30  14.443  -9.463  -3.161
  240    H    ALA  31           H        ALA  31  12.433  -7.881   0.349
  241    HA   ALA  31           HA       ALA  31   9.760  -6.807   0.265
  242   1HB   ALA  31          1HB       ALA  31  11.745  -6.876   2.535
  243   2HB   ALA  31          2HB       ALA  31  10.555  -8.125   2.173
  244   3HB   ALA  31          3HB       ALA  31  10.024  -6.516   2.666
  245    H    ASP  32           H        ASP  32  12.620  -5.499  -0.650
  246    HA   ASP  32           HA       ASP  32  12.464  -2.911   0.538
  247   1HB   ASP  32          1HB       ASP  32  14.246  -2.297  -0.865
  248   2HB   ASP  32          2HB       ASP  32  14.509  -4.017  -0.603
  249    H    GLY  33           H        GLY  33  11.032  -4.477  -2.207
  250   1HA   GLY  33          1HA       GLY  33   8.806  -3.682  -2.781
  251   2HA   GLY  33          2HA       GLY  33   9.410  -2.045  -2.598
  252    H    SER  34           H        SER  34  11.918  -3.327  -4.111
  253    HA   SER  34           HA       SER  34  11.168  -2.279  -6.641
  254   1HB   SER  34          1HB       SER  34  13.551  -3.988  -5.889
  255   2HB   SER  34          2HB       SER  34  13.357  -3.131  -7.418
  256    HG   SER  34           HG       SER  34  13.700  -2.079  -4.812
  257    HA   PRO  35           HA       PRO  35   9.180  -5.872  -8.413
  258   1HB   PRO  35          1HB       PRO  35   9.789  -4.453 -10.942
  259   2HB   PRO  35          2HB       PRO  35   8.235  -4.993 -10.301
  260   1HG   PRO  35          1HG       PRO  35   8.872  -2.407 -10.337
  261   2HG   PRO  35          2HG       PRO  35   7.970  -3.111  -8.981
  262   1HD   PRO  35          1HD       PRO  35  10.883  -2.421  -9.163
  263   2HD   PRO  35          2HD       PRO  35   9.744  -2.157  -7.823
  264    HA   PRO  36           HA       PRO  36   8.765  -6.803 -10.878
  265   1HB   PRO  36          1HB       PRO  36   8.788  -9.394 -11.551
  266   2HB   PRO  36          2HB       PRO  36   9.576  -8.172 -12.556
  267   1HG   PRO  36          1HG       PRO  36  10.786 -10.036 -10.550
  268   2HG   PRO  36          2HG       PRO  36  11.352  -9.638 -12.182
  269   1HD   PRO  36          1HD       PRO  36  12.379  -8.499  -9.938
  270   2HD   PRO  36          2HD       PRO  36  12.314  -7.662 -11.502
  271    H    TYR  37           H        TYR  37   7.130  -8.679 -10.523
  272    HA   TYR  37           HA       TYR  37   7.367  -9.866  -7.837
  273   1HB   TYR  37          1HB       TYR  37   4.884  -8.522  -8.933
  274   2HB   TYR  37          2HB       TYR  37   4.993  -9.395  -7.414
  275    HD1  TYR  37           HD1      TYR  37   5.056  -6.241  -8.923
  276    HD2  TYR  37           HD2      TYR  37   6.772  -8.441  -5.718
  277    HE1  TYR  37           HE1      TYR  37   5.547  -4.139  -7.755
  278    HE2  TYR  37           HE2      TYR  37   7.280  -6.341  -4.541
  279    HH   TYR  37           HH       TYR  37   7.650  -3.846  -5.279
  280    H    VAL  38           H        VAL  38   5.680 -11.588  -7.570
  281    HA   VAL  38           HA       VAL  38   4.802 -12.749 -10.126
  282    HB   VAL  38           HB       VAL  38   6.167 -14.334  -7.926
  283   1HG1  VAL  38          1HG1      VAL  38   5.021 -15.220 -10.571
  284   2HG1  VAL  38          2HG1      VAL  38   4.371 -15.584  -8.973
  285   3HG1  VAL  38          3HG1      VAL  38   5.934 -16.242  -9.460
  286   1HG2  VAL  38          1HG2      VAL  38   7.911 -14.802  -9.586
  287   2HG2  VAL  38          2HG2      VAL  38   7.795 -13.079  -9.228
  288   3HG2  VAL  38          3HG2      VAL  38   7.112 -13.717 -10.723
  289    H    VAL  39           H        VAL  39   2.721 -12.991  -9.960
  290    HA   VAL  39           HA       VAL  39   1.527 -12.651  -7.308
  291    HB   VAL  39           HB       VAL  39   2.445 -10.545  -8.745
  292   1HG1  VAL  39          1HG1      VAL  39   0.975 -10.867 -10.620
  293   2HG1  VAL  39          2HG1      VAL  39   0.564  -9.374  -9.775
  294   3HG1  VAL  39          3HG1      VAL  39  -0.437 -10.810  -9.563
  295   1HG2  VAL  39          1HG2      VAL  39   0.062 -10.586  -6.929
  296   2HG2  VAL  39          2HG2      VAL  39   0.950  -9.136  -7.399
  297   3HG2  VAL  39          3HG2      VAL  39   1.754 -10.404  -6.474
  298    H    ARG  40           H        ARG  40  -0.924 -12.223  -7.710
  299    HA   ARG  40           HA       ARG  40  -1.836 -13.783 -10.022
  300   1HB   ARG  40          1HB       ARG  40  -2.764 -14.228  -7.181
  301   2HB   ARG  40          2HB       ARG  40  -3.400 -15.034  -8.605
  302   1HG   ARG  40          1HG       ARG  40  -1.208 -16.064  -8.984
  303   2HG   ARG  40          2HG       ARG  40  -0.600 -15.280  -7.525
  304   1HD   ARG  40          1HD       ARG  40  -2.904 -17.221  -7.624
  305   2HD   ARG  40          2HD       ARG  40  -1.255 -17.631  -7.161
  306    HE   ARG  40           HE       ARG  40  -2.018 -15.562  -5.493
  307   1HH1  ARG  40          1HH1      ARG  40  -3.220 -18.755  -6.240
  308   2HH1  ARG  40          2HH1      ARG  40  -3.747 -19.088  -4.616
  309   1HH2  ARG  40          1HH2      ARG  40  -2.750 -15.966  -3.330
  310   2HH2  ARG  40          2HH2      ARG  40  -3.496 -17.501  -2.972
  311    H    TRP  41           H        TRP  41  -3.493 -12.856 -11.051
  312    HA   TRP  41           HA       TRP  41  -5.219 -10.936  -9.688
  313   1HB   TRP  41          1HB       TRP  41  -5.864 -12.150 -12.367
  314   2HB   TRP  41          2HB       TRP  41  -6.284 -10.560 -11.752
  315    HD1  TRP  41           HD1      TRP  41  -4.227 -12.062 -14.259
  316    HE1  TRP  41           HE1      TRP  41  -2.327 -10.517 -15.016
  317    HE3  TRP  41           HE3      TRP  41  -4.314  -8.713 -10.398
  318    HZ2  TRP  41           HZ2      TRP  41  -1.019  -8.203 -14.098
  319    HZ3  TRP  41           HZ3      TRP  41  -2.694  -6.863 -10.419
  320    HH2  TRP  41           HH2      TRP  41  -1.084  -6.617 -12.231
  321    H    LEU  42           H        LEU  42  -5.561 -12.719  -8.078
  322    HA   LEU  42           HA       LEU  42  -6.151 -15.310  -9.035
  323   1HB   LEU  42          1HB       LEU  42  -6.853 -15.655  -6.527
  324   2HB   LEU  42          2HB       LEU  42  -5.183 -15.529  -7.041
  325    HG   LEU  42           HG       LEU  42  -5.822 -12.922  -6.528
  326   1HD1  LEU  42          1HD1      LEU  42  -7.971 -13.525  -5.577
  327   2HD1  LEU  42          2HD1      LEU  42  -6.885 -12.919  -4.327
  328   3HD1  LEU  42          3HD1      LEU  42  -7.181 -14.651  -4.475
  329   1HD2  LEU  42          1HD2      LEU  42  -3.787 -14.099  -5.946
  330   2HD2  LEU  42          2HD2      LEU  42  -4.647 -14.992  -4.692
  331   3HD2  LEU  42          3HD2      LEU  42  -4.440 -13.247  -4.548
  332    H    VAL  43           H        VAL  43  -8.438 -13.024  -7.435
  333    HA   VAL  43           HA       VAL  43 -10.587 -14.797  -7.624
  334    HB   VAL  43           HB       VAL  43 -11.944 -12.581  -7.608
  335   1HG1  VAL  43          1HG1      VAL  43 -11.661 -12.481  -5.179
  336   2HG1  VAL  43          2HG1      VAL  43 -10.186 -13.436  -5.324
  337   3HG1  VAL  43          3HG1      VAL  43 -11.743 -14.145  -5.751
  338   1HG2  VAL  43          1HG2      VAL  43  -9.215 -11.616  -6.820
  339   2HG2  VAL  43          2HG2      VAL  43 -10.716 -10.730  -6.561
  340   3HG2  VAL  43          3HG2      VAL  43 -10.162 -11.063  -8.202
  341    H    ASN  44           H        ASN  44  -9.290 -12.484  -9.923
  342    HA   ASN  44           HA       ASN  44 -11.281 -12.696 -11.887
  343   1HB   ASN  44          1HB       ASN  44  -8.305 -12.328 -12.296
  344   2HB   ASN  44          2HB       ASN  44  -9.553 -12.010 -13.495
  345   1HD2  ASN  44          1HD2      ASN  44  -7.974 -10.886 -10.640
  346   2HD2  ASN  44          2HD2      ASN  44  -8.711  -9.322 -10.600
  347    H    GLY  45           H        GLY  45  -8.382 -14.660 -11.296
  348   1HA   GLY  45          1HA       GLY  45  -9.053 -17.099 -11.392
  349   2HA   GLY  45          2HA       GLY  45  -9.588 -16.729 -13.019
  350    H    HIS  46           H        HIS  46  -6.692 -15.038 -12.325
  351    HA   HIS  46           HA       HIS  46  -5.102 -17.270 -13.363
  352   1HB   HIS  46          1HB       HIS  46  -6.071 -15.693 -15.208
  353   2HB   HIS  46          2HB       HIS  46  -4.778 -14.612 -14.694
  354    HD1  HIS  46           HD1      HIS  46  -3.737 -18.103 -14.401
  355    HD2  HIS  46           HD2      HIS  46  -3.834 -15.214 -17.409
  356    HE1  HIS  46           HE1      HIS  46  -2.199 -18.940 -16.207
  357    HE2  HIS  46           HE2      HIS  46  -2.401 -17.266 -18.074
  358    H    GLU  47           H        GLU  47  -2.764 -16.434 -13.744
  359    HA   GLU  47           HA       GLU  47  -1.827 -14.930 -11.401
  360   1HB   GLU  47          1HB       GLU  47  -0.546 -17.544 -12.176
  361   2HB   GLU  47          2HB       GLU  47  -0.421 -16.663 -10.661
  362   1HG   GLU  47          1HG       GLU  47  -1.791 -18.296  -9.950
  363   2HG   GLU  47          2HG       GLU  47  -3.027 -17.224 -10.602
  364    H    THR  48           H        THR  48   0.154 -13.921 -11.748
  365    HA   THR  48           HA       THR  48   1.236 -14.046 -14.462
  366    HB   THR  48           HB       THR  48   1.144 -11.493 -14.495
  367    HG1  THR  48           HG1      THR  48  -1.118 -11.269 -13.108
  368   1HG2  THR  48          1HG2      THR  48  -1.136 -11.461 -15.400
  369   2HG2  THR  48          2HG2      THR  48  -1.447 -13.036 -14.673
  370   3HG2  THR  48          3HG2      THR  48  -0.249 -12.879 -15.958
  371    H    THR  49           H        THR  49   2.987 -12.262 -14.641
  372    HA   THR  49           HA       THR  49   4.525 -11.879 -12.167
  373    HB   THR  49           HB       THR  49   5.763 -12.722 -14.810
  374    HG1  THR  49           HG1      THR  49   4.616 -14.234 -12.910
  375   1HG2  THR  49          1HG2      THR  49   7.231 -11.334 -13.449
  376   2HG2  THR  49          2HG2      THR  49   7.817 -12.996 -13.488
  377   3HG2  THR  49          3HG2      THR  49   6.972 -12.393 -12.063
  378    H    VAL  50           H        VAL  50   4.737  -9.682 -11.996
  379    HA   VAL  50           HA       VAL  50   4.385  -8.135 -14.476
  380    HB   VAL  50           HB       VAL  50   2.485  -6.886 -13.501
  381   1HG1  VAL  50          1HG1      VAL  50   2.070  -8.665 -15.100
  382   2HG1  VAL  50          2HG1      VAL  50   0.788  -8.606 -13.890
  383   3HG1  VAL  50          3HG1      VAL  50   2.034  -9.851 -13.795
  384   1HG2  VAL  50          1HG2      VAL  50   2.544  -9.047 -11.395
  385   2HG2  VAL  50          2HG2      VAL  50   1.261  -7.854 -11.601
  386   3HG2  VAL  50          3HG2      VAL  50   2.884  -7.334 -11.146
  387    H    TYR  51           H        TYR  51   3.959  -5.774 -13.840
  388    HA   TYR  51           HA       TYR  51   5.678  -4.829 -11.667
  389   1HB   TYR  51          1HB       TYR  51   5.800  -3.660 -14.462
  390   2HB   TYR  51          2HB       TYR  51   6.878  -3.329 -13.109
  391    HD1  TYR  51           HD1      TYR  51   5.969  -5.807 -15.693
  392    HD2  TYR  51           HD2      TYR  51   8.758  -4.750 -12.660
  393    HE1  TYR  51           HE1      TYR  51   7.505  -7.551 -16.510
  394    HE2  TYR  51           HE2      TYR  51  10.296  -6.488 -13.468
  395    HH   TYR  51           HH       TYR  51   9.877  -8.089 -16.451
  396    HA   PRO  52           HA       PRO  52   1.985  -2.317 -11.448
  397   1HB   PRO  52          1HB       PRO  52   2.512  -1.035  -9.161
  398   2HB   PRO  52          2HB       PRO  52   2.220  -2.778  -9.180
  399   1HG   PRO  52          1HG       PRO  52   4.799  -1.287  -8.981
  400   2HG   PRO  52          2HG       PRO  52   4.294  -2.768  -8.151
  401   1HD   PRO  52          1HD       PRO  52   5.909  -2.656 -10.416
  402   2HD   PRO  52          2HD       PRO  52   5.021  -4.087  -9.855
  403    H    GLY  53           H        GLY  53   1.659   0.166 -10.584
  404   1HA   GLY  53          1HA       GLY  53   3.133   1.736 -12.572
  405   2HA   GLY  53          2HA       GLY  53   1.583   2.162 -11.867
  406    H    SER  54           H        SER  54   1.842   4.031 -10.847
  407    HA   SER  54           HA       SER  54   4.368   4.591  -9.500
  408   1HB   SER  54          1HB       SER  54   2.065   6.450 -10.119
  409   2HB   SER  54          2HB       SER  54   3.652   6.921  -9.514
  410    HG   SER  54           HG       SER  54   4.134   5.504 -11.645
  411    H    ASP  55           H        ASP  55   4.415   5.618  -7.461
  412    HA   ASP  55           HA       ASP  55   3.986   5.813  -5.245
  413   1HB   ASP  55          1HB       ASP  55   1.832   6.834  -5.823
  414   2HB   ASP  55          2HB       ASP  55   1.108   5.239  -6.001
  415    H    ALA  56           H        ALA  56   1.974   3.260  -6.561
  416    HA   ALA  56           HA       ALA  56   1.470   1.146  -5.917
  417   1HB   ALA  56          1HB       ALA  56   4.396   1.047  -5.244
  418   2HB   ALA  56          2HB       ALA  56   3.705   0.857  -6.855
  419   3HB   ALA  56          3HB       ALA  56   3.349  -0.326  -5.597
  420    H    VAL  57           H        VAL  57   0.538   0.125  -4.304
  421    HA   VAL  57           HA       VAL  57   1.503   0.513  -1.567
  422    HB   VAL  57           HB       VAL  57  -0.335   2.163  -2.123
  423   1HG1  VAL  57          1HG1      VAL  57  -2.642   1.343  -2.021
  424   2HG1  VAL  57          2HG1      VAL  57  -2.025  -0.307  -2.093
  425   3HG1  VAL  57          3HG1      VAL  57  -1.775   0.788  -3.453
  426   1HG2  VAL  57          1HG2      VAL  57  -0.796   0.288   0.168
  427   2HG2  VAL  57          2HG2      VAL  57  -1.475   1.908   0.017
  428   3HG2  VAL  57          3HG2      VAL  57   0.270   1.695   0.162
  429    H    VAL  58           H        VAL  58  -0.163  -0.780  -0.176
  430    HA   VAL  58           HA       VAL  58  -0.390  -3.488  -1.300
  431    HB   VAL  58           HB       VAL  58   1.221  -2.739   1.150
  432   1HG1  VAL  58          1HG1      VAL  58   1.544  -5.135   1.534
  433   2HG1  VAL  58          2HG1      VAL  58   0.425  -5.498   0.220
  434   3HG1  VAL  58          3HG1      VAL  58  -0.157  -4.691   1.674
  435   1HG2  VAL  58          1HG2      VAL  58   3.025  -3.919  -0.012
  436   2HG2  VAL  58          2HG2      VAL  58   2.410  -2.570  -0.967
  437   3HG2  VAL  58          3HG2      VAL  58   1.946  -4.223  -1.374
  438    H    VAL  59           H        VAL  59  -1.976  -4.698  -0.436
  439    HA   VAL  59           HA       VAL  59  -3.751  -3.444   1.514
  440    HB   VAL  59           HB       VAL  59  -5.480  -4.299  -0.378
  441   1HG1  VAL  59          1HG1      VAL  59  -5.737  -1.919  -0.988
  442   2HG1  VAL  59          2HG1      VAL  59  -4.231  -1.570  -0.138
  443   3HG1  VAL  59          3HG1      VAL  59  -5.630  -2.171   0.752
  444   1HG2  VAL  59          1HG2      VAL  59  -4.717  -3.461  -2.543
  445   2HG2  VAL  59          2HG2      VAL  59  -3.723  -4.800  -1.968
  446   3HG2  VAL  59          3HG2      VAL  59  -3.127  -3.145  -1.848
  447    H    THR  60           H        THR  60  -5.804  -4.893   1.554
  448    HA   THR  60           HA       THR  60  -4.890  -7.676   2.037
  449    HB   THR  60           HB       THR  60  -6.742  -7.525   3.852
  450    HG1  THR  60           HG1      THR  60  -7.727  -5.682   4.071
  451   1HG2  THR  60          1HG2      THR  60  -5.252  -6.422   5.448
  452   2HG2  THR  60          2HG2      THR  60  -4.292  -5.793   4.108
  453   3HG2  THR  60          3HG2      THR  60  -4.368  -7.531   4.401
  454    H    ALA  61           H        ALA  61  -7.434  -8.703   2.716
  455    HA   ALA  61           HA       ALA  61  -8.363  -9.594   0.281
  456   1HB   ALA  61          1HB       ALA  61 -10.127 -10.675   1.513
  457   2HB   ALA  61          2HB       ALA  61  -9.832  -9.629   2.902
  458   3HB   ALA  61          3HB       ALA  61  -8.604 -10.789   2.397
  459    H    THR  62           H        THR  62  -9.866  -7.064   2.353
  460    HA   THR  62           HA       THR  62 -12.254  -6.919   0.874
  461    HB   THR  62           HB       THR  62 -12.081  -4.415   1.665
  462    HG1  THR  62           HG1      THR  62 -10.560  -4.032   3.078
  463   1HG2  THR  62          1HG2      THR  62 -12.600  -6.753   3.475
  464   2HG2  THR  62          2HG2      THR  62 -13.756  -6.004   2.375
  465   3HG2  THR  62          3HG2      THR  62 -13.146  -5.100   3.759
  466    H    GLU  63           H        GLU  63  -9.479  -4.722   0.720
  467    HA   GLU  63           HA       GLU  63 -10.333  -3.298  -1.542
  468   1HB   GLU  63          1HB       GLU  63  -7.460  -3.871  -0.813
  469   2HB   GLU  63          2HB       GLU  63  -8.083  -2.482  -1.693
  470   1HG   GLU  63          1HG       GLU  63  -8.584  -3.123   1.204
  471   2HG   GLU  63          2HG       GLU  63  -7.502  -1.879   0.577
  472    H    HIS  64           H        HIS  64  -8.970  -6.394  -1.163
  473    HA   HIS  64           HA       HIS  64  -7.735  -6.776  -3.603
  474   1HB   HIS  64          1HB       HIS  64  -7.140  -8.599  -2.509
  475   2HB   HIS  64          2HB       HIS  64  -8.397  -8.337  -1.315
  476    HD1  HIS  64           HD1      HIS  64  -7.832 -10.112  -4.621
  477    HD2  HIS  64           HD2      HIS  64 -10.378 -10.203  -1.326
  478    HE1  HIS  64           HE1      HIS  64  -9.180 -12.212  -4.844
  479    HE2  HIS  64           HE2      HIS  64 -10.615 -12.323  -2.780
  480    H    ALA  65           H        ALA  65 -11.146  -7.226  -2.779
  481    HA   ALA  65           HA       ALA  65 -11.817  -8.835  -4.976
  482   1HB   ALA  65          1HB       ALA  65 -13.180  -8.599  -2.955
  483   2HB   ALA  65          2HB       ALA  65 -14.123  -8.283  -4.412
  484   3HB   ALA  65          3HB       ALA  65 -13.567  -6.942  -3.410
  485    H    GLU  66           H        GLU  66 -12.866  -5.494  -4.532
  486    HA   GLU  66           HA       GLU  66 -13.778  -5.262  -7.177
  487   1HB   GLU  66          1HB       GLU  66 -13.822  -2.732  -6.444
  488   2HB   GLU  66          2HB       GLU  66 -14.943  -3.902  -5.765
  489   1HG   GLU  66          1HG       GLU  66 -14.270  -2.910  -3.833
  490   2HG   GLU  66          2HG       GLU  66 -13.007  -4.137  -3.951
  491    H    ALA  67           H        ALA  67 -10.832  -4.060  -5.609
  492    HA   ALA  67           HA       ALA  67  -9.898  -2.655  -7.868
  493   1HB   ALA  67          1HB       ALA  67  -8.282  -3.809  -5.604
  494   2HB   ALA  67          2HB       ALA  67  -9.080  -2.234  -5.601
  495   3HB   ALA  67          3HB       ALA  67  -7.765  -2.555  -6.731
  496    H    GLU  68           H        GLU  68  -9.722  -6.064  -7.010
  497    HA   GLU  68           HA       GLU  68  -7.568  -6.651  -8.796
  498   1HB   GLU  68          1HB       GLU  68  -8.786  -8.084  -6.833
  499   2HB   GLU  68          2HB       GLU  68  -9.495  -8.821  -8.265
  500   1HG   GLU  68          1HG       GLU  68  -7.484  -9.633  -9.019
  501   2HG   GLU  68          2HG       GLU  68  -6.545  -8.420  -8.149
  502    H    LYS  69           H        LYS  69 -11.105  -6.585  -9.090
  503    HA   LYS  69           HA       LYS  69 -11.276  -7.290 -11.806
  504   1HB   LYS  69          1HB       LYS  69 -12.771  -5.284 -10.151
  505   2HB   LYS  69          2HB       LYS  69 -13.065  -5.383 -11.880
  506   1HG   LYS  69          1HG       LYS  69 -13.582  -7.798 -11.582
  507   2HG   LYS  69          2HG       LYS  69 -13.461  -7.549  -9.839
  508   1HD   LYS  69          1HD       LYS  69 -15.280  -5.999  -9.863
  509   2HD   LYS  69          2HD       LYS  69 -15.307  -5.980 -11.628
  510   1HE   LYS  69          1HE       LYS  69 -17.112  -7.348 -10.771
  511   2HE   LYS  69          2HE       LYS  69 -15.944  -8.346 -11.634
  512   1HZ   LYS  69          1HZ       LYS  69 -16.073  -8.033  -8.681
  513   2HZ   LYS  69          2HZ       LYS  69 -15.016  -9.050  -9.537
  514   3HZ   LYS  69          3HZ       LYS  69 -16.681  -9.352  -9.551
  515    H    ARG  70           H        ARG  70 -10.621  -4.083 -10.413
  516    HA   ARG  70           HA       ARG  70 -10.083  -2.684 -12.782
  517   1HB   ARG  70          1HB       ARG  70  -9.090  -2.330  -9.962
  518   2HB   ARG  70          2HB       ARG  70  -8.527  -1.281 -11.250
  519   1HG   ARG  70          1HG       ARG  70 -10.314  -0.230 -10.010
  520   2HG   ARG  70          2HG       ARG  70 -10.826  -0.554 -11.665
  521   1HD   ARG  70          1HD       ARG  70 -12.341  -2.128 -11.035
  522   2HD   ARG  70          2HD       ARG  70 -11.414  -2.616  -9.619
  523    HE   ARG  70           HE       ARG  70 -12.208  -0.462  -8.605
  524   1HH1  ARG  70          1HH1      ARG  70 -14.010  -1.982 -11.196
  525   2HH1  ARG  70          2HH1      ARG  70 -15.559  -1.431 -10.618
  526   1HH2  ARG  70          1HH2      ARG  70 -14.237   0.255  -7.823
  527   2HH2  ARG  70          2HH2      ARG  70 -15.689  -0.192  -8.679
  528    H    ALA  71           H        ALA  71  -8.241  -5.113 -11.235
  529    HA   ALA  71           HA       ALA  71  -5.652  -4.327 -12.164
  530   1HB   ALA  71          1HB       ALA  71  -4.925  -6.475 -11.351
  531   2HB   ALA  71          2HB       ALA  71  -6.602  -6.996 -11.179
  532   3HB   ALA  71          3HB       ALA  71  -5.974  -5.692 -10.170
  533    H    ALA  72           H        ALA  72  -7.711  -7.130 -13.019
  534    HA   ALA  72           HA       ALA  72  -6.072  -7.907 -15.173
  535   1HB   ALA  72          1HB       ALA  72  -7.672  -9.427 -14.126
  536   2HB   ALA  72          2HB       ALA  72  -7.917  -9.334 -15.871
  537   3HB   ALA  72          3HB       ALA  72  -9.005  -8.476 -14.779
  538    H    ALA  73           H        ALA  73  -8.562  -5.503 -14.868
  539    HA   ALA  73           HA       ALA  73  -8.713  -4.942 -17.674
  540   1HB   ALA  73          1HB       ALA  73  -9.348  -3.148 -15.335
  541   2HB   ALA  73          2HB       ALA  73 -10.477  -4.252 -16.123
  542   3HB   ALA  73          3HB       ALA  73  -9.819  -2.878 -17.013
  543    H    ARG  74           H        ARG  74  -7.311  -2.888 -15.091
  544    HA   ARG  74           HA       ARG  74  -5.871  -1.426 -17.124
  545   1HB   ARG  74          1HB       ARG  74  -6.059  -0.963 -14.145
  546   2HB   ARG  74          2HB       ARG  74  -5.321   0.142 -15.301
  547   1HG   ARG  74          1HG       ARG  74  -7.890  -0.422 -16.291
  548   2HG   ARG  74          2HG       ARG  74  -8.077  -0.143 -14.560
  549   1HD   ARG  74          1HD       ARG  74  -6.383   1.741 -16.112
  550   2HD   ARG  74          2HD       ARG  74  -8.130   1.838 -16.320
  551    HE   ARG  74           HE       ARG  74  -7.703   1.816 -13.591
  552   1HH1  ARG  74          1HH1      ARG  74  -6.761   3.827 -16.305
  553   2HH1  ARG  74          2HH1      ARG  74  -6.732   5.299 -15.381
  554   1HH2  ARG  74          1HH2      ARG  74  -7.653   3.743 -12.340
  555   2HH2  ARG  74          2HH2      ARG  74  -7.227   5.249 -13.113
  556    H    ALA  75           H        ALA  75  -4.906  -3.183 -14.164
  557    HA   ALA  75           HA       ALA  75  -2.168  -2.562 -14.253
  558   1HB   ALA  75          1HB       ALA  75  -3.270  -3.439 -12.263
  559   2HB   ALA  75          2HB       ALA  75  -1.864  -4.411 -12.695
  560   3HB   ALA  75          3HB       ALA  75  -3.487  -4.999 -13.058
  561    H    GLY  76           H        GLY  76  -3.739  -5.633 -15.220
  562   1HA   GLY  76          1HA       GLY  76  -1.334  -6.148 -16.847
  563   2HA   GLY  76          2HA       GLY  76  -1.951  -7.376 -15.757
  564    H    HIS  77           H        HIS  77  -2.845  -5.372 -18.531
  565    HA   HIS  77           HA       HIS  77  -4.579  -7.560 -19.463
  566   1HB   HIS  77          1HB       HIS  77  -5.474  -5.927 -21.109
  567   2HB   HIS  77          2HB       HIS  77  -5.733  -5.426 -19.445
  568    HD1  HIS  77           HD1      HIS  77  -4.960  -3.145 -18.827
  569    HD2  HIS  77           HD2      HIS  77  -3.310  -4.443 -22.420
  570    HE1  HIS  77           HE1      HIS  77  -3.733  -1.157 -19.772
  571    HE2  HIS  77           HE2      HIS  77  -2.737  -1.963 -21.947
  572    H    ALA  78           H        ALA  78  -1.560  -6.136 -19.859
  573    HA   ALA  78           HA       ALA  78  -1.058  -7.810 -22.222
  574   1HB   ALA  78          1HB       ALA  78  -1.317  -5.499 -23.017
  575   2HB   ALA  78          2HB       ALA  78   0.340  -6.067 -23.215
  576   3HB   ALA  78          3HB       ALA  78  -0.064  -4.973 -21.892
  577    H    ALA  79           H        ALA  79  -0.609  -8.047 -19.322
  578    HA   ALA  79           HA       ALA  79   2.334  -8.210 -19.313
  579   1HB   ALA  79          1HB       ALA  79   0.539  -7.546 -16.979
  580   2HB   ALA  79          2HB       ALA  79   1.553  -6.402 -17.857
  581   3HB   ALA  79          3HB       ALA  79   2.295  -7.701 -16.924
  582    H    THR  80           H        THR  80   0.561 -10.262 -20.159
  583    HA   THR  80           HA       THR  80   0.913 -12.228 -17.989
  584    HB   THR  80           HB       THR  80  -1.168 -12.293 -20.189
  585    HG1  THR  80           HG1      THR  80  -1.162 -10.884 -17.997
  586   1HG2  THR  80          1HG2      THR  80  -0.781 -14.080 -17.780
  587   2HG2  THR  80          2HG2      THR  80  -0.458 -14.524 -19.457
  588   3HG2  THR  80          3HG2      THR  80  -2.107 -14.176 -18.940
  Start of MODEL    5
    1    H    MET   1           H        MET   1   8.075   3.288   0.932
    2    HA   MET   1           HA       MET   1   6.607   1.458   0.547
    3   1HB   MET   1          1HB       MET   1   7.601   2.668  -1.385
    4   2HB   MET   1          2HB       MET   1   8.907   1.496  -1.429
    5   1HG   MET   1          1HG       MET   1   6.041   0.681  -1.744
    6   2HG   MET   1          2HG       MET   1   7.008   1.243  -3.104
    7   1HE   MET   1          1HE       MET   1   5.569  -1.563  -3.098
    8   2HE   MET   1          2HE       MET   1   6.840  -2.601  -3.741
    9   3HE   MET   1          3HE       MET   1   6.582  -0.995  -4.424
   10    H    HIS   2           H        HIS   2   6.195  -0.686   0.730
   11    HA   HIS   2           HA       HIS   2   8.261  -2.670   0.561
   12   1HB   HIS   2          1HB       HIS   2   8.619  -1.734   2.859
   13   2HB   HIS   2          2HB       HIS   2   6.983  -2.229   3.270
   14    HD1  HIS   2           HD1      HIS   2  10.446  -3.498   2.924
   15    HD2  HIS   2           HD2      HIS   2   6.630  -5.069   3.483
   16    HE1  HIS   2           HE1      HIS   2  10.788  -5.863   3.695
   17    HE2  HIS   2           HE2      HIS   2   8.482  -6.748   4.177
   18    H    ALA   3           H        ALA   3   7.033  -3.812  -0.835
   19    HA   ALA   3           HA       ALA   3   4.343  -4.630   0.021
   20   1HB   ALA   3          1HB       ALA   3   3.996  -5.297  -2.317
   21   2HB   ALA   3          2HB       ALA   3   5.641  -4.787  -2.701
   22   3HB   ALA   3          3HB       ALA   3   4.446  -3.597  -2.186
   23    H    LYS   4           H        LYS   4   4.136  -6.617   0.868
   24    HA   LYS   4           HA       LYS   4   6.179  -8.617   0.175
   25   1HB   LYS   4          1HB       LYS   4   6.386  -7.475   2.493
   26   2HB   LYS   4          2HB       LYS   4   4.983  -8.440   2.930
   27   1HG   LYS   4          1HG       LYS   4   6.972  -9.570   3.642
   28   2HG   LYS   4          2HG       LYS   4   6.246 -10.479   2.315
   29   1HD   LYS   4          1HD       LYS   4   7.836  -9.173   0.793
   30   2HD   LYS   4          2HD       LYS   4   8.685  -8.723   2.272
   31   1HE   LYS   4          1HE       LYS   4   8.213 -11.506   1.219
   32   2HE   LYS   4          2HE       LYS   4   9.748 -10.647   1.283
   33   1HZ   LYS   4          1HZ       LYS   4   8.144 -11.497   3.638
   34   2HZ   LYS   4          2HZ       LYS   4   9.634 -10.687   3.699
   35   3HZ   LYS   4          3HZ       LYS   4   9.547 -12.259   3.065
   36    H    VAL   5           H        VAL   5   5.502 -10.843   0.723
   37    HA   VAL   5           HA       VAL   5   3.056 -11.478  -0.524
   38    HB   VAL   5           HB       VAL   5   4.905 -12.992  -0.726
   39   1HG1  VAL   5          1HG1      VAL   5   4.849 -13.245   2.278
   40   2HG1  VAL   5          2HG1      VAL   5   6.099 -12.464   1.308
   41   3HG1  VAL   5          3HG1      VAL   5   5.854 -14.206   1.192
   42   1HG2  VAL   5          1HG2      VAL   5   2.730 -14.080  -0.715
   43   2HG2  VAL   5          2HG2      VAL   5   2.816 -14.266   1.038
   44   3HG2  VAL   5          3HG2      VAL   5   3.953 -15.130   0.001
   45    H    GLY   6           H        GLY   6   1.213 -12.502   0.320
   46   1HA   GLY   6          1HA       GLY   6  -0.125 -13.312   2.141
   47   2HA   GLY   6          2HA       GLY   6   0.844 -12.333   3.238
   48    H    ASP   7           H        ASP   7   0.352 -10.594   0.516
   49    HA   ASP   7           HA       ASP   7  -2.240  -9.379   1.370
   50   1HB   ASP   7          1HB       ASP   7   0.424  -7.921   1.287
   51   2HB   ASP   7          2HB       ASP   7  -1.119  -7.090   1.148
   52    H    TYR   8           H        TYR   8  -2.618  -7.493  -0.229
   53    HA   TYR   8           HA       TYR   8  -2.103  -8.619  -2.887
   54   1HB   TYR   8          1HB       TYR   8  -4.307  -6.827  -1.863
   55   2HB   TYR   8          2HB       TYR   8  -4.108  -7.273  -3.552
   56    HD1  TYR   8           HD1      TYR   8  -4.998  -8.532  -0.193
   57    HD2  TYR   8           HD2      TYR   8  -4.772  -9.435  -4.346
   58    HE1  TYR   8           HE1      TYR   8  -6.392 -10.535   0.159
   59    HE2  TYR   8           HE2      TYR   8  -6.162 -11.439  -3.995
   60    HH   TYR   8           HH       TYR   8  -6.647 -12.996  -2.029
   61    H    LEU   9           H        LEU   9  -1.685  -7.188  -4.616
   62    HA   LEU   9           HA       LEU   9  -0.130  -4.842  -3.828
   63   1HB   LEU   9          1HB       LEU   9   0.956  -6.612  -5.181
   64   2HB   LEU   9          2HB       LEU   9  -0.242  -6.375  -6.434
   65    HG   LEU   9           HG       LEU   9   1.517  -4.085  -5.614
   66   1HD1  LEU   9          1HD1      LEU   9   3.025  -5.966  -6.014
   67   2HD1  LEU   9          2HD1      LEU   9   3.141  -4.764  -7.300
   68   3HD1  LEU   9          3HD1      LEU   9   2.248  -6.262  -7.569
   69   1HD2  LEU   9          1HD2      LEU   9   0.246  -4.888  -8.234
   70   2HD2  LEU   9          2HD2      LEU   9   1.189  -3.426  -7.945
   71   3HD2  LEU   9          3HD2      LEU   9  -0.359  -3.651  -7.132
   72    H    VAL  10           H        VAL  10  -0.777  -2.894  -4.269
   73    HA   VAL  10           HA       VAL  10  -2.647  -2.369  -6.460
   74    HB   VAL  10           HB       VAL  10  -2.950  -1.488  -3.593
   75   1HG1  VAL  10          1HG1      VAL  10  -2.944   0.563  -4.898
   76   2HG1  VAL  10          2HG1      VAL  10  -4.571   0.196  -4.323
   77   3HG1  VAL  10          3HG1      VAL  10  -4.135  -0.121  -6.002
   78   1HG2  VAL  10          1HG2      VAL  10  -4.918  -2.492  -5.644
   79   2HG2  VAL  10          2HG2      VAL  10  -5.279  -2.101  -3.962
   80   3HG2  VAL  10          3HG2      VAL  10  -4.203  -3.446  -4.343
   81    H    VAL  11           H        VAL  11  -2.252  -0.445  -7.523
   82    HA   VAL  11           HA       VAL  11   0.288   0.851  -6.872
   83    HB   VAL  11           HB       VAL  11  -1.372   0.784  -9.392
   84   1HG1  VAL  11          1HG1      VAL  11   0.380   2.110 -10.466
   85   2HG1  VAL  11          2HG1      VAL  11   1.182   2.314  -8.909
   86   3HG1  VAL  11          3HG1      VAL  11  -0.413   3.018  -9.178
   87   1HG2  VAL  11          1HG2      VAL  11   1.391  -0.226  -8.740
   88   2HG2  VAL  11          2HG2      VAL  11   0.606  -0.325 -10.317
   89   3HG2  VAL  11          3HG2      VAL  11  -0.060  -1.209  -8.944
   90    H    LYS  12           H        LYS  12   0.432   2.837  -6.177
   91    HA   LYS  12           HA       LYS  12   0.147   5.071  -6.009
   92   1HB   LYS  12          1HB       LYS  12  -0.950   4.892  -8.289
   93   2HB   LYS  12          2HB       LYS  12  -2.492   4.854  -7.443
   94   1HG   LYS  12          1HG       LYS  12  -1.906   7.095  -8.274
   95   2HG   LYS  12          2HG       LYS  12  -2.090   7.044  -6.518
   96   1HD   LYS  12          1HD       LYS  12   0.284   7.026  -6.204
   97   2HD   LYS  12          2HD       LYS  12   0.563   6.828  -7.934
   98   1HE   LYS  12          1HE       LYS  12  -0.794   9.223  -6.712
   99   2HE   LYS  12          2HE       LYS  12   0.933   9.145  -7.056
  100   1HZ   LYS  12          1HZ       LYS  12   0.363   8.718  -9.399
  101   2HZ   LYS  12          2HZ       LYS  12  -0.177  10.228  -8.853
  102   3HZ   LYS  12          3HZ       LYS  12  -1.280   8.953  -9.034
  103    H    GLY  13           H        GLY  13  -2.943   3.360  -5.560
  104   1HA   GLY  13          1HA       GLY  13  -4.095   3.174  -3.509
  105   2HA   GLY  13          2HA       GLY  13  -3.049   4.420  -2.837
  106    H    THR  14           H        THR  14  -3.578   6.595  -3.125
  107    HA   THR  14           HA       THR  14  -5.790   7.315  -4.826
  108    HB   THR  14           HB       THR  14  -6.674   8.635  -2.628
  109    HG1  THR  14           HG1      THR  14  -6.303   6.037  -1.602
  110   1HG2  THR  14          1HG2      THR  14  -8.513   7.018  -2.582
  111   2HG2  THR  14          2HG2      THR  14  -7.547   5.894  -3.540
  112   3HG2  THR  14          3HG2      THR  14  -8.061   7.433  -4.234
  113    H    THR  15           H        THR  15  -5.200   9.069  -5.814
  114    HA   THR  15           HA       THR  15  -4.317  11.375  -4.300
  115    HB   THR  15           HB       THR  15  -2.667  10.441  -6.669
  116    HG1  THR  15           HG1      THR  15  -2.521   9.790  -4.026
  117   1HG2  THR  15          1HG2      THR  15  -2.262  12.708  -4.711
  118   2HG2  THR  15          2HG2      THR  15  -2.762  12.874  -6.393
  119   3HG2  THR  15          3HG2      THR  15  -1.155  12.258  -6.007
  120    H    THR  16           H        THR  16  -4.005  10.727  -7.751
  121    HA   THR  16           HA       THR  16  -6.388  12.382  -8.253
  122    HB   THR  16           HB       THR  16  -4.087  11.760 -10.131
  123    HG1  THR  16           HG1      THR  16  -4.696  14.306  -9.045
  124   1HG2  THR  16          1HG2      THR  16  -6.407  13.676 -10.426
  125   2HG2  THR  16          2HG2      THR  16  -6.210  12.156 -11.299
  126   3HG2  THR  16          3HG2      THR  16  -5.076  13.479 -11.566
  127    H    GLU  17           H        GLU  17  -4.684   9.416  -8.914
  128    HA   GLU  17           HA       GLU  17  -6.911   8.313 -10.429
  129   1HB   GLU  17          1HB       GLU  17  -4.395   6.868  -9.602
  130   2HB   GLU  17          2HB       GLU  17  -5.468   6.494 -10.942
  131   1HG   GLU  17          1HG       GLU  17  -3.779   7.451 -12.099
  132   2HG   GLU  17          2HG       GLU  17  -4.710   8.901 -11.739
  133    H    ARG  18           H        ARG  18  -7.685   6.116  -9.788
  134    HA   ARG  18           HA       ARG  18  -8.169   5.929  -6.942
  135   1HB   ARG  18          1HB       ARG  18  -9.516   3.929  -7.551
  136   2HB   ARG  18          2HB       ARG  18 -10.013   5.381  -8.405
  137   1HG   ARG  18          1HG       ARG  18  -9.293   4.605 -10.436
  138   2HG   ARG  18          2HG       ARG  18  -8.071   3.551  -9.721
  139   1HD   ARG  18          1HD       ARG  18 -11.019   3.056  -9.379
  140   2HD   ARG  18          2HD       ARG  18 -10.111   2.421 -10.752
  141    HE   ARG  18           HE       ARG  18  -8.626   1.421  -8.911
  142   1HH1  ARG  18          1HH1      ARG  18 -12.117   1.772  -8.676
  143   2HH1  ARG  18          2HH1      ARG  18 -12.277   0.468  -7.534
  144   1HH2  ARG  18          1HH2      ARG  18  -8.870  -0.303  -7.471
  145   2HH2  ARG  18          2HH2      ARG  18 -10.452  -0.723  -6.858
  146    H    HIS  19           H        HIS  19  -7.970   3.533  -6.023
  147    HA   HIS  19           HA       HIS  19  -5.207   2.823  -6.331
  148   1HB   HIS  19          1HB       HIS  19  -5.783   0.888  -4.766
  149   2HB   HIS  19          2HB       HIS  19  -5.917   2.514  -4.127
  150    HD1  HIS  19           HD1      HIS  19  -8.079  -0.376  -5.255
  151    HD2  HIS  19           HD2      HIS  19  -8.358   3.147  -3.075
  152    HE1  HIS  19           HE1      HIS  19 -10.303  -0.476  -4.095
  153    HE2  HIS  19           HE2      HIS  19 -10.376   1.581  -2.651
  154    H    ASP  20           H        ASP  20  -4.562   1.936  -8.119
  155    HA   ASP  20           HA       ASP  20  -6.400   0.087  -9.521
  156   1HB   ASP  20          1HB       ASP  20  -6.486   2.280 -10.559
  157   2HB   ASP  20          2HB       ASP  20  -4.731   2.352 -10.640
  158    H    GLN  21           H        GLN  21  -5.199  -1.190 -11.284
  159    HA   GLN  21           HA       GLN  21  -3.713  -2.850 -11.733
  160   1HB   GLN  21          1HB       GLN  21  -1.791  -0.880 -10.494
  161   2HB   GLN  21          2HB       GLN  21  -1.287  -2.380 -11.261
  162   1HG   GLN  21          1HG       GLN  21  -1.540  -1.557 -13.322
  163   2HG   GLN  21          2HG       GLN  21  -3.042  -0.730 -12.913
  164   1HE2  GLN  21          1HE2      GLN  21  -2.999   1.379 -12.268
  165   2HE2  GLN  21          2HE2      GLN  21  -1.574   2.359 -12.346
  166    H    HIS  22           H        HIS  22  -4.205  -4.655 -10.577
  167    HA   HIS  22           HA       HIS  22  -3.230  -4.852  -7.846
  168   1HB   HIS  22          1HB       HIS  22  -5.257  -3.705  -7.437
  169   2HB   HIS  22          2HB       HIS  22  -6.147  -4.709  -8.574
  170    HD1  HIS  22           HD1      HIS  22  -4.795  -4.694  -5.090
  171    HD2  HIS  22           HD2      HIS  22  -6.990  -7.157  -7.593
  172    HE1  HIS  22           HE1      HIS  22  -5.711  -6.511  -3.621
  173    HE2  HIS  22           HE2      HIS  22  -6.781  -8.134  -5.231
  174    H    ALA  23           H        ALA  23  -3.198  -6.848  -6.940
  175    HA   ALA  23           HA       ALA  23  -4.528  -9.239  -7.725
  176   1HB   ALA  23          1HB       ALA  23  -3.149  -9.108  -9.764
  177   2HB   ALA  23          2HB       ALA  23  -2.740 -10.501  -8.763
  178   3HB   ALA  23          3HB       ALA  23  -1.696  -9.080  -8.763
  179    H    GLU  24           H        GLU  24  -3.153 -11.152  -6.738
  180    HA   GLU  24           HA       GLU  24  -2.451 -10.110  -4.076
  181   1HB   GLU  24          1HB       GLU  24  -4.137 -11.912  -4.173
  182   2HB   GLU  24          2HB       GLU  24  -2.926 -12.987  -4.867
  183   1HG   GLU  24          1HG       GLU  24  -1.554 -12.716  -2.839
  184   2HG   GLU  24          2HG       GLU  24  -2.811 -11.700  -2.143
  185    H    ILE  25           H        ILE  25  -0.517 -10.148  -3.211
  186    HA   ILE  25           HA       ILE  25   1.724 -11.049  -4.816
  187    HB   ILE  25           HB       ILE  25   1.771  -9.712  -2.106
  188   1HG1  ILE  25          1HG1      ILE  25   2.039  -8.456  -4.847
  189   2HG1  ILE  25          2HG1      ILE  25   0.635  -8.303  -3.794
  190   1HG2  ILE  25          1HG2      ILE  25   4.073  -9.137  -2.714
  191   2HG2  ILE  25          2HG2      ILE  25   3.896 -10.039  -4.220
  192   3HG2  ILE  25          3HG2      ILE  25   3.822 -10.882  -2.673
  193   1HD1  ILE  25          1HD1      ILE  25   2.017  -6.327  -3.670
  194   2HD1  ILE  25          2HD1      ILE  25   3.413  -7.304  -3.213
  195   3HD1  ILE  25          3HD1      ILE  25   2.031  -7.176  -2.125
  196    H    ILE  26           H        ILE  26   2.216 -13.108  -4.689
  197    HA   ILE  26           HA       ILE  26   2.401 -14.340  -2.031
  198    HB   ILE  26           HB       ILE  26   2.271 -16.535  -3.500
  199   1HG1  ILE  26          1HG1      ILE  26   0.401 -16.155  -5.213
  200   2HG1  ILE  26          2HG1      ILE  26   0.829 -14.451  -5.144
  201   1HG2  ILE  26          1HG2      ILE  26  -0.099 -14.891  -2.630
  202   2HG2  ILE  26          2HG2      ILE  26   0.831 -16.014  -1.638
  203   3HG2  ILE  26          3HG2      ILE  26  -0.134 -16.618  -2.984
  204   1HD1  ILE  26          1HD1      ILE  26   1.851 -15.533  -7.049
  205   2HD1  ILE  26          2HD1      ILE  26   2.638 -16.703  -5.990
  206   3HD1  ILE  26          3HD1      ILE  26   3.086 -15.000  -5.907
  207    H    GLU  27           H        GLU  27   4.076 -13.471  -4.880
  208    HA   GLU  27           HA       GLU  27   6.478 -14.710  -3.738
  209   1HB   GLU  27          1HB       GLU  27   5.640 -14.647  -6.624
  210   2HB   GLU  27          2HB       GLU  27   7.330 -14.806  -6.164
  211   1HG   GLU  27          1HG       GLU  27   6.787 -16.832  -4.902
  212   2HG   GLU  27          2HG       GLU  27   5.101 -16.680  -5.399
  213    H    VAL  28           H        VAL  28   7.569 -13.091  -2.906
  214    HA   VAL  28           HA       VAL  28   7.650 -10.531  -4.309
  215    HB   VAL  28           HB       VAL  28   8.652 -11.226  -1.543
  216   1HG1  VAL  28          1HG1      VAL  28   9.884  -9.366  -2.538
  217   2HG1  VAL  28          2HG1      VAL  28   8.846  -8.808  -1.227
  218   3HG1  VAL  28          3HG1      VAL  28   8.366  -8.547  -2.903
  219   1HG2  VAL  28          1HG2      VAL  28   6.712  -9.958  -0.758
  220   2HG2  VAL  28          2HG2      VAL  28   6.228 -11.362  -1.710
  221   3HG2  VAL  28          3HG2      VAL  28   6.176  -9.752  -2.425
  222    H    ARG  29           H        ARG  29   9.340 -10.263  -5.681
  223    HA   ARG  29           HA       ARG  29  11.686 -11.967  -5.330
  224   1HB   ARG  29          1HB       ARG  29  10.706 -10.340  -7.676
  225   2HB   ARG  29          2HB       ARG  29  12.242 -11.199  -7.665
  226   1HG   ARG  29          1HG       ARG  29   9.512 -12.437  -7.352
  227   2HG   ARG  29          2HG       ARG  29  10.540 -12.513  -8.787
  228   1HD   ARG  29          1HD       ARG  29  12.159 -13.836  -7.668
  229   2HD   ARG  29          2HD       ARG  29  11.431 -13.522  -6.095
  230    HE   ARG  29           HE       ARG  29   9.563 -14.829  -7.750
  231   1HH1  ARG  29          1HH1      ARG  29  12.547 -15.452  -6.025
  232   2HH1  ARG  29          2HH1      ARG  29  12.198 -17.134  -5.773
  233   1HH2  ARG  29          1HH2      ARG  29   9.087 -17.036  -7.402
  234   2HH2  ARG  29          2HH2      ARG  29  10.248 -18.030  -6.570
  235    H    SER  30           H        SER  30  11.401  -9.855  -3.541
  236    HA   SER  30           HA       SER  30  13.940  -8.531  -3.975
  237   1HB   SER  30          1HB       SER  30  11.394  -6.961  -3.479
  238   2HB   SER  30          2HB       SER  30  13.025  -6.291  -3.416
  239    HG   SER  30           HG       SER  30  12.578  -7.651  -5.724
  240    H    ALA  31           H        ALA  31  14.900  -7.829  -2.011
  241    HA   ALA  31           HA       ALA  31  14.101  -9.313   0.286
  242   1HB   ALA  31          1HB       ALA  31  16.447  -8.826  -0.199
  243   2HB   ALA  31          2HB       ALA  31  15.985  -8.227   1.394
  244   3HB   ALA  31          3HB       ALA  31  16.142  -7.106   0.042
  245    H    ASP  32           H        ASP  32  13.682  -6.008  -0.780
  246    HA   ASP  32           HA       ASP  32  12.184  -5.458   1.697
  247   1HB   ASP  32          1HB       ASP  32  14.123  -3.991   1.457
  248   2HB   ASP  32          2HB       ASP  32  13.582  -3.513  -0.149
  249    H    GLY  33           H        GLY  33  12.273  -4.224  -1.660
  250   1HA   GLY  33          1HA       GLY  33   9.727  -5.064  -2.402
  251   2HA   GLY  33          2HA       GLY  33   9.529  -3.504  -1.617
  252    H    SER  34           H        SER  34  10.389  -5.142  -4.467
  253    HA   SER  34           HA       SER  34  10.503  -2.638  -5.905
  254   1HB   SER  34          1HB       SER  34  12.872  -3.035  -5.281
  255   2HB   SER  34          2HB       SER  34  12.798  -4.620  -6.046
  256    HG   SER  34           HG       SER  34  12.459  -3.602  -8.031
  257    HA   PRO  35           HA       PRO  35   8.431  -5.264  -8.898
  258   1HB   PRO  35          1HB       PRO  35   9.392  -3.373 -10.943
  259   2HB   PRO  35          2HB       PRO  35   7.737  -3.776 -10.482
  260   1HG   PRO  35          1HG       PRO  35   8.830  -1.399  -9.880
  261   2HG   PRO  35          2HG       PRO  35   7.680  -2.204  -8.797
  262   1HD   PRO  35          1HD       PRO  35  10.665  -2.049  -8.614
  263   2HD   PRO  35          2HD       PRO  35   9.448  -1.913  -7.326
  264    HA   PRO  36           HA       PRO  36   7.894  -6.090 -10.787
  265   1HB   PRO  36          1HB       PRO  36   7.818  -8.427 -12.064
  266   2HB   PRO  36          2HB       PRO  36   8.424  -6.972 -12.865
  267   1HG   PRO  36          1HG       PRO  36   9.935  -9.266 -11.699
  268   2HG   PRO  36          2HG       PRO  36  10.273  -8.326 -13.162
  269   1HD   PRO  36          1HD       PRO  36  11.479  -7.962 -10.664
  270   2HD   PRO  36          2HD       PRO  36  11.501  -6.803 -12.007
  271    H    TYR  37           H        TYR  37   6.292  -7.960 -10.398
  272    HA   TYR  37           HA       TYR  37   7.114  -9.534  -8.041
  273   1HB   TYR  37          1HB       TYR  37   4.537  -8.015  -8.458
  274   2HB   TYR  37          2HB       TYR  37   4.775  -9.204  -7.184
  275    HD1  TYR  37           HD1      TYR  37   6.231  -8.727  -5.291
  276    HD2  TYR  37           HD2      TYR  37   5.583  -5.832  -8.342
  277    HE1  TYR  37           HE1      TYR  37   7.164  -6.985  -3.830
  278    HE2  TYR  37           HE2      TYR  37   6.516  -4.085  -6.888
  279    HH   TYR  37           HH       TYR  37   8.198  -4.798  -4.020
  280    H    VAL  38           H        VAL  38   6.258 -11.601  -7.893
  281    HA   VAL  38           HA       VAL  38   4.821 -12.527 -10.278
  282    HB   VAL  38           HB       VAL  38   6.067 -14.186  -8.070
  283   1HG1  VAL  38          1HG1      VAL  38   4.886 -14.995 -10.731
  284   2HG1  VAL  38          2HG1      VAL  38   4.165 -15.280  -9.148
  285   3HG1  VAL  38          3HG1      VAL  38   5.676 -16.076  -9.582
  286   1HG2  VAL  38          1HG2      VAL  38   7.770 -14.762  -9.746
  287   2HG2  VAL  38          2HG2      VAL  38   7.769 -13.037  -9.378
  288   3HG2  VAL  38          3HG2      VAL  38   7.036 -13.621 -10.874
  289    H    VAL  39           H        VAL  39   2.719 -12.624 -10.133
  290    HA   VAL  39           HA       VAL  39   1.571 -12.336  -7.448
  291    HB   VAL  39           HB       VAL  39   2.113 -10.279  -9.129
  292   1HG1  VAL  39          1HG1      VAL  39   0.574 -10.981 -10.836
  293   2HG1  VAL  39          2HG1      VAL  39   0.038  -9.466 -10.110
  294   3HG1  VAL  39          3HG1      VAL  39  -0.755 -10.981  -9.677
  295   1HG2  VAL  39          1HG2      VAL  39  -0.153 -10.414  -7.163
  296   2HG2  VAL  39          2HG2      VAL  39   0.580  -8.935  -7.787
  297   3HG2  VAL  39          3HG2      VAL  39   1.535 -10.051  -6.810
  298    H    ARG  40           H        ARG  40  -0.559 -13.070  -7.207
  299    HA   ARG  40           HA       ARG  40  -1.511 -14.695  -9.465
  300   1HB   ARG  40          1HB       ARG  40  -1.952 -14.999  -6.501
  301   2HB   ARG  40          2HB       ARG  40  -2.897 -15.874  -7.697
  302   1HG   ARG  40          1HG       ARG  40  -0.752 -16.799  -8.589
  303   2HG   ARG  40          2HG       ARG  40   0.061 -16.067  -7.204
  304   1HD   ARG  40          1HD       ARG  40  -0.397 -18.363  -6.688
  305   2HD   ARG  40          2HD       ARG  40  -1.456 -17.348  -5.711
  306    HE   ARG  40           HE       ARG  40  -2.610 -18.273  -8.201
  307   1HH1  ARG  40          1HH1      ARG  40  -2.225 -18.830  -4.775
  308   2HH1  ARG  40          2HH1      ARG  40  -3.530 -19.976  -4.676
  309   1HH2  ARG  40          1HH2      ARG  40  -4.343 -19.739  -8.084
  310   2HH2  ARG  40          2HH2      ARG  40  -4.772 -20.459  -6.562
  311    H    TRP  41           H        TRP  41  -3.328 -14.259 -10.404
  312    HA   TRP  41           HA       TRP  41  -4.943 -12.022  -9.460
  313   1HB   TRP  41          1HB       TRP  41  -5.091 -13.557 -12.074
  314   2HB   TRP  41          2HB       TRP  41  -5.887 -12.030 -11.712
  315    HD1  TRP  41           HD1      TRP  41  -2.144 -12.917 -11.153
  316    HE1  TRP  41           HE1      TRP  41  -0.728 -11.199 -12.425
  317    HE3  TRP  41           HE3      TRP  41  -5.882 -10.327 -13.457
  318    HZ2  TRP  41           HZ2      TRP  41  -1.121  -9.051 -14.188
  319    HZ3  TRP  41           HZ3      TRP  41  -5.270  -8.455 -14.909
  320    HH2  TRP  41           HH2      TRP  41  -2.946  -7.829 -15.281
  321    H    LEU  42           H        LEU  42  -6.176 -12.902  -7.828
  322    HA   LEU  42           HA       LEU  42  -6.761 -15.695  -7.839
  323   1HB   LEU  42          1HB       LEU  42  -7.950 -13.666  -5.976
  324   2HB   LEU  42          2HB       LEU  42  -7.681 -15.374  -5.684
  325    HG   LEU  42           HG       LEU  42  -5.598 -13.208  -5.865
  326   1HD1  LEU  42          1HD1      LEU  42  -6.828 -13.287  -3.786
  327   2HD1  LEU  42          2HD1      LEU  42  -5.169 -13.840  -3.551
  328   3HD1  LEU  42          3HD1      LEU  42  -6.487 -15.010  -3.629
  329   1HD2  LEU  42          1HD2      LEU  42  -4.753 -15.230  -6.929
  330   2HD2  LEU  42          2HD2      LEU  42  -5.215 -16.178  -5.516
  331   3HD2  LEU  42          3HD2      LEU  42  -3.956 -14.949  -5.381
  332    H    VAL  43           H        VAL  43  -9.033 -12.972  -7.452
  333    HA   VAL  43           HA       VAL  43 -11.236 -14.708  -7.936
  334    HB   VAL  43           HB       VAL  43 -12.514 -12.528  -7.840
  335   1HG1  VAL  43          1HG1      VAL  43 -12.330 -14.055  -5.966
  336   2HG1  VAL  43          2HG1      VAL  43 -12.250 -12.386  -5.401
  337   3HG1  VAL  43          3HG1      VAL  43 -10.776 -13.346  -5.533
  338   1HG2  VAL  43          1HG2      VAL  43 -10.722 -10.994  -8.419
  339   2HG2  VAL  43          2HG2      VAL  43  -9.837 -11.485  -6.974
  340   3HG2  VAL  43          3HG2      VAL  43 -11.369 -10.626  -6.821
  341    H    ASN  44           H        ASN  44  -9.149 -13.099  -9.955
  342    HA   ASN  44           HA       ASN  44 -11.075 -12.834 -12.098
  343   1HB   ASN  44          1HB       ASN  44  -8.136 -12.241 -11.883
  344   2HB   ASN  44          2HB       ASN  44  -8.917 -12.325 -13.457
  345   1HD2  ASN  44          1HD2      ASN  44 -10.564 -11.157 -10.611
  346   2HD2  ASN  44          2HD2      ASN  44 -10.624  -9.499 -11.091
  347    H    GLY  45           H        GLY  45  -8.081 -14.695 -11.524
  348   1HA   GLY  45          1HA       GLY  45  -8.275 -17.136 -11.796
  349   2HA   GLY  45          2HA       GLY  45  -9.232 -16.814 -13.234
  350    H    HIS  46           H        HIS  46  -6.079 -15.649 -12.016
  351    HA   HIS  46           HA       HIS  46  -4.711 -16.910 -14.233
  352   1HB   HIS  46          1HB       HIS  46  -5.276 -14.005 -14.191
  353   2HB   HIS  46          2HB       HIS  46  -3.615 -14.450 -14.566
  354    HD1  HIS  46           HD1      HIS  46  -6.985 -14.236 -16.037
  355    HD2  HIS  46           HD2      HIS  46  -3.365 -16.084 -16.934
  356    HE1  HIS  46           HE1      HIS  46  -7.136 -14.897 -18.458
  357    HE2  HIS  46           HE2      HIS  46  -4.875 -15.854 -19.024
  358    H    GLU  47           H        GLU  47  -2.326 -16.496 -14.123
  359    HA   GLU  47           HA       GLU  47  -1.282 -15.489 -11.588
  360   1HB   GLU  47          1HB       GLU  47  -1.728 -17.925 -11.228
  361   2HB   GLU  47          2HB       GLU  47  -0.658 -18.286 -12.575
  362   1HG   GLU  47          1HG       GLU  47   1.173 -17.148 -11.331
  363   2HG   GLU  47          2HG       GLU  47   0.080 -17.008  -9.956
  364    H    THR  48           H        THR  48   0.509 -14.283 -12.063
  365    HA   THR  48           HA       THR  48   2.346 -15.022 -14.105
  366    HB   THR  48           HB       THR  48   0.571 -14.314 -15.583
  367    HG1  THR  48           HG1      THR  48   1.858 -13.165 -16.863
  368   1HG2  THR  48          1HG2      THR  48   0.684 -11.645 -14.172
  369   2HG2  THR  48          2HG2      THR  48  -0.647 -12.797 -14.105
  370   3HG2  THR  48          3HG2      THR  48  -0.256 -11.993 -15.624
  371    H    THR  49           H        THR  49   3.726 -13.029 -14.711
  372    HA   THR  49           HA       THR  49   4.495 -11.747 -12.175
  373    HB   THR  49           HB       THR  49   6.138 -12.052 -14.706
  374    HG1  THR  49           HG1      THR  49   5.422 -13.987 -13.207
  375   1HG2  THR  49          1HG2      THR  49   8.033 -11.540 -13.239
  376   2HG2  THR  49          2HG2      THR  49   6.931 -11.344 -11.874
  377   3HG2  THR  49          3HG2      THR  49   6.859 -10.224 -13.235
  378    H    VAL  50           H        VAL  50   3.771  -9.705 -11.986
  379    HA   VAL  50           HA       VAL  50   3.141  -8.262 -14.468
  380    HB   VAL  50           HB       VAL  50   1.234  -8.818 -12.962
  381   1HG1  VAL  50          1HG1      VAL  50   0.930  -7.536 -10.899
  382   2HG1  VAL  50          2HG1      VAL  50   2.547  -6.856 -11.090
  383   3HG1  VAL  50          3HG1      VAL  50   2.344  -8.587 -10.816
  384   1HG2  VAL  50          1HG2      VAL  50   0.190  -6.602 -13.047
  385   2HG2  VAL  50          2HG2      VAL  50   1.054  -6.982 -14.537
  386   3HG2  VAL  50          3HG2      VAL  50   1.768  -5.880 -13.362
  387    H    TYR  51           H        TYR  51   3.626  -6.121 -14.706
  388    HA   TYR  51           HA       TYR  51   5.562  -4.966 -12.822
  389   1HB   TYR  51          1HB       TYR  51   4.985  -4.368 -15.728
  390   2HB   TYR  51          2HB       TYR  51   5.995  -3.339 -14.724
  391    HD1  TYR  51           HD1      TYR  51   5.847  -6.330 -16.732
  392    HD2  TYR  51           HD2      TYR  51   8.127  -4.270 -13.791
  393    HE1  TYR  51           HE1      TYR  51   7.816  -7.688 -17.311
  394    HE2  TYR  51           HE2      TYR  51  10.098  -5.620 -14.358
  395    HH   TYR  51           HH       TYR  51  10.359  -7.418 -17.140
  396    HA   PRO  52           HA       PRO  52   1.945  -2.341 -11.863
  397   1HB   PRO  52          1HB       PRO  52   2.919  -1.499  -9.473
  398   2HB   PRO  52          2HB       PRO  52   2.105  -3.056  -9.667
  399   1HG   PRO  52          1HG       PRO  52   5.034  -2.451  -9.536
  400   2HG   PRO  52          2HG       PRO  52   4.128  -3.768  -8.767
  401   1HD   PRO  52          1HD       PRO  52   5.571  -4.103 -11.043
  402   2HD   PRO  52          2HD       PRO  52   4.110  -5.042 -10.680
  403    H    GLY  53           H        GLY  53   1.782  -0.032 -11.823
  404   1HA   GLY  53          1HA       GLY  53   3.670   1.360 -13.337
  405   2HA   GLY  53          2HA       GLY  53   2.395   2.105 -12.392
  406    H    SER  54           H        SER  54   2.849   2.401 -10.054
  407    HA   SER  54           HA       SER  54   5.493   2.317  -9.044
  408   1HB   SER  54          1HB       SER  54   5.751   4.191 -10.673
  409   2HB   SER  54          2HB       SER  54   4.468   5.061  -9.833
  410    HG   SER  54           HG       SER  54   5.896   5.709  -8.459
  411    H    ASP  55           H        ASP  55   5.610   3.408  -6.896
  412    HA   ASP  55           HA       ASP  55   4.815   3.569  -4.776
  413   1HB   ASP  55          1HB       ASP  55   2.558   4.963  -6.230
  414   2HB   ASP  55          2HB       ASP  55   2.728   4.941  -4.477
  415    H    ALA  56           H        ALA  56   4.609   1.132  -5.324
  416    HA   ALA  56           HA       ALA  56   1.913   0.112  -5.329
  417   1HB   ALA  56          1HB       ALA  56   2.947  -2.095  -5.336
  418   2HB   ALA  56          2HB       ALA  56   4.531  -1.366  -5.064
  419   3HB   ALA  56          3HB       ALA  56   3.664  -1.056  -6.568
  420    H    VAL  57           H        VAL  57   0.727  -0.379  -3.633
  421    HA   VAL  57           HA       VAL  57   2.011  -0.559  -0.976
  422    HB   VAL  57           HB       VAL  57  -0.821   0.378  -1.434
  423   1HG1  VAL  57          1HG1      VAL  57   1.058   0.707   0.898
  424   2HG1  VAL  57          2HG1      VAL  57  -0.301  -0.414   0.804
  425   3HG1  VAL  57          3HG1      VAL  57  -0.592   1.325   0.805
  426   1HG2  VAL  57          1HG2      VAL  57  -0.049   2.682  -1.190
  427   2HG2  VAL  57          2HG2      VAL  57   0.659   1.921  -2.615
  428   3HG2  VAL  57          3HG2      VAL  57   1.623   2.120  -1.151
  429    H    VAL  58           H        VAL  58   0.851  -1.978   0.551
  430    HA   VAL  58           HA       VAL  58  -0.286  -4.266  -0.847
  431    HB   VAL  58           HB       VAL  58   0.145  -5.285   1.539
  432   1HG1  VAL  58          1HG1      VAL  58   1.180  -6.041  -0.532
  433   2HG1  VAL  58          2HG1      VAL  58   2.360  -5.993   0.777
  434   3HG1  VAL  58          3HG1      VAL  58   2.340  -4.716  -0.441
  435   1HG2  VAL  58          1HG2      VAL  58   2.159  -4.348   2.582
  436   2HG2  VAL  58          2HG2      VAL  58   0.805  -3.218   2.618
  437   3HG2  VAL  58          3HG2      VAL  58   2.103  -3.002   1.442
  438    H    VAL  59           H        VAL  59  -2.398  -4.433  -0.849
  439    HA   VAL  59           HA       VAL  59  -4.001  -3.398   1.348
  440    HB   VAL  59           HB       VAL  59  -5.851  -3.877  -0.271
  441   1HG1  VAL  59          1HG1      VAL  59  -3.761  -1.904  -1.133
  442   2HG1  VAL  59          2HG1      VAL  59  -5.020  -1.621   0.072
  443   3HG1  VAL  59          3HG1      VAL  59  -5.456  -1.876  -1.619
  444   1HG2  VAL  59          1HG2      VAL  59  -4.748  -5.471  -1.695
  445   2HG2  VAL  59          2HG2      VAL  59  -3.574  -4.247  -2.180
  446   3HG2  VAL  59          3HG2      VAL  59  -5.269  -4.076  -2.640
  447    H    THR  60           H        THR  60  -6.093  -4.779   1.527
  448    HA   THR  60           HA       THR  60  -5.275  -7.604   1.886
  449    HB   THR  60           HB       THR  60  -7.118  -7.410   3.774
  450    HG1  THR  60           HG1      THR  60  -6.201  -4.738   3.822
  451   1HG2  THR  60          1HG2      THR  60  -5.400  -6.763   5.377
  452   2HG2  THR  60          2HG2      THR  60  -4.401  -6.151   4.057
  453   3HG2  THR  60          3HG2      THR  60  -4.760  -7.876   4.167
  454    H    ALA  61           H        ALA  61  -7.833  -8.569   2.626
  455    HA   ALA  61           HA       ALA  61  -8.826  -9.429   0.243
  456   1HB   ALA  61          1HB       ALA  61 -10.391  -9.202   2.798
  457   2HB   ALA  61          2HB       ALA  61  -9.232 -10.475   2.417
  458   3HB   ALA  61          3HB       ALA  61 -10.705 -10.308   1.461
  459    H    THR  62           H        THR  62 -10.194  -6.663   2.093
  460    HA   THR  62           HA       THR  62 -12.496  -6.529   0.401
  461    HB   THR  62           HB       THR  62 -12.409  -4.051   1.483
  462    HG1  THR  62           HG1      THR  62 -11.061  -3.986   3.109
  463   1HG2  THR  62          1HG2      THR  62 -13.864  -4.966   3.236
  464   2HG2  THR  62          2HG2      THR  62 -13.339  -6.595   2.807
  465   3HG2  THR  62          3HG2      THR  62 -14.248  -5.627   1.646
  466    H    GLU  63           H        GLU  63  -9.435  -4.795   0.430
  467    HA   GLU  63           HA       GLU  63 -10.189  -3.109  -1.760
  468   1HB   GLU  63          1HB       GLU  63  -7.411  -3.806  -0.799
  469   2HB   GLU  63          2HB       GLU  63  -7.868  -2.428  -1.789
  470   1HG   GLU  63          1HG       GLU  63  -8.570  -2.917   1.092
  471   2HG   GLU  63          2HG       GLU  63  -7.501  -1.676   0.441
  472    H    HIS  64           H        HIS  64  -9.252  -6.320  -1.395
  473    HA   HIS  64           HA       HIS  64  -7.874  -6.687  -3.843
  474   1HB   HIS  64          1HB       HIS  64  -7.310  -8.575  -2.814
  475   2HB   HIS  64          2HB       HIS  64  -8.463  -8.236  -1.538
  476    HD1  HIS  64           HD1      HIS  64  -8.070 -10.224  -4.720
  477    HD2  HIS  64           HD2      HIS  64 -10.727  -9.850  -1.534
  478    HE1  HIS  64           HE1      HIS  64  -9.613 -12.195  -4.880
  479    HE2  HIS  64           HE2      HIS  64 -11.076 -12.060  -2.831
  480    H    ALA  65           H        ALA  65 -11.266  -7.105  -2.907
  481    HA   ALA  65           HA       ALA  65 -12.031  -8.727  -5.056
  482   1HB   ALA  65          1HB       ALA  65 -13.345  -8.455  -3.008
  483   2HB   ALA  65          2HB       ALA  65 -14.315  -8.159  -4.451
  484   3HB   ALA  65          3HB       ALA  65 -13.738  -6.802  -3.483
  485    H    GLU  66           H        GLU  66 -12.942  -5.320  -4.644
  486    HA   GLU  66           HA       GLU  66 -13.935  -5.113  -7.271
  487   1HB   GLU  66          1HB       GLU  66 -14.161  -2.703  -6.761
  488   2HB   GLU  66          2HB       GLU  66 -14.836  -3.738  -5.514
  489   1HG   GLU  66          1HG       GLU  66 -13.751  -2.314  -4.151
  490   2HG   GLU  66          2HG       GLU  66 -12.380  -3.370  -4.494
  491    H    ALA  67           H        ALA  67 -10.805  -4.449  -5.873
  492    HA   ALA  67           HA       ALA  67  -9.884  -2.980  -8.166
  493   1HB   ALA  67          1HB       ALA  67  -7.731  -2.930  -7.060
  494   2HB   ALA  67          2HB       ALA  67  -8.294  -4.101  -5.868
  495   3HB   ALA  67          3HB       ALA  67  -9.011  -2.490  -5.931
  496    H    GLU  68           H        GLU  68 -10.003  -6.330  -7.261
  497    HA   GLU  68           HA       GLU  68  -7.827  -7.074  -8.969
  498   1HB   GLU  68          1HB       GLU  68  -9.160  -8.396  -7.004
  499   2HB   GLU  68          2HB       GLU  68  -9.881  -9.118  -8.438
  500   1HG   GLU  68          1HG       GLU  68  -7.967 -10.158  -9.053
  501   2HG   GLU  68          2HG       GLU  68  -6.933  -8.887  -8.403
  502    H    LYS  69           H        LYS  69 -11.368  -7.153  -9.221
  503    HA   LYS  69           HA       LYS  69 -11.521  -8.039 -11.875
  504   1HB   LYS  69          1HB       LYS  69 -13.506  -7.817 -10.486
  505   2HB   LYS  69          2HB       LYS  69 -13.284  -6.076 -10.394
  506   1HG   LYS  69          1HG       LYS  69 -13.619  -5.971 -12.858
  507   2HG   LYS  69          2HG       LYS  69 -14.017  -7.690 -12.824
  508   1HD   LYS  69          1HD       LYS  69 -15.882  -7.246 -11.325
  509   2HD   LYS  69          2HD       LYS  69 -15.461  -5.533 -11.286
  510   1HE   LYS  69          1HE       LYS  69 -17.303  -5.896 -12.811
  511   2HE   LYS  69          2HE       LYS  69 -15.869  -5.399 -13.709
  512   1HZ   LYS  69          1HZ       LYS  69 -16.807  -8.202 -13.406
  513   2HZ   LYS  69          2HZ       LYS  69 -15.481  -7.686 -14.326
  514   3HZ   LYS  69          3HZ       LYS  69 -17.052  -7.236 -14.778
  515    H    ARG  70           H        ARG  70 -11.874  -4.658 -10.832
  516    HA   ARG  70           HA       ARG  70 -11.721  -3.651 -13.474
  517   1HB   ARG  70          1HB       ARG  70 -11.265  -2.088 -10.934
  518   2HB   ARG  70          2HB       ARG  70 -11.873  -1.485 -12.469
  519   1HG   ARG  70          1HG       ARG  70 -13.941  -2.632 -12.186
  520   2HG   ARG  70          2HG       ARG  70 -13.330  -3.494 -10.771
  521   1HD   ARG  70          1HD       ARG  70 -13.017  -1.235  -9.687
  522   2HD   ARG  70          2HD       ARG  70 -13.927  -0.555 -11.035
  523    HE   ARG  70           HE       ARG  70 -15.445  -2.638  -9.979
  524   1HH1  ARG  70          1HH1      ARG  70 -14.264   0.513  -8.997
  525   2HH1  ARG  70          2HH1      ARG  70 -15.539   0.767  -7.846
  526   1HH2  ARG  70          1HH2      ARG  70 -17.133  -2.282  -8.502
  527   2HH2  ARG  70          2HH2      ARG  70 -17.193  -0.798  -7.595
  528    H    ALA  71           H        ALA  71  -9.419  -3.610 -10.773
  529    HA   ALA  71           HA       ALA  71  -7.628  -1.954 -12.293
  530   1HB   ALA  71          1HB       ALA  71  -6.317  -1.793 -10.280
  531   2HB   ALA  71          2HB       ALA  71  -7.270  -3.071  -9.527
  532   3HB   ALA  71          3HB       ALA  71  -8.022  -1.525  -9.919
  533    H    ALA  72           H        ALA  72  -7.799  -5.425 -11.553
  534    HA   ALA  72           HA       ALA  72  -5.062  -5.787 -12.392
  535   1HB   ALA  72          1HB       ALA  72  -6.140  -7.501 -10.988
  536   2HB   ALA  72          2HB       ALA  72  -5.494  -8.161 -12.489
  537   3HB   ALA  72          3HB       ALA  72  -7.227  -7.886 -12.322
  538    H    ALA  73           H        ALA  73  -8.268  -5.993 -13.925
  539    HA   ALA  73           HA       ALA  73  -7.382  -6.743 -16.477
  540   1HB   ALA  73          1HB       ALA  73  -9.743  -6.675 -15.837
  541   2HB   ALA  73          2HB       ALA  73  -9.447  -5.761 -17.316
  542   3HB   ALA  73          3HB       ALA  73  -9.678  -4.913 -15.787
  543    H    ARG  74           H        ARG  74  -7.264  -3.665 -14.820
  544    HA   ARG  74           HA       ARG  74  -6.435  -2.211 -17.170
  545   1HB   ARG  74          1HB       ARG  74  -7.648  -1.385 -14.963
  546   2HB   ARG  74          2HB       ARG  74  -5.994  -1.150 -14.419
  547   1HG   ARG  74          1HG       ARG  74  -5.554   0.329 -16.281
  548   2HG   ARG  74          2HG       ARG  74  -7.175   0.042 -16.919
  549   1HD   ARG  74          1HD       ARG  74  -8.104   0.968 -14.812
  550   2HD   ARG  74          2HD       ARG  74  -6.463   1.365 -14.308
  551    HE   ARG  74           HE       ARG  74  -7.771   2.525 -16.691
  552   1HH1  ARG  74          1HH1      ARG  74  -5.600   2.763 -13.946
  553   2HH1  ARG  74          2HH1      ARG  74  -5.303   4.460 -14.181
  554   1HH2  ARG  74          1HH2      ARG  74  -7.387   4.754 -16.983
  555   2HH2  ARG  74          2HH2      ARG  74  -6.306   5.594 -15.910
  556    H    ALA  75           H        ALA  75  -4.858  -3.526 -14.265
  557    HA   ALA  75           HA       ALA  75  -2.221  -2.708 -14.651
  558   1HB   ALA  75          1HB       ALA  75  -1.581  -4.686 -13.383
  559   2HB   ALA  75          2HB       ALA  75  -3.179  -5.389 -13.637
  560   3HB   ALA  75          3HB       ALA  75  -3.004  -3.922 -12.674
  561    H    GLY  76           H        GLY  76  -3.612  -5.836 -15.682
  562   1HA   GLY  76          1HA       GLY  76  -1.377  -6.139 -17.560
  563   2HA   GLY  76          2HA       GLY  76  -2.472  -7.412 -17.037
  564    H    HIS  77           H        HIS  77  -2.998  -4.197 -18.471
  565    HA   HIS  77           HA       HIS  77  -5.113  -5.201 -20.115
  566   1HB   HIS  77          1HB       HIS  77  -5.310  -2.938 -20.980
  567   2HB   HIS  77          2HB       HIS  77  -5.144  -2.899 -19.231
  568    HD1  HIS  77           HD1      HIS  77  -3.120  -1.678 -18.263
  569    HD2  HIS  77           HD2      HIS  77  -3.099  -1.890 -22.418
  570    HE1  HIS  77           HE1      HIS  77  -1.298  -0.119 -19.015
  571    HE2  HIS  77           HE2      HIS  77  -1.439  -0.115 -21.531
  572    H    ALA  78           H        ALA  78  -1.826  -5.349 -20.427
  573    HA   ALA  78           HA       ALA  78  -1.973  -6.459 -23.042
  574   1HB   ALA  78          1HB       ALA  78  -1.994  -4.083 -23.670
  575   2HB   ALA  78          2HB       ALA  78  -0.518  -4.885 -24.207
  576   3HB   ALA  78          3HB       ALA  78  -0.487  -3.841 -22.785
  577    H    ALA  79           H        ALA  79  -0.996  -6.976 -20.272
  578    HA   ALA  79           HA       ALA  79   1.831  -7.486 -20.875
  579   1HB   ALA  79          1HB       ALA  79   1.695  -5.502 -19.454
  580   2HB   ALA  79          2HB       ALA  79   2.464  -6.849 -18.616
  581   3HB   ALA  79          3HB       ALA  79   0.792  -6.425 -18.254
  582    H    THR  80           H        THR  80   1.450  -9.634 -21.265
  583    HA   THR  80           HA       THR  80   1.526 -11.246 -18.878
  584    HB   THR  80           HB       THR  80  -0.589 -11.847 -20.972
  585    HG1  THR  80           HG1      THR  80  -0.643 -10.396 -18.664
  586   1HG2  THR  80          1HG2      THR  80   0.090 -13.285 -18.401
  587   2HG2  THR  80          2HG2      THR  80   0.450 -13.865 -20.027
  588   3HG2  THR  80          3HG2      THR  80  -1.225 -13.693 -19.503
  Start of MODEL    6
    1    H    MET   1           H        MET   1   8.607   1.072  -0.805
    2    HA   MET   1           HA       MET   1   7.521   1.472   1.912
    3   1HB   MET   1          1HB       MET   1   5.452   0.413   1.009
    4   2HB   MET   1          2HB       MET   1   5.783   2.004   0.346
    5   1HG   MET   1          1HG       MET   1   5.061   0.734  -1.466
    6   2HG   MET   1          2HG       MET   1   6.813   0.797  -1.634
    7   1HE   MET   1          1HE       MET   1   4.766  -1.264  -3.096
    8   2HE   MET   1          2HE       MET   1   5.711  -2.751  -3.021
    9   3HE   MET   1          3HE       MET   1   6.498  -1.227  -3.430
   10    H    HIS   2           H        HIS   2   6.233  -0.887   2.166
   11    HA   HIS   2           HA       HIS   2   8.203  -2.984   1.598
   12   1HB   HIS   2          1HB       HIS   2   8.524  -1.915   3.927
   13   2HB   HIS   2          2HB       HIS   2   6.987  -2.657   4.347
   14    HD1  HIS   2           HD1      HIS   2   6.955  -5.214   4.710
   15    HD2  HIS   2           HD2      HIS   2  10.687  -3.685   3.662
   16    HE1  HIS   2           HE1      HIS   2   8.600  -7.067   5.146
   17    HE2  HIS   2           HE2      HIS   2  10.850  -6.134   4.502
   18    H    ALA   3           H        ALA   3   7.243  -5.125   1.660
   19    HA   ALA   3           HA       ALA   3   4.310  -5.125   1.669
   20   1HB   ALA   3          1HB       ALA   3   5.018  -4.666  -0.630
   21   2HB   ALA   3          2HB       ALA   3   4.222  -6.234  -0.492
   22   3HB   ALA   3          3HB       ALA   3   5.979  -6.144  -0.626
   23    H    LYS   4           H        LYS   4   3.509  -7.435   1.225
   24    HA   LYS   4           HA       LYS   4   5.227  -9.429   2.500
   25   1HB   LYS   4          1HB       LYS   4   3.894  -8.370   4.292
   26   2HB   LYS   4          2HB       LYS   4   2.418  -8.733   3.413
   27   1HG   LYS   4          1HG       LYS   4   2.764 -11.097   3.712
   28   2HG   LYS   4          2HG       LYS   4   4.332 -10.807   4.463
   29   1HD   LYS   4          1HD       LYS   4   2.879 -11.221   6.257
   30   2HD   LYS   4          2HD       LYS   4   3.055  -9.468   6.222
   31   1HE   LYS   4          1HE       LYS   4   0.796 -10.723   4.736
   32   2HE   LYS   4          2HE       LYS   4   0.695 -10.609   6.490
   33   1HZ   LYS   4          1HZ       LYS   4   1.025  -8.360   4.574
   34   2HZ   LYS   4          2HZ       LYS   4   1.086  -8.196   6.265
   35   3HZ   LYS   4          3HZ       LYS   4  -0.339  -8.709   5.510
   36    H    VAL   5           H        VAL   5   4.642 -11.586   1.987
   37    HA   VAL   5           HA       VAL   5   3.000 -11.914  -0.399
   38    HB   VAL   5           HB       VAL   5   5.018 -13.252  -0.286
   39   1HG1  VAL   5          1HG1      VAL   5   3.979 -14.365   2.319
   40   2HG1  VAL   5          2HG1      VAL   5   5.359 -13.284   2.119
   41   3HG1  VAL   5          3HG1      VAL   5   5.419 -14.922   1.466
   42   1HG2  VAL   5          1HG2      VAL   5   3.111 -14.345  -1.328
   43   2HG2  VAL   5          2HG2      VAL   5   2.628 -15.019   0.229
   44   3HG2  VAL   5          3HG2      VAL   5   4.142 -15.526  -0.521
   45    H    GLY   6           H        GLY   6   1.003 -13.025  -0.441
   46   1HA   GLY   6          1HA       GLY   6  -1.003 -13.782   0.533
   47   2HA   GLY   6          2HA       GLY   6  -0.260 -13.639   2.128
   48    H    ASP   7           H        ASP   7   0.048 -11.200  -0.201
   49    HA   ASP   7           HA       ASP   7  -2.009  -9.376   1.042
   50   1HB   ASP   7          1HB       ASP   7   0.973  -9.023   0.912
   51   2HB   ASP   7          2HB       ASP   7  -0.040  -7.627   0.576
   52    H    TYR   8           H        TYR   8  -1.684  -7.281  -0.360
   53    HA   TYR   8           HA       TYR   8  -1.888  -8.192  -3.157
   54   1HB   TYR   8          1HB       TYR   8  -3.956  -6.645  -1.567
   55   2HB   TYR   8          2HB       TYR   8  -4.010  -6.851  -3.306
   56    HD1  TYR   8           HD1      TYR   8  -4.899  -8.811  -4.279
   57    HD2  TYR   8           HD2      TYR   8  -4.330  -8.627  -0.068
   58    HE1  TYR   8           HE1      TYR   8  -6.305 -10.819  -4.017
   59    HE2  TYR   8           HE2      TYR   8  -5.723 -10.644   0.200
   60    HH   TYR   8           HH       TYR   8  -6.554 -12.668  -2.298
   61    H    LEU   9           H        LEU   9  -2.402  -6.179  -4.553
   62    HA   LEU   9           HA       LEU   9  -0.651  -3.994  -3.686
   63   1HB   LEU   9          1HB       LEU   9   0.848  -5.560  -4.680
   64   2HB   LEU   9          2HB       LEU   9  -0.229  -5.842  -6.029
   65    HG   LEU   9           HG       LEU   9   0.920  -3.102  -5.671
   66   1HD1  LEU   9          1HD1      LEU   9   2.839  -4.577  -5.398
   67   2HD1  LEU   9          2HD1      LEU   9   2.889  -3.776  -6.968
   68   3HD1  LEU   9          3HD1      LEU   9   2.383  -5.461  -6.854
   69   1HD2  LEU   9          1HD2      LEU   9  -0.732  -3.506  -7.427
   70   2HD2  LEU   9          2HD2      LEU   9   0.266  -4.807  -8.077
   71   3HD2  LEU   9          3HD2      LEU   9   0.849  -3.142  -8.119
   72    H    VAL  10           H        VAL  10  -0.959  -2.087  -4.665
   73    HA   VAL  10           HA       VAL  10  -2.790  -1.866  -6.942
   74    HB   VAL  10           HB       VAL  10  -2.976  -0.064  -4.505
   75   1HG1  VAL  10          1HG1      VAL  10  -4.684  -0.228  -6.980
   76   2HG1  VAL  10          2HG1      VAL  10  -3.569   1.071  -6.558
   77   3HG1  VAL  10          3HG1      VAL  10  -5.011   0.793  -5.581
   78   1HG2  VAL  10          1HG2      VAL  10  -4.886  -2.220  -5.382
   79   2HG2  VAL  10          2HG2      VAL  10  -5.150  -1.075  -4.066
   80   3HG2  VAL  10          3HG2      VAL  10  -3.852  -2.263  -3.954
   81    H    VAL  11           H        VAL  11  -2.477   0.300  -8.027
   82    HA   VAL  11           HA       VAL  11  -0.075   1.727  -7.130
   83    HB   VAL  11           HB       VAL  11   0.574   0.180  -8.987
   84   1HG1  VAL  11          1HG1      VAL  11  -1.239   1.917 -10.649
   85   2HG1  VAL  11          2HG1      VAL  11  -1.494   0.216 -10.259
   86   3HG1  VAL  11          3HG1      VAL  11  -0.127   0.694 -11.265
   87   1HG2  VAL  11          1HG2      VAL  11   1.782   1.861 -10.307
   88   2HG2  VAL  11          2HG2      VAL  11   1.872   2.181  -8.576
   89   3HG2  VAL  11          3HG2      VAL  11   0.782   3.126  -9.590
   90    H    LYS  12           H        LYS  12  -0.230   3.914  -7.285
   91    HA   LYS  12           HA       LYS  12  -2.759   5.026  -8.179
   92   1HB   LYS  12          1HB       LYS  12  -1.531   5.758  -6.076
   93   2HB   LYS  12          2HB       LYS  12  -0.359   6.534  -7.129
   94   1HG   LYS  12          1HG       LYS  12  -1.918   8.106  -7.893
   95   2HG   LYS  12          2HG       LYS  12  -3.286   7.167  -7.287
   96   1HD   LYS  12          1HD       LYS  12  -3.222   8.515  -5.504
   97   2HD   LYS  12          2HD       LYS  12  -1.794   7.603  -5.020
   98   1HE   LYS  12          1HE       LYS  12  -1.809  10.153  -6.630
   99   2HE   LYS  12          2HE       LYS  12  -1.401  10.012  -4.923
  100   1HZ   LYS  12          1HZ       LYS  12   0.600  10.114  -6.162
  101   2HZ   LYS  12          2HZ       LYS  12   0.101   8.896  -7.224
  102   3HZ   LYS  12          3HZ       LYS  12   0.447   8.518  -5.609
  103    H    GLY  13           H        GLY  13   0.622   5.038  -9.089
  104   1HA   GLY  13          1HA       GLY  13   1.640   5.361 -11.106
  105   2HA   GLY  13          2HA       GLY  13   0.076   5.010 -11.817
  106    H    THR  14           H        THR  14  -0.557   6.503 -13.173
  107    HA   THR  14           HA       THR  14   0.539   9.206 -12.908
  108    HB   THR  14           HB       THR  14  -0.248   9.343 -15.358
  109    HG1  THR  14           HG1      THR  14  -0.488   7.292 -16.357
  110   1HG2  THR  14          1HG2      THR  14   1.775   8.214 -16.159
  111   2HG2  THR  14          2HG2      THR  14   1.937   7.394 -14.607
  112   3HG2  THR  14          3HG2      THR  14   2.109   9.147 -14.700
  113    H    THR  15           H        THR  15  -2.175   7.734 -11.958
  114    HA   THR  15           HA       THR  15  -3.944   9.902 -12.859
  115    HB   THR  15           HB       THR  15  -4.714   7.629 -13.432
  116    HG1  THR  15           HG1      THR  15  -6.370   9.042 -13.158
  117   1HG2  THR  15          1HG2      THR  15  -3.752   6.398 -11.559
  118   2HG2  THR  15          2HG2      THR  15  -5.489   6.112 -11.667
  119   3HG2  THR  15          3HG2      THR  15  -4.851   7.211 -10.444
  120    H    THR  16           H        THR  16  -5.450  10.800 -11.261
  121    HA   THR  16           HA       THR  16  -3.932  11.363  -8.860
  122    HB   THR  16           HB       THR  16  -6.533  12.631  -9.726
  123    HG1  THR  16           HG1      THR  16  -3.832  13.308 -10.377
  124   1HG2  THR  16          1HG2      THR  16  -4.296  13.607  -7.942
  125   2HG2  THR  16          2HG2      THR  16  -5.878  13.049  -7.399
  126   3HG2  THR  16          3HG2      THR  16  -5.747  14.513  -8.372
  127    H    GLU  17           H        GLU  17  -4.165   9.748  -7.441
  128    HA   GLU  17           HA       GLU  17  -5.001   8.699  -5.629
  129   1HB   GLU  17          1HB       GLU  17  -7.255  10.684  -5.924
  130   2HB   GLU  17          2HB       GLU  17  -7.018   9.635  -4.531
  131   1HG   GLU  17          1HG       GLU  17  -4.789  10.687  -4.201
  132   2HG   GLU  17          2HG       GLU  17  -5.185  11.817  -5.494
  133    H    ARG  18           H        ARG  18  -5.947   7.981  -8.478
  134    HA   ARG  18           HA       ARG  18  -8.269   6.376  -7.750
  135   1HB   ARG  18          1HB       ARG  18  -8.396   7.327  -9.951
  136   2HB   ARG  18          2HB       ARG  18  -6.789   6.740 -10.360
  137   1HG   ARG  18          1HG       ARG  18  -7.595   4.443 -10.284
  138   2HG   ARG  18          2HG       ARG  18  -9.203   5.014  -9.844
  139   1HD   ARG  18          1HD       ARG  18  -7.812   5.864 -12.371
  140   2HD   ARG  18          2HD       ARG  18  -8.821   4.423 -12.282
  141    HE   ARG  18           HE       ARG  18 -10.178   6.743 -11.306
  142   1HH1  ARG  18          1HH1      ARG  18  -9.218   5.067 -14.243
  143   2HH1  ARG  18          2HH1      ARG  18 -10.553   5.687 -15.171
  144   1HH2  ARG  18          1HH2      ARG  18 -11.923   7.561 -12.551
  145   2HH2  ARG  18          2HH2      ARG  18 -12.086   7.081 -14.219
  146    H    HIS  19           H        HIS  19  -8.178   4.257  -7.268
  147    HA   HIS  19           HA       HIS  19  -5.514   3.082  -7.004
  148   1HB   HIS  19          1HB       HIS  19  -8.188   2.092  -5.978
  149   2HB   HIS  19          2HB       HIS  19  -6.616   1.405  -5.589
  150    HD1  HIS  19           HD1      HIS  19  -8.895   4.227  -4.765
  151    HD2  HIS  19           HD2      HIS  19  -5.093   2.890  -3.732
  152    HE1  HIS  19           HE1      HIS  19  -8.250   5.540  -2.717
  153    HE2  HIS  19           HE2      HIS  19  -5.909   4.787  -2.163
  154    H    ASP  20           H        ASP  20  -4.867   2.125  -8.873
  155    HA   ASP  20           HA       ASP  20  -6.711   0.148 -10.026
  156   1HB   ASP  20          1HB       ASP  20  -6.435   2.376 -11.351
  157   2HB   ASP  20          2HB       ASP  20  -4.871   1.703 -11.806
  158    H    GLN  21           H        GLN  21  -5.320  -1.192 -11.749
  159    HA   GLN  21           HA       GLN  21  -4.053  -3.062 -11.766
  160   1HB   GLN  21          1HB       GLN  21  -1.941  -1.167 -10.729
  161   2HB   GLN  21          2HB       GLN  21  -1.637  -2.742 -11.453
  162   1HG   GLN  21          1HG       GLN  21  -2.786  -1.894 -13.523
  163   2HG   GLN  21          2HG       GLN  21  -2.774  -0.296 -12.780
  164   1HE2  GLN  21          1HE2      GLN  21  -0.215  -2.644 -12.410
  165   2HE2  GLN  21          2HE2      GLN  21   0.976  -1.770 -13.305
  166    H    HIS  22           H        HIS  22  -4.636  -4.656 -10.405
  167    HA   HIS  22           HA       HIS  22  -3.777  -4.482  -7.608
  168   1HB   HIS  22          1HB       HIS  22  -6.117  -3.588  -7.840
  169   2HB   HIS  22          2HB       HIS  22  -6.607  -5.188  -8.383
  170    HD1  HIS  22           HD1      HIS  22  -5.697  -7.144  -6.464
  171    HD2  HIS  22           HD2      HIS  22  -6.648  -3.280  -5.237
  172    HE1  HIS  22           HE1      HIS  22  -6.144  -7.302  -4.006
  173    HE2  HIS  22           HE2      HIS  22  -6.896  -4.999  -3.330
  174    H    ALA  23           H        ALA  23  -2.923  -6.254  -6.941
  175    HA   ALA  23           HA       ALA  23  -3.672  -8.890  -8.017
  176   1HB   ALA  23          1HB       ALA  23  -1.768  -8.078  -9.336
  177   2HB   ALA  23          2HB       ALA  23  -1.363  -9.491  -8.359
  178   3HB   ALA  23          3HB       ALA  23  -0.838  -7.884  -7.852
  179    H    GLU  24           H        GLU  24  -2.201 -10.547  -6.837
  180    HA   GLU  24           HA       GLU  24  -1.885  -9.833  -4.008
  181   1HB   GLU  24          1HB       GLU  24  -4.077 -11.019  -4.394
  182   2HB   GLU  24          2HB       GLU  24  -3.160 -12.397  -4.982
  183   1HG   GLU  24          1HG       GLU  24  -2.504 -11.338  -2.287
  184   2HG   GLU  24          2HG       GLU  24  -4.016 -12.216  -2.484
  185    H    ILE  25           H        ILE  25  -0.088 -10.460  -3.254
  186    HA   ILE  25           HA       ILE  25   1.815 -11.559  -5.133
  187    HB   ILE  25           HB       ILE  25   2.646 -10.640  -2.428
  188   1HG1  ILE  25          1HG1      ILE  25   1.707  -8.715  -4.574
  189   2HG1  ILE  25          2HG1      ILE  25   0.861  -9.031  -3.063
  190   1HG2  ILE  25          1HG2      ILE  25   3.663 -10.128  -5.217
  191   2HG2  ILE  25          2HG2      ILE  25   4.279 -11.336  -4.088
  192   3HG2  ILE  25          3HG2      ILE  25   4.451  -9.619  -3.724
  193   1HD1  ILE  25          1HD1      ILE  25   2.128  -6.955  -2.977
  194   2HD1  ILE  25          2HD1      ILE  25   3.614  -7.842  -3.316
  195   3HD1  ILE  25          3HD1      ILE  25   2.740  -8.129  -1.811
  196    H    ILE  26           H        ILE  26   1.776 -13.722  -5.129
  197    HA   ILE  26           HA       ILE  26   1.933 -15.138  -2.572
  198    HB   ILE  26           HB       ILE  26   1.600 -17.208  -3.751
  199   1HG1  ILE  26          1HG1      ILE  26   2.902 -16.533  -5.830
  200   2HG1  ILE  26          2HG1      ILE  26   1.425 -17.435  -6.133
  201   1HG2  ILE  26          1HG2      ILE  26  -0.637 -16.804  -4.756
  202   2HG2  ILE  26          2HG2      ILE  26  -0.313 -15.070  -4.731
  203   3HG2  ILE  26          3HG2      ILE  26  -0.419 -15.967  -3.216
  204   1HD1  ILE  26          1HD1      ILE  26   1.745 -14.456  -6.396
  205   2HD1  ILE  26          2HD1      ILE  26   0.284 -15.382  -6.744
  206   3HD1  ILE  26          3HD1      ILE  26   1.735 -15.620  -7.721
  207    H    GLU  27           H        GLU  27   3.840 -13.911  -5.062
  208    HA   GLU  27           HA       GLU  27   6.178 -15.126  -3.802
  209   1HB   GLU  27          1HB       GLU  27   5.347 -15.911  -6.323
  210   2HB   GLU  27          2HB       GLU  27   6.552 -14.679  -6.669
  211   1HG   GLU  27          1HG       GLU  27   6.938 -17.168  -5.022
  212   2HG   GLU  27          2HG       GLU  27   7.590 -16.848  -6.626
  213    H    VAL  28           H        VAL  28   7.984 -13.775  -3.750
  214    HA   VAL  28           HA       VAL  28   7.423 -10.963  -4.401
  215    HB   VAL  28           HB       VAL  28   8.300 -11.880  -1.658
  216   1HG1  VAL  28          1HG1      VAL  28   7.911  -9.549  -1.015
  217   2HG1  VAL  28          2HG1      VAL  28   7.504  -9.158  -2.685
  218   3HG1  VAL  28          3HG1      VAL  28   9.138  -9.681  -2.274
  219   1HG2  VAL  28          1HG2      VAL  28   5.595 -10.872  -2.530
  220   2HG2  VAL  28          2HG2      VAL  28   6.090 -11.183  -0.866
  221   3HG2  VAL  28          3HG2      VAL  28   5.978 -12.514  -2.017
  222    H    ARG  29           H        ARG  29   9.201 -10.682  -5.755
  223    HA   ARG  29           HA       ARG  29  11.734 -11.947  -5.027
  224   1HB   ARG  29          1HB       ARG  29  10.644 -12.035  -7.387
  225   2HB   ARG  29          2HB       ARG  29  11.277 -10.405  -7.564
  226   1HG   ARG  29          1HG       ARG  29  13.488 -11.668  -6.701
  227   2HG   ARG  29          2HG       ARG  29  12.680 -12.993  -7.539
  228   1HD   ARG  29          1HD       ARG  29  14.045 -11.978  -9.162
  229   2HD   ARG  29          2HD       ARG  29  12.417 -11.388  -9.495
  230    HE   ARG  29           HE       ARG  29  13.696  -9.587  -7.763
  231   1HH1  ARG  29          1HH1      ARG  29  13.840 -10.665 -11.101
  232   2HH1  ARG  29          2HH1      ARG  29  14.536  -9.176 -11.678
  233   1HH2  ARG  29          1HH2      ARG  29  14.579  -7.635  -8.519
  234   2HH2  ARG  29          2HH2      ARG  29  14.969  -7.456 -10.211
  235    H    SER  30           H        SER  30  12.118 -10.486  -3.279
  236    HA   SER  30           HA       SER  30  13.974  -8.519  -3.728
  237   1HB   SER  30          1HB       SER  30  12.653  -6.434  -3.158
  238   2HB   SER  30          2HB       SER  30  12.346  -7.092  -4.765
  239    HG   SER  30           HG       SER  30  10.342  -7.054  -4.170
  240    H    ALA  31           H        ALA  31  11.278  -9.559  -1.774
  241    HA   ALA  31           HA       ALA  31  11.090 -10.138   0.406
  242   1HB   ALA  31          1HB       ALA  31  13.365 -11.022   0.287
  243   2HB   ALA  31          2HB       ALA  31  13.026 -10.301   1.861
  244   3HB   ALA  31          3HB       ALA  31  14.005  -9.427   0.682
  245    H    ASP  32           H        ASP  32  12.173  -7.070  -0.606
  246    HA   ASP  32           HA       ASP  32  11.301  -5.860   1.919
  247   1HB   ASP  32          1HB       ASP  32  12.433  -3.877   1.294
  248   2HB   ASP  32          2HB       ASP  32  13.518  -5.185   0.839
  249    H    GLY  33           H        GLY  33  10.636  -5.969  -1.534
  250   1HA   GLY  33          1HA       GLY  33   8.146  -5.829  -1.956
  251   2HA   GLY  33          2HA       GLY  33   8.238  -4.318  -1.064
  252    H    SER  34           H        SER  34  11.042  -4.720  -2.844
  253    HA   SER  34           HA       SER  34  10.277  -2.732  -4.760
  254   1HB   SER  34          1HB       SER  34  12.790  -4.420  -4.597
  255   2HB   SER  34          2HB       SER  34  12.573  -2.992  -5.609
  256    HG   SER  34           HG       SER  34  12.518  -3.094  -2.759
  257    HA   PRO  35           HA       PRO  35   8.794  -5.428  -7.981
  258   1HB   PRO  35          1HB       PRO  35   9.785  -3.428  -9.902
  259   2HB   PRO  35          2HB       PRO  35   8.129  -3.955  -9.588
  260   1HG   PRO  35          1HG       PRO  35   9.005  -1.522  -8.856
  261   2HG   PRO  35          2HG       PRO  35   7.822  -2.423  -7.891
  262   1HD   PRO  35          1HD       PRO  35  10.763  -2.074  -7.443
  263   2HD   PRO  35          2HD       PRO  35   9.432  -2.048  -6.265
  264    HA   PRO  36           HA       PRO  36   8.492  -6.114 -10.170
  265   1HB   PRO  36          1HB       PRO  36   8.697  -8.461 -11.407
  266   2HB   PRO  36          2HB       PRO  36   9.330  -6.985 -12.144
  267   1HG   PRO  36          1HG       PRO  36  10.786  -9.156 -10.695
  268   2HG   PRO  36          2HG       PRO  36  11.243  -8.298 -12.176
  269   1HD   PRO  36          1HD       PRO  36  12.224  -7.710  -9.683
  270   2HD   PRO  36          2HD       PRO  36  12.148  -6.554 -11.025
  271    H    TYR  37           H        TYR  37   7.105  -8.226 -10.181
  272    HA   TYR  37           HA       TYR  37   7.513  -9.733  -7.683
  273   1HB   TYR  37          1HB       TYR  37   4.816  -8.632  -8.469
  274   2HB   TYR  37          2HB       TYR  37   5.278  -9.372  -6.944
  275    HD1  TYR  37           HD1      TYR  37   6.371  -8.067  -5.215
  276    HD2  TYR  37           HD2      TYR  37   5.420  -6.334  -8.980
  277    HE1  TYR  37           HE1      TYR  37   6.751  -5.823  -4.278
  278    HE2  TYR  37           HE2      TYR  37   5.804  -4.095  -8.057
  279    HH   TYR  37           HH       TYR  37   7.218  -3.599  -4.948
  280    H    VAL  38           H        VAL  38   5.765 -11.494  -7.554
  281    HA   VAL  38           HA       VAL  38   4.884 -12.386 -10.209
  282    HB   VAL  38           HB       VAL  38   6.230 -14.215  -8.193
  283   1HG1  VAL  38          1HG1      VAL  38   4.299 -15.277  -9.248
  284   2HG1  VAL  38          2HG1      VAL  38   5.796 -15.982  -9.862
  285   3HG1  VAL  38          3HG1      VAL  38   4.901 -14.820 -10.841
  286   1HG2  VAL  38          1HG2      VAL  38   7.824 -12.918  -9.518
  287   2HG2  VAL  38          2HG2      VAL  38   7.021 -13.441 -11.000
  288   3HG2  VAL  38          3HG2      VAL  38   7.853 -14.620  -9.985
  289    H    VAL  39           H        VAL  39   2.837 -12.798 -10.127
  290    HA   VAL  39           HA       VAL  39   1.606 -12.544  -7.499
  291    HB   VAL  39           HB       VAL  39   2.472 -10.385  -8.936
  292   1HG1  VAL  39          1HG1      VAL  39   0.925 -10.699 -10.735
  293   2HG1  VAL  39          2HG1      VAL  39   0.513  -9.234  -9.842
  294   3HG1  VAL  39          3HG1      VAL  39  -0.435 -10.705  -9.614
  295   1HG2  VAL  39          1HG2      VAL  39   0.158 -10.460  -7.022
  296   2HG2  VAL  39          2HG2      VAL  39   1.076  -9.022  -7.471
  297   3HG2  VAL  39          3HG2      VAL  39   1.870 -10.341  -6.611
  298    H    ARG  40           H        ARG  40  -0.843 -12.375  -7.829
  299    HA   ARG  40           HA       ARG  40  -1.670 -13.816 -10.240
  300   1HB   ARG  40          1HB       ARG  40  -1.187 -15.412  -8.348
  301   2HB   ARG  40          2HB       ARG  40  -2.453 -14.617  -7.427
  302   1HG   ARG  40          1HG       ARG  40  -4.024 -15.232  -9.303
  303   2HG   ARG  40          2HG       ARG  40  -2.729 -16.254  -9.926
  304   1HD   ARG  40          1HD       ARG  40  -4.040 -16.460  -7.220
  305   2HD   ARG  40          2HD       ARG  40  -4.266 -17.559  -8.578
  306    HE   ARG  40           HE       ARG  40  -1.724 -17.932  -8.274
  307   1HH1  ARG  40          1HH1      ARG  40  -4.004 -17.288  -5.699
  308   2HH1  ARG  40          2HH1      ARG  40  -3.162 -18.245  -4.521
  309   1HH2  ARG  40          1HH2      ARG  40  -0.581 -19.183  -6.714
  310   2HH2  ARG  40          2HH2      ARG  40  -1.201 -19.305  -5.094
  311    H    TRP  41           H        TRP  41  -3.404 -12.840 -11.097
  312    HA   TRP  41           HA       TRP  41  -4.998 -11.004  -9.536
  313   1HB   TRP  41          1HB       TRP  41  -5.962 -12.042 -12.169
  314   2HB   TRP  41          2HB       TRP  41  -6.062 -10.417 -11.510
  315    HD1  TRP  41           HD1      TRP  41  -4.324 -12.348 -14.060
  316    HE1  TRP  41           HE1      TRP  41  -2.299 -11.080 -15.000
  317    HE3  TRP  41           HE3      TRP  41  -3.933  -8.712 -10.493
  318    HZ2  TRP  41           HZ2      TRP  41  -0.737  -8.839 -14.313
  319    HZ3  TRP  41           HZ3      TRP  41  -2.140  -7.046 -10.716
  320    HH2  TRP  41           HH2      TRP  41  -0.578  -7.109 -12.585
  321    H    LEU  42           H        LEU  42  -5.861 -12.249  -7.896
  322    HA   LEU  42           HA       LEU  42  -6.440 -14.989  -8.170
  323   1HB   LEU  42          1HB       LEU  42  -7.778 -13.324  -6.086
  324   2HB   LEU  42          2HB       LEU  42  -7.154 -14.955  -5.965
  325    HG   LEU  42           HG       LEU  42  -5.528 -12.424  -6.058
  326   1HD1  LEU  42          1HD1      LEU  42  -6.014 -14.422  -3.872
  327   2HD1  LEU  42          2HD1      LEU  42  -6.702 -12.801  -3.971
  328   3HD1  LEU  42          3HD1      LEU  42  -4.962 -13.010  -3.780
  329   1HD2  LEU  42          1HD2      LEU  42  -3.603 -13.864  -5.626
  330   2HD2  LEU  42          2HD2      LEU  42  -4.344 -14.219  -7.187
  331   3HD2  LEU  42          3HD2      LEU  42  -4.628 -15.288  -5.812
  332    H    VAL  43           H        VAL  43  -8.756 -12.402  -7.461
  333    HA   VAL  43           HA       VAL  43 -11.006 -13.989  -7.862
  334    HB   VAL  43           HB       VAL  43 -12.136 -11.653  -8.104
  335   1HG1  VAL  43          1HG1      VAL  43 -10.653 -12.507  -5.627
  336   2HG1  VAL  43          2HG1      VAL  43 -12.241 -13.081  -6.139
  337   3HG1  VAL  43          3HG1      VAL  43 -12.021 -11.397  -5.666
  338   1HG2  VAL  43          1HG2      VAL  43  -9.408 -10.884  -7.071
  339   2HG2  VAL  43          2HG2      VAL  43 -10.830  -9.840  -7.083
  340   3HG2  VAL  43          3HG2      VAL  43 -10.114 -10.372  -8.604
  341    H    ASN  44           H        ASN  44  -9.216 -11.930 -10.058
  342    HA   ASN  44           HA       ASN  44 -10.895 -12.142 -12.278
  343   1HB   ASN  44          1HB       ASN  44  -7.897 -11.849 -12.105
  344   2HB   ASN  44          2HB       ASN  44  -8.793 -11.763 -13.619
  345   1HD2  ASN  44          1HD2      ASN  44  -8.209 -10.234 -10.546
  346   2HD2  ASN  44          2HD2      ASN  44  -8.866  -8.694 -10.971
  347    H    GLY  45           H        GLY  45  -7.985 -14.081 -11.554
  348   1HA   GLY  45          1HA       GLY  45  -8.241 -16.531 -11.624
  349   2HA   GLY  45          2HA       GLY  45  -9.229 -16.304 -13.057
  350    H    HIS  46           H        HIS  46  -6.119 -14.744 -12.284
  351    HA   HIS  46           HA       HIS  46  -4.825 -16.343 -14.382
  352   1HB   HIS  46          1HB       HIS  46  -5.534 -13.569 -14.621
  353   2HB   HIS  46          2HB       HIS  46  -3.792 -13.738 -14.663
  354    HD1  HIS  46           HD1      HIS  46  -3.336 -13.363 -17.079
  355    HD2  HIS  46           HD2      HIS  46  -6.335 -16.181 -16.452
  356    HE1  HIS  46           HE1      HIS  46  -3.843 -14.332 -19.345
  357    HE2  HIS  46           HE2      HIS  46  -5.510 -16.167 -18.909
  358    H    GLU  47           H        GLU  47  -2.439 -16.113 -14.353
  359    HA   GLU  47           HA       GLU  47  -1.351 -15.255 -11.759
  360   1HB   GLU  47          1HB       GLU  47  -1.971 -17.682 -11.651
  361   2HB   GLU  47          2HB       GLU  47  -0.819 -17.982 -12.942
  362   1HG   GLU  47          1HG       GLU  47   1.012 -17.403 -11.576
  363   2HG   GLU  47          2HG       GLU  47  -0.039 -16.717 -10.337
  364    H    THR  48           H        THR  48   0.514 -14.176 -11.998
  365    HA   THR  48           HA       THR  48   1.866 -14.263 -14.591
  366    HB   THR  48           HB       THR  48  -0.017 -12.665 -14.702
  367    HG1  THR  48           HG1      THR  48   1.482 -12.142 -16.173
  368   1HG2  THR  48          1HG2      THR  48   0.191 -10.503 -13.571
  369   2HG2  THR  48          2HG2      THR  48   1.613 -11.101 -12.718
  370   3HG2  THR  48          3HG2      THR  48   0.034 -11.829 -12.420
  371    H    THR  49           H        THR  49   3.484 -12.399 -14.659
  372    HA   THR  49           HA       THR  49   4.835 -11.848 -12.116
  373    HB   THR  49           HB       THR  49   6.237 -12.769 -14.648
  374    HG1  THR  49           HG1      THR  49   5.173 -14.198 -12.703
  375   1HG2  THR  49          1HG2      THR  49   7.518 -11.066 -13.439
  376   2HG2  THR  49          2HG2      THR  49   8.298 -12.642 -13.316
  377   3HG2  THR  49          3HG2      THR  49   7.380 -12.006 -11.952
  378    H    VAL  50           H        VAL  50   4.867  -9.642 -12.017
  379    HA   VAL  50           HA       VAL  50   4.600  -8.170 -14.548
  380    HB   VAL  50           HB       VAL  50   2.344  -9.022 -13.676
  381   1HG1  VAL  50          1HG1      VAL  50   2.643  -8.580 -11.328
  382   2HG1  VAL  50          2HG1      VAL  50   1.272  -7.656 -11.944
  383   3HG1  VAL  50          3HG1      VAL  50   2.815  -6.855 -11.645
  384   1HG2  VAL  50          1HG2      VAL  50   2.509  -7.308 -15.387
  385   2HG2  VAL  50          2HG2      VAL  50   2.692  -6.068 -14.148
  386   3HG2  VAL  50          3HG2      VAL  50   1.177  -6.960 -14.285
  387    H    TYR  51           H        TYR  51   4.143  -5.751 -13.987
  388    HA   TYR  51           HA       TYR  51   5.651  -4.856 -11.637
  389   1HB   TYR  51          1HB       TYR  51   6.168  -3.288 -14.082
  390   2HB   TYR  51          2HB       TYR  51   7.280  -3.786 -12.814
  391    HD1  TYR  51           HD1      TYR  51   8.438  -5.963 -12.962
  392    HD2  TYR  51           HD2      TYR  51   5.900  -4.585 -16.087
  393    HE1  TYR  51           HE1      TYR  51   9.402  -7.642 -14.482
  394    HE2  TYR  51           HE2      TYR  51   6.858  -6.256 -17.613
  395    HH   TYR  51           HH       TYR  51   8.970  -7.565 -17.824
  396    HA   PRO  52           HA       PRO  52   1.820  -2.451 -11.617
  397   1HB   PRO  52          1HB       PRO  52   2.428  -1.047  -9.344
  398   2HB   PRO  52          2HB       PRO  52   1.759  -2.684  -9.346
  399   1HG   PRO  52          1HG       PRO  52   4.602  -1.797  -9.025
  400   2HG   PRO  52          2HG       PRO  52   3.715  -3.050  -8.138
  401   1HD   PRO  52          1HD       PRO  52   5.432  -3.664 -10.108
  402   2HD   PRO  52          2HD       PRO  52   3.943  -4.595  -9.845
  403    H    GLY  53           H        GLY  53   4.536  -0.523 -10.312
  404   1HA   GLY  53          1HA       GLY  53   5.066   1.170 -12.391
  405   2HA   GLY  53          2HA       GLY  53   3.604   1.826 -11.664
  406    H    SER  54           H        SER  54   5.024   3.709 -11.251
  407    HA   SER  54           HA       SER  54   7.069   3.303  -9.227
  408   1HB   SER  54          1HB       SER  54   7.475   5.782  -9.631
  409   2HB   SER  54          2HB       SER  54   7.752   4.718 -11.008
  410    HG   SER  54           HG       SER  54   6.212   6.819 -10.937
  411    H    ASP  55           H        ASP  55   4.105   3.144  -8.741
  412    HA   ASP  55           HA       ASP  55   4.128   4.708  -6.275
  413   1HB   ASP  55          1HB       ASP  55   2.847   5.875  -8.262
  414   2HB   ASP  55          2HB       ASP  55   1.596   4.694  -7.890
  415    H    ALA  56           H        ALA  56   4.691   2.209  -6.279
  416    HA   ALA  56           HA       ALA  56   2.488   0.396  -6.392
  417   1HB   ALA  56          1HB       ALA  56   4.080  -1.323  -5.773
  418   2HB   ALA  56          2HB       ALA  56   5.291  -0.095  -5.397
  419   3HB   ALA  56          3HB       ALA  56   4.732  -0.306  -7.057
  420    H    VAL  57           H        VAL  57   1.247  -0.375  -4.779
  421    HA   VAL  57           HA       VAL  57   1.954   0.191  -1.987
  422    HB   VAL  57           HB       VAL  57   0.421   1.991  -2.928
  423   1HG1  VAL  57          1HG1      VAL  57  -1.973   1.490  -2.958
  424   2HG1  VAL  57          2HG1      VAL  57  -1.595  -0.222  -2.759
  425   3HG1  VAL  57          3HG1      VAL  57  -1.083   0.632  -4.216
  426   1HG2  VAL  57          1HG2      VAL  57   0.798   1.717  -0.559
  427   2HG2  VAL  57          2HG2      VAL  57  -0.463   0.486  -0.488
  428   3HG2  VAL  57          3HG2      VAL  57  -0.880   2.156  -0.876
  429    H    VAL  58           H        VAL  58  -0.034  -0.719  -0.704
  430    HA   VAL  58           HA       VAL  58  -0.370  -3.522  -1.558
  431    HB   VAL  58           HB       VAL  58   0.866  -2.660   1.068
  432   1HG1  VAL  58          1HG1      VAL  58  -0.570  -4.599   1.385
  433   2HG1  VAL  58          2HG1      VAL  58   1.129  -5.042   1.550
  434   3HG1  VAL  58          3HG1      VAL  58   0.255  -5.439   0.071
  435   1HG2  VAL  58          1HG2      VAL  58   2.062  -4.186  -1.241
  436   2HG2  VAL  58          2HG2      VAL  58   2.859  -3.842   0.293
  437   3HG2  VAL  58          3HG2      VAL  58   2.429  -2.521  -0.791
  438    H    VAL  59           H        VAL  59  -2.139  -4.555  -0.767
  439    HA   VAL  59           HA       VAL  59  -3.946  -3.183   1.062
  440    HB   VAL  59           HB       VAL  59  -5.667  -4.129  -0.690
  441   1HG1  VAL  59          1HG1      VAL  59  -5.795  -1.902  -1.723
  442   2HG1  VAL  59          2HG1      VAL  59  -4.216  -1.519  -1.038
  443   3HG1  VAL  59          3HG1      VAL  59  -5.593  -1.811   0.025
  444   1HG2  VAL  59          1HG2      VAL  59  -4.918  -3.764  -2.989
  445   2HG2  VAL  59          2HG2      VAL  59  -4.051  -5.076  -2.192
  446   3HG2  VAL  59          3HG2      VAL  59  -3.282  -3.501  -2.385
  447    H    THR  60           H        THR  60  -5.929  -4.707   1.339
  448    HA   THR  60           HA       THR  60  -4.851  -7.422   1.913
  449    HB   THR  60           HB       THR  60  -5.388  -5.834   3.842
  450    HG1  THR  60           HG1      THR  60  -5.776  -7.578   5.024
  451   1HG2  THR  60          1HG2      THR  60  -7.450  -4.880   2.970
  452   2HG2  THR  60          2HG2      THR  60  -7.716  -5.642   4.540
  453   3HG2  THR  60          3HG2      THR  60  -8.224  -6.462   3.061
  454    H    ALA  61           H        ALA  61  -7.125  -8.657   2.724
  455    HA   ALA  61           HA       ALA  61  -8.115  -9.726   0.355
  456   1HB   ALA  61          1HB       ALA  61  -8.042 -10.927   2.479
  457   2HB   ALA  61          2HB       ALA  61  -9.643 -10.993   1.742
  458   3HB   ALA  61          3HB       ALA  61  -9.339  -9.907   3.098
  459    H    THR  62           H        THR  62  -9.823  -7.507   2.604
  460    HA   THR  62           HA       THR  62 -12.236  -7.440   1.147
  461    HB   THR  62           HB       THR  62 -12.142  -4.925   2.128
  462    HG1  THR  62           HG1      THR  62 -10.656  -6.429   4.034
  463   1HG2  THR  62          1HG2      THR  62 -12.751  -7.423   3.706
  464   2HG2  THR  62          2HG2      THR  62 -13.844  -6.624   2.577
  465   3HG2  THR  62          3HG2      THR  62 -13.349  -5.802   4.056
  466    H    GLU  63           H        GLU  63  -9.539  -5.151   1.088
  467    HA   GLU  63           HA       GLU  63 -10.505  -3.543  -0.993
  468   1HB   GLU  63          1HB       GLU  63  -7.621  -4.138  -0.307
  469   2HB   GLU  63          2HB       GLU  63  -8.243  -2.694  -1.105
  470   1HG   GLU  63          1HG       GLU  63  -9.383  -2.001   0.870
  471   2HG   GLU  63          2HG       GLU  63  -9.041  -3.528   1.673
  472    H    HIS  64           H        HIS  64  -8.973  -6.620  -1.005
  473    HA   HIS  64           HA       HIS  64  -8.046  -6.815  -3.605
  474   1HB   HIS  64          1HB       HIS  64  -7.343  -8.701  -2.733
  475   2HB   HIS  64          2HB       HIS  64  -8.426  -8.506  -1.371
  476    HD1  HIS  64           HD1      HIS  64 -10.526  -9.960  -1.317
  477    HD2  HIS  64           HD2      HIS  64  -8.196 -10.552  -4.705
  478    HE1  HIS  64           HE1      HIS  64 -11.335 -12.113  -2.319
  479    HE2  HIS  64           HE2      HIS  64  -9.710 -12.585  -4.178
  480    H    ALA  65           H        ALA  65 -11.398  -7.422  -2.496
  481    HA   ALA  65           HA       ALA  65 -12.061  -9.136  -4.593
  482   1HB   ALA  65          1HB       ALA  65 -13.334  -8.986  -2.517
  483   2HB   ALA  65          2HB       ALA  65 -14.380  -8.740  -3.915
  484   3HB   ALA  65          3HB       ALA  65 -13.863  -7.360  -2.948
  485    H    GLU  66           H        GLU  66 -13.490  -5.990  -4.151
  486    HA   GLU  66           HA       GLU  66 -14.433  -5.680  -6.764
  487   1HB   GLU  66          1HB       GLU  66 -14.484  -3.185  -6.037
  488   2HB   GLU  66          2HB       GLU  66 -15.486  -4.355  -5.190
  489   1HG   GLU  66          1HG       GLU  66 -14.478  -3.937  -3.244
  490   2HG   GLU  66          2HG       GLU  66 -12.873  -4.128  -3.953
  491    H    ALA  67           H        ALA  67 -11.704  -4.048  -5.232
  492    HA   ALA  67           HA       ALA  67 -10.877  -2.569  -7.416
  493   1HB   ALA  67          1HB       ALA  67  -9.182  -3.558  -5.134
  494   2HB   ALA  67          2HB       ALA  67 -10.184  -2.107  -5.124
  495   3HB   ALA  67          3HB       ALA  67  -8.803  -2.217  -6.213
  496    H    GLU  68           H        GLU  68  -9.994  -5.891  -6.516
  497    HA   GLU  68           HA       GLU  68  -7.830  -5.964  -8.376
  498   1HB   GLU  68          1HB       GLU  68  -7.989  -7.476  -6.414
  499   2HB   GLU  68          2HB       GLU  68  -9.309  -8.315  -7.217
  500   1HG   GLU  68          1HG       GLU  68  -7.920  -9.197  -8.854
  501   2HG   GLU  68          2HG       GLU  68  -6.640  -8.022  -8.533
  502    H    LYS  69           H        LYS  69 -11.231  -6.995  -8.528
  503    HA   LYS  69           HA       LYS  69 -11.121  -8.273 -10.987
  504   1HB   LYS  69          1HB       LYS  69 -13.323  -6.476  -9.949
  505   2HB   LYS  69          2HB       LYS  69 -13.481  -7.580 -11.308
  506   1HG   LYS  69          1HG       LYS  69 -12.877  -9.439  -9.718
  507   2HG   LYS  69          2HG       LYS  69 -13.061  -8.264  -8.413
  508   1HD   LYS  69          1HD       LYS  69 -15.118  -9.474  -8.637
  509   2HD   LYS  69          2HD       LYS  69 -15.378  -7.828  -9.224
  510   1HE   LYS  69          1HE       LYS  69 -16.423  -9.378 -10.745
  511   2HE   LYS  69          2HE       LYS  69 -15.026  -8.648 -11.538
  512   1HZ   LYS  69          1HZ       LYS  69 -14.729 -10.849 -12.045
  513   2HZ   LYS  69          2HZ       LYS  69 -15.402 -11.405 -10.591
  514   3HZ   LYS  69          3HZ       LYS  69 -13.837 -10.760 -10.607
  515    H    ARG  70           H        ARG  70 -11.826  -4.810 -10.414
  516    HA   ARG  70           HA       ARG  70 -11.730  -4.216 -13.222
  517   1HB   ARG  70          1HB       ARG  70 -11.647  -1.794 -12.368
  518   2HB   ARG  70          2HB       ARG  70 -13.062  -2.757 -11.964
  519   1HG   ARG  70          1HG       ARG  70 -12.063  -3.206  -9.740
  520   2HG   ARG  70          2HG       ARG  70 -10.738  -2.118 -10.156
  521   1HD   ARG  70          1HD       ARG  70 -12.253  -0.259 -10.341
  522   2HD   ARG  70          2HD       ARG  70 -13.645  -1.320 -10.125
  523    HE   ARG  70           HE       ARG  70 -12.005  -1.619  -7.894
  524   1HH1  ARG  70          1HH1      ARG  70 -14.008   0.852  -9.370
  525   2HH1  ARG  70          2HH1      ARG  70 -14.319   1.670  -7.864
  526   1HH2  ARG  70          1HH2      ARG  70 -12.464  -0.573  -5.902
  527   2HH2  ARG  70          2HH2      ARG  70 -13.438   0.866  -5.911
  528    H    ALA  71           H        ALA  71  -9.447  -3.582 -10.591
  529    HA   ALA  71           HA       ALA  71  -7.679  -2.084 -12.221
  530   1HB   ALA  71          1HB       ALA  71  -7.230  -3.283  -9.499
  531   2HB   ALA  71          2HB       ALA  71  -7.917  -1.692  -9.831
  532   3HB   ALA  71          3HB       ALA  71  -6.243  -2.040 -10.266
  533    H    ALA  72           H        ALA  72  -7.801  -5.500 -11.302
  534    HA   ALA  72           HA       ALA  72  -5.149  -6.027 -12.291
  535   1HB   ALA  72          1HB       ALA  72  -5.699  -8.380 -12.062
  536   2HB   ALA  72          2HB       ALA  72  -7.390  -7.970 -11.767
  537   3HB   ALA  72          3HB       ALA  72  -6.149  -7.489 -10.609
  538    H    ALA  73           H        ALA  73  -8.456  -6.228 -13.547
  539    HA   ALA  73           HA       ALA  73  -7.974  -7.361 -16.014
  540   1HB   ALA  73          1HB       ALA  73  -9.767  -4.998 -15.451
  541   2HB   ALA  73          2HB       ALA  73 -10.204  -6.697 -15.255
  542   3HB   ALA  73          3HB       ALA  73  -9.854  -6.054 -16.861
  543    H    ARG  74           H        ARG  74  -7.359  -4.008 -14.974
  544    HA   ARG  74           HA       ARG  74  -6.139  -3.395 -17.532
  545   1HB   ARG  74          1HB       ARG  74  -6.563  -1.887 -15.011
  546   2HB   ARG  74          2HB       ARG  74  -5.315  -1.323 -16.118
  547   1HG   ARG  74          1HG       ARG  74  -7.016  -1.315 -17.930
  548   2HG   ARG  74          2HG       ARG  74  -8.239  -1.710 -16.723
  549   1HD   ARG  74          1HD       ARG  74  -6.457   0.700 -16.516
  550   2HD   ARG  74          2HD       ARG  74  -8.013   0.732 -17.342
  551    HE   ARG  74           HE       ARG  74  -7.597   0.254 -14.461
  552   1HH1  ARG  74          1HH1      ARG  74  -9.672   1.121 -17.159
  553   2HH1  ARG  74          2HH1      ARG  74 -11.006   1.594 -16.146
  554   1HH2  ARG  74          1HH2      ARG  74  -9.315   0.885 -13.135
  555   2HH2  ARG  74          2HH2      ARG  74 -10.801   1.458 -13.847
  556    H    ALA  75           H        ALA  75  -4.814  -4.000 -14.273
  557    HA   ALA  75           HA       ALA  75  -2.150  -3.379 -14.565
  558   1HB   ALA  75          1HB       ALA  75  -3.236  -5.806 -13.144
  559   2HB   ALA  75          2HB       ALA  75  -3.179  -4.168 -12.491
  560   3HB   ALA  75          3HB       ALA  75  -1.682  -5.025 -12.858
  561    H    GLY  76           H        GLY  76  -3.638  -6.515 -15.415
  562   1HA   GLY  76          1HA       GLY  76  -1.278  -7.058 -17.105
  563   2HA   GLY  76          2HA       GLY  76  -1.759  -8.238 -15.894
  564    H    HIS  77           H        HIS  77  -3.504  -6.262 -18.264
  565    HA   HIS  77           HA       HIS  77  -5.560  -8.099 -18.698
  566   1HB   HIS  77          1HB       HIS  77  -5.517  -5.631 -19.299
  567   2HB   HIS  77          2HB       HIS  77  -4.588  -6.081 -20.724
  568    HD1  HIS  77           HD1      HIS  77  -6.422  -5.330 -22.350
  569    HD2  HIS  77           HD2      HIS  77  -7.664  -8.238 -19.646
  570    HE1  HIS  77           HE1      HIS  77  -8.658  -6.132 -23.187
  571    HE2  HIS  77           HE2      HIS  77  -9.487  -7.707 -21.398
  572    H    ALA  78           H        ALA  78  -2.638  -7.462 -20.619
  573    HA   ALA  78           HA       ALA  78  -2.937 -10.151 -21.780
  574   1HB   ALA  78          1HB       ALA  78  -3.607  -8.519 -23.462
  575   2HB   ALA  78          2HB       ALA  78  -2.096  -9.304 -23.921
  576   3HB   ALA  78          3HB       ALA  78  -2.077  -7.668 -23.265
  577    H    ALA  79           H        ALA  79  -0.730  -7.429 -21.267
  578    HA   ALA  79           HA       ALA  79   1.446  -7.267 -20.690
  579   1HB   ALA  79          1HB       ALA  79   2.520  -9.045 -19.437
  580   2HB   ALA  79          2HB       ALA  79   1.238 -10.168 -19.893
  581   3HB   ALA  79          3HB       ALA  79   0.875  -8.787 -18.857
  582    H    THR  80           H        THR  80   3.211  -7.167 -21.881
  583    HA   THR  80           HA       THR  80   4.572  -7.358 -23.666
  584    HB   THR  80           HB       THR  80   5.414  -9.707 -24.163
  585    HG1  THR  80           HG1      THR  80   3.265 -10.466 -22.977
  586   1HG2  THR  80          1HG2      THR  80   6.648  -9.846 -22.050
  587   2HG2  THR  80          2HG2      THR  80   5.513  -8.715 -21.313
  588   3HG2  THR  80          3HG2      THR  80   6.554  -8.184 -22.633
  Start of MODEL    7
    1    H    MET   1           H        MET   1   7.795   2.101   1.375
    2    HA   MET   1           HA       MET   1   5.653   1.239   1.806
    3   1HB   MET   1          1HB       MET   1   4.331   0.132   0.090
    4   2HB   MET   1          2HB       MET   1   4.664   1.789  -0.381
    5   1HG   MET   1          1HG       MET   1   4.967   0.630  -2.343
    6   2HG   MET   1          2HG       MET   1   6.615   0.775  -1.731
    7   1HE   MET   1          1HE       MET   1   7.324  -1.176  -3.447
    8   2HE   MET   1          2HE       MET   1   5.651  -1.297  -3.990
    9   3HE   MET   1          3HE       MET   1   6.529  -2.749  -3.504
   10    H    HIS   2           H        HIS   2   5.064  -1.165   1.737
   11    HA   HIS   2           HA       HIS   2   7.387  -2.892   1.347
   12   1HB   HIS   2          1HB       HIS   2   5.950  -2.480   3.971
   13   2HB   HIS   2          2HB       HIS   2   6.808  -3.976   3.615
   14    HD1  HIS   2           HD1      HIS   2   9.294  -3.987   3.981
   15    HD2  HIS   2           HD2      HIS   2   7.689  -0.150   4.018
   16    HE1  HIS   2           HE1      HIS   2  11.178  -2.471   4.651
   17    HE2  HIS   2           HE2      HIS   2  10.237  -0.141   4.462
   18    H    ALA   3           H        ALA   3   6.822  -5.085   0.935
   19    HA   ALA   3           HA       ALA   3   3.970  -5.478   0.387
   20   1HB   ALA   3          1HB       ALA   3   6.144  -5.744  -1.682
   21   2HB   ALA   3          2HB       ALA   3   4.948  -4.451  -1.605
   22   3HB   ALA   3          3HB       ALA   3   4.435  -6.109  -1.919
   23    H    LYS   4           H        LYS   4   3.333  -7.599   0.111
   24    HA   LYS   4           HA       LYS   4   5.078  -9.558   1.413
   25   1HB   LYS   4          1HB       LYS   4   2.395  -8.680   2.501
   26   2HB   LYS   4          2HB       LYS   4   3.493  -9.846   3.226
   27   1HG   LYS   4          1HG       LYS   4   4.442  -7.061   2.768
   28   2HG   LYS   4          2HG       LYS   4   3.353  -7.392   4.116
   29   1HD   LYS   4          1HD       LYS   4   5.941  -8.860   3.623
   30   2HD   LYS   4          2HD       LYS   4   5.771  -7.480   4.712
   31   1HE   LYS   4          1HE       LYS   4   4.412 -10.161   4.932
   32   2HE   LYS   4          2HE       LYS   4   5.633  -9.490   6.012
   33   1HZ   LYS   4          1HZ       LYS   4   4.056  -7.729   6.607
   34   2HZ   LYS   4          2HZ       LYS   4   3.446  -9.269   6.978
   35   3HZ   LYS   4          3HZ       LYS   4   2.879  -8.440   5.613
   36    H    VAL   5           H        VAL   5   4.514 -11.682   0.891
   37    HA   VAL   5           HA       VAL   5   2.598 -12.220  -1.104
   38    HB   VAL   5           HB       VAL   5   4.361 -13.814  -0.735
   39   1HG1  VAL   5          1HG1      VAL   5   4.574 -15.116   1.330
   40   2HG1  VAL   5          2HG1      VAL   5   3.251 -14.189   2.043
   41   3HG1  VAL   5          3HG1      VAL   5   4.766 -13.387   1.624
   42   1HG2  VAL   5          1HG2      VAL   5   2.270 -14.787  -1.517
   43   2HG2  VAL   5          2HG2      VAL   5   1.746 -15.033   0.149
   44   3HG2  VAL   5          3HG2      VAL   5   3.133 -15.923  -0.481
   45    H    GLY   6           H        GLY   6   0.465 -12.882  -1.036
   46   1HA   GLY   6          1HA       GLY   6  -1.656 -13.310  -0.110
   47   2HA   GLY   6          2HA       GLY   6  -0.947 -13.219   1.504
   48    H    ASP   7           H        ASP   7  -0.083 -10.864  -0.701
   49    HA   ASP   7           HA       ASP   7  -1.807  -8.770   0.546
   50   1HB   ASP   7          1HB       ASP   7   0.582  -9.228   1.710
   51   2HB   ASP   7          2HB       ASP   7   1.123  -8.176   0.408
   52    H    TYR   8           H        TYR   8  -1.615  -6.681  -0.827
   53    HA   TYR   8           HA       TYR   8  -1.863  -7.799  -3.581
   54   1HB   TYR   8          1HB       TYR   8  -3.942  -6.380  -1.863
   55   2HB   TYR   8          2HB       TYR   8  -4.129  -6.686  -3.572
   56    HD1  TYR   8           HD1      TYR   8  -5.118  -8.584  -4.329
   57    HD2  TYR   8           HD2      TYR   8  -3.942  -8.372  -0.255
   58    HE1  TYR   8           HE1      TYR   8  -6.417 -10.603  -3.876
   59    HE2  TYR   8           HE2      TYR   8  -5.247 -10.418   0.207
   60    HH   TYR   8           HH       TYR   8  -6.309 -12.480  -2.096
   61    H    LEU   9           H        LEU   9  -2.076  -5.953  -5.152
   62    HA   LEU   9           HA       LEU   9  -0.594  -3.709  -3.964
   63   1HB   LEU   9          1HB       LEU   9   1.026  -5.437  -4.410
   64   2HB   LEU   9          2HB       LEU   9   0.367  -5.722  -6.003
   65    HG   LEU   9           HG       LEU   9   1.698  -3.111  -5.294
   66   1HD1  LEU   9          1HD1      LEU   9   3.746  -4.025  -6.257
   67   2HD1  LEU   9          2HD1      LEU   9   2.976  -5.606  -6.402
   68   3HD1  LEU   9          3HD1      LEU   9   3.268  -4.909  -4.807
   69   1HD2  LEU   9          1HD2      LEU   9   2.085  -2.999  -7.706
   70   2HD2  LEU   9          2HD2      LEU   9   0.363  -3.159  -7.357
   71   3HD2  LEU   9          3HD2      LEU   9   1.283  -4.557  -7.916
   72    H    VAL  10           H        VAL  10  -0.327  -1.973  -5.248
   73    HA   VAL  10           HA       VAL  10  -2.589  -1.489  -7.041
   74    HB   VAL  10           HB       VAL  10  -2.175   0.042  -4.471
   75   1HG1  VAL  10          1HG1      VAL  10  -4.532  -0.107  -6.339
   76   2HG1  VAL  10          2HG1      VAL  10  -3.365   1.211  -6.238
   77   3HG1  VAL  10          3HG1      VAL  10  -4.427   0.867  -4.872
   78   1HG2  VAL  10          1HG2      VAL  10  -4.094  -2.234  -4.925
   79   2HG2  VAL  10          2HG2      VAL  10  -4.077  -1.174  -3.515
   80   3HG2  VAL  10          3HG2      VAL  10  -2.703  -2.232  -3.842
   81    H    VAL  11           H        VAL  11  -2.327   0.440  -8.244
   82    HA   VAL  11           HA       VAL  11   0.208   1.870  -7.820
   83    HB   VAL  11           HB       VAL  11  -0.661   0.737 -10.493
   84   1HG1  VAL  11          1HG1      VAL  11   1.514   1.497 -11.301
   85   2HG1  VAL  11          2HG1      VAL  11   1.856   2.201  -9.718
   86   3HG1  VAL  11          3HG1      VAL  11   0.538   2.841 -10.703
   87   1HG2  VAL  11          1HG2      VAL  11   1.593  -0.145  -8.696
   88   2HG2  VAL  11          2HG2      VAL  11   1.286  -0.741 -10.328
   89   3HG2  VAL  11          3HG2      VAL  11   0.118  -1.049  -9.042
   90    H    LYS  12           H        LYS  12   0.211   3.931  -8.490
   91    HA   LYS  12           HA       LYS  12  -2.404   5.136  -8.545
   92   1HB   LYS  12          1HB       LYS  12  -0.660   5.923  -7.010
   93   2HB   LYS  12          2HB       LYS  12   0.365   6.335  -8.373
   94   1HG   LYS  12          1HG       LYS  12  -1.278   8.018  -9.078
   95   2HG   LYS  12          2HG       LYS  12  -2.261   7.622  -7.664
   96   1HD   LYS  12          1HD       LYS  12  -0.490   8.323  -6.181
   97   2HD   LYS  12          2HD       LYS  12   0.601   8.576  -7.544
   98   1HE   LYS  12          1HE       LYS  12  -0.843  10.353  -8.378
   99   2HE   LYS  12          2HE       LYS  12  -1.955  10.088  -7.035
  100   1HZ   LYS  12          1HZ       LYS  12  -0.485  11.956  -6.612
  101   2HZ   LYS  12          2HZ       LYS  12   0.878  10.962  -6.790
  102   3HZ   LYS  12          3HZ       LYS  12  -0.195  10.706  -5.500
  103    H    GLY  13           H        GLY  13  -3.179   4.758 -10.613
  104   1HA   GLY  13          1HA       GLY  13  -1.879   5.376 -13.015
  105   2HA   GLY  13          2HA       GLY  13  -3.624   5.352 -12.782
  106    H    THR  14           H        THR  14  -4.017   7.356 -11.001
  107    HA   THR  14           HA       THR  14  -4.106   9.595 -10.637
  108    HB   THR  14           HB       THR  14  -1.755   9.930 -12.510
  109    HG1  THR  14           HG1      THR  14  -0.900   8.663 -10.966
  110   1HG2  THR  14          1HG2      THR  14  -2.799  11.619 -10.232
  111   2HG2  THR  14          2HG2      THR  14  -2.942  11.996 -11.951
  112   3HG2  THR  14          3HG2      THR  14  -1.352  11.958 -11.185
  113    H    THR  15           H        THR  15  -2.973   9.407 -14.019
  114    HA   THR  15           HA       THR  15  -4.948  11.226 -14.938
  115    HB   THR  15           HB       THR  15  -4.167  10.025 -17.219
  116    HG1  THR  15           HG1      THR  15  -2.875   8.446 -16.233
  117   1HG2  THR  15          1HG2      THR  15  -2.395  11.711 -17.347
  118   2HG2  THR  15          2HG2      THR  15  -2.506  11.966 -15.608
  119   3HG2  THR  15          3HG2      THR  15  -3.865  12.384 -16.649
  120    H    THR  16           H        THR  16  -4.783   7.764 -14.603
  121    HA   THR  16           HA       THR  16  -7.480   7.563 -15.735
  122    HB   THR  16           HB       THR  16  -7.078   5.068 -15.638
  123    HG1  THR  16           HG1      THR  16  -5.343   4.951 -14.233
  124   1HG2  THR  16          1HG2      THR  16  -5.692   5.041 -17.671
  125   2HG2  THR  16          2HG2      THR  16  -5.245   6.721 -17.378
  126   3HG2  THR  16          3HG2      THR  16  -6.920   6.306 -17.732
  127    H    GLU  17           H        GLU  17  -8.318   8.575 -13.828
  128    HA   GLU  17           HA       GLU  17  -9.588   8.481 -11.975
  129   1HB   GLU  17          1HB       GLU  17  -9.227   5.486 -12.172
  130   2HB   GLU  17          2HB       GLU  17 -10.476   6.328 -11.262
  131   1HG   GLU  17          1HG       GLU  17 -11.231   7.324 -13.447
  132   2HG   GLU  17          2HG       GLU  17 -10.136   6.200 -14.243
  133    H    ARG  18           H        ARG  18  -9.307   6.306  -9.930
  134    HA   ARG  18           HA       ARG  18  -7.610   7.853  -8.215
  135   1HB   ARG  18          1HB       ARG  18  -9.039   5.237  -7.717
  136   2HB   ARG  18          2HB       ARG  18  -8.344   6.278  -6.484
  137   1HG   ARG  18          1HG       ARG  18  -9.959   7.986  -6.927
  138   2HG   ARG  18          2HG       ARG  18 -10.567   7.103  -8.331
  139   1HD   ARG  18          1HD       ARG  18 -12.039   6.816  -6.405
  140   2HD   ARG  18          2HD       ARG  18 -11.307   5.286  -6.886
  141    HE   ARG  18           HE       ARG  18 -10.061   6.814  -4.717
  142   1HH1  ARG  18          1HH1      ARG  18 -11.875   4.004  -5.768
  143   2HH1  ARG  18          2HH1      ARG  18 -11.685   3.159  -4.262
  144   1HH2  ARG  18          1HH2      ARG  18  -9.790   5.678  -2.735
  145   2HH2  ARG  18          2HH2      ARG  18 -10.508   4.102  -2.557
  146    H    HIS  19           H        HIS  19  -6.725   5.796  -6.488
  147    HA   HIS  19           HA       HIS  19  -4.388   4.774  -7.884
  148   1HB   HIS  19          1HB       HIS  19  -5.259   4.261  -5.019
  149   2HB   HIS  19          2HB       HIS  19  -3.674   3.943  -5.707
  150    HD1  HIS  19           HD1      HIS  19  -3.079   5.477  -3.485
  151    HD2  HIS  19           HD2      HIS  19  -4.750   7.404  -6.769
  152    HE1  HIS  19           HE1      HIS  19  -2.599   7.921  -3.161
  153    HE2  HIS  19           HE2      HIS  19  -3.875   9.071  -5.004
  154    H    ASP  20           H        ASP  20  -4.800   3.054  -9.160
  155    HA   ASP  20           HA       ASP  20  -6.821   1.134  -8.203
  156   1HB   ASP  20          1HB       ASP  20  -7.571   2.721 -10.075
  157   2HB   ASP  20          2HB       ASP  20  -6.434   1.866 -11.111
  158    H    GLN  21           H        GLN  21  -6.468  -0.571 -10.506
  159    HA   GLN  21           HA       GLN  21  -5.218  -2.343 -11.179
  160   1HB   GLN  21          1HB       GLN  21  -2.813  -0.713 -10.329
  161   2HB   GLN  21          2HB       GLN  21  -2.820  -2.073 -11.442
  162   1HG   GLN  21          1HG       GLN  21  -4.049  -0.801 -13.069
  163   2HG   GLN  21          2HG       GLN  21  -4.233   0.537 -11.936
  164   1HE2  GLN  21          1HE2      GLN  21  -2.034  -1.176 -14.019
  165   2HE2  GLN  21          2HE2      GLN  21  -0.794   0.025 -14.028
  166    H    HIS  22           H        HIS  22  -5.726  -4.052  -9.632
  167    HA   HIS  22           HA       HIS  22  -3.449  -4.317  -7.772
  168   1HB   HIS  22          1HB       HIS  22  -6.180  -5.325  -6.982
  169   2HB   HIS  22          2HB       HIS  22  -4.764  -5.149  -5.974
  170    HD1  HIS  22           HD1      HIS  22  -6.255  -3.945  -4.240
  171    HD2  HIS  22           HD2      HIS  22  -5.964  -1.946  -7.858
  172    HE1  HIS  22           HE1      HIS  22  -7.248  -1.672  -3.838
  173    HE2  HIS  22           HE2      HIS  22  -7.269  -0.574  -6.108
  174    H    ALA  23           H        ALA  23  -2.611  -6.068  -7.757
  175    HA   ALA  23           HA       ALA  23  -3.746  -8.663  -8.448
  176   1HB   ALA  23          1HB       ALA  23  -2.758  -7.878 -10.567
  177   2HB   ALA  23          2HB       ALA  23  -1.920  -9.279  -9.900
  178   3HB   ALA  23          3HB       ALA  23  -1.200  -7.674  -9.766
  179    H    GLU  24           H        GLU  24  -2.504 -10.389  -7.256
  180    HA   GLU  24           HA       GLU  24  -0.968  -9.044  -5.117
  181   1HB   GLU  24          1HB       GLU  24  -3.201  -9.240  -4.263
  182   2HB   GLU  24          2HB       GLU  24  -3.340 -10.889  -4.846
  183   1HG   GLU  24          1HG       GLU  24  -1.118 -10.545  -3.004
  184   2HG   GLU  24          2HG       GLU  24  -2.661 -10.090  -2.294
  185    H    ILE  25           H        ILE  25   0.343 -10.223  -4.005
  186    HA   ILE  25           HA       ILE  25   1.586 -12.067  -5.841
  187    HB   ILE  25           HB       ILE  25   3.663 -11.482  -4.527
  188   1HG1  ILE  25          1HG1      ILE  25   1.741  -9.485  -3.320
  189   2HG1  ILE  25          2HG1      ILE  25   2.703 -10.687  -2.467
  190   1HG2  ILE  25          1HG2      ILE  25   2.164  -9.261  -5.904
  191   2HG2  ILE  25          2HG2      ILE  25   3.142 -10.501  -6.689
  192   3HG2  ILE  25          3HG2      ILE  25   3.906  -9.311  -5.634
  193   1HD1  ILE  25          1HD1      ILE  25   3.770  -8.286  -3.938
  194   2HD1  ILE  25          2HD1      ILE  25   4.742  -9.489  -3.092
  195   3HD1  ILE  25          3HD1      ILE  25   3.630  -8.462  -2.188
  196    H    ILE  26           H        ILE  26   1.797 -13.992  -5.502
  197    HA   ILE  26           HA       ILE  26   1.773 -15.146  -2.825
  198    HB   ILE  26           HB       ILE  26   1.817 -17.324  -4.280
  199   1HG1  ILE  26          1HG1      ILE  26   0.495 -16.979  -6.410
  200   2HG1  ILE  26          2HG1      ILE  26   0.803 -15.258  -6.253
  201   1HG2  ILE  26          1HG2      ILE  26   0.004 -16.661  -2.831
  202   2HG2  ILE  26          2HG2      ILE  26  -0.641 -17.273  -4.355
  203   3HG2  ILE  26          3HG2      ILE  26  -0.595 -15.537  -4.051
  204   1HD1  ILE  26          1HD1      ILE  26   3.198 -15.665  -6.468
  205   2HD1  ILE  26          2HD1      ILE  26   2.303 -16.293  -7.852
  206   3HD1  ILE  26          3HD1      ILE  26   2.889 -17.397  -6.609
  207    H    GLU  27           H        GLU  27   3.788 -13.964  -5.168
  208    HA   GLU  27           HA       GLU  27   6.083 -15.128  -3.790
  209   1HB   GLU  27          1HB       GLU  27   5.759 -14.958  -6.787
  210   2HB   GLU  27          2HB       GLU  27   7.325 -15.115  -6.007
  211   1HG   GLU  27          1HG       GLU  27   6.405 -17.212  -4.915
  212   2HG   GLU  27          2HG       GLU  27   5.066 -17.084  -6.054
  213    H    VAL  28           H        VAL  28   7.744 -13.737  -3.475
  214    HA   VAL  28           HA       VAL  28   7.451 -10.989  -4.457
  215    HB   VAL  28           HB       VAL  28   8.088 -11.586  -1.569
  216   1HG1  VAL  28          1HG1      VAL  28   8.814  -9.430  -2.390
  217   2HG1  VAL  28          2HG1      VAL  28   7.488  -9.232  -1.242
  218   3HG1  VAL  28          3HG1      VAL  28   7.186  -9.079  -2.974
  219   1HG2  VAL  28          1HG2      VAL  28   5.796 -10.988  -0.974
  220   2HG2  VAL  28          2HG2      VAL  28   5.843 -12.441  -1.971
  221   3HG2  VAL  28          3HG2      VAL  28   5.373 -10.898  -2.682
  222    H    ARG  29           H        ARG  29   9.501  -9.994  -4.726
  223    HA   ARG  29           HA       ARG  29  11.799 -11.731  -4.108
  224   1HB   ARG  29          1HB       ARG  29  10.926 -11.659  -6.555
  225   2HB   ARG  29          2HB       ARG  29  11.672 -10.067  -6.605
  226   1HG   ARG  29          1HG       ARG  29  13.792 -10.900  -6.538
  227   2HG   ARG  29          2HG       ARG  29  13.316 -12.337  -5.628
  228   1HD   ARG  29          1HD       ARG  29  12.707 -11.818  -8.536
  229   2HD   ARG  29          2HD       ARG  29  13.970 -12.888  -7.927
  230    HE   ARG  29           HE       ARG  29  11.809 -13.915  -6.740
  231   1HH1  ARG  29          1HH1      ARG  29  12.377 -12.981 -10.073
  232   2HH1  ARG  29          2HH1      ARG  29  11.240 -14.124 -10.723
  233   1HH2  ARG  29          1HH2      ARG  29  10.319 -15.420  -7.578
  234   2HH2  ARG  29          2HH2      ARG  29  10.061 -15.520  -9.297
  235    H    SER  30           H        SER  30  10.622  -9.355  -2.814
  236    HA   SER  30           HA       SER  30  13.022  -8.087  -2.083
  237   1HB   SER  30          1HB       SER  30  12.774  -6.938  -4.247
  238   2HB   SER  30          2HB       SER  30  11.154  -6.414  -3.790
  239    HG   SER  30           HG       SER  30  13.641  -5.492  -2.947
  240    H    ALA  31           H        ALA  31  12.705  -7.647  -0.010
  241    HA   ALA  31           HA       ALA  31  10.026  -7.212   1.029
  242   1HB   ALA  31          1HB       ALA  31  12.698  -7.176   2.443
  243   2HB   ALA  31          2HB       ALA  31  11.624  -8.568   2.306
  244   3HB   ALA  31          3HB       ALA  31  11.114  -7.149   3.219
  245    H    ASP  32           H        ASP  32  12.614  -5.412  -0.174
  246    HA   ASP  32           HA       ASP  32  12.215  -2.958   1.220
  247   1HB   ASP  32          1HB       ASP  32  13.485  -3.480  -1.479
  248   2HB   ASP  32          2HB       ASP  32  13.611  -1.982  -0.567
  249    H    GLY  33           H        GLY  33  11.217  -4.238  -1.912
  250   1HA   GLY  33          1HA       GLY  33   8.879  -3.669  -2.561
  251   2HA   GLY  33          2HA       GLY  33   9.294  -2.010  -2.142
  252    H    SER  34           H        SER  34  11.278  -4.362  -3.855
  253    HA   SER  34           HA       SER  34  11.190  -2.624  -6.229
  254   1HB   SER  34          1HB       SER  34  13.480  -4.357  -5.246
  255   2HB   SER  34          2HB       SER  34  13.493  -3.359  -6.701
  256    HG   SER  34           HG       SER  34  13.231  -1.522  -5.372
  257    HA   PRO  35           HA       PRO  35   9.757  -6.146  -8.511
  258   1HB   PRO  35          1HB       PRO  35  10.635  -5.532 -10.994
  259   2HB   PRO  35          2HB       PRO  35   9.316  -4.651 -10.213
  260   1HG   PRO  35          1HG       PRO  35  12.206  -3.909 -10.459
  261   2HG   PRO  35          2HG       PRO  35  10.768  -2.895 -10.682
  262   1HD   PRO  35          1HD       PRO  35  12.235  -2.885  -8.398
  263   2HD   PRO  35          2HD       PRO  35  10.488  -2.576  -8.422
  264    HA   PRO  36           HA       PRO  36   9.735  -7.301 -10.723
  265   1HB   PRO  36          1HB       PRO  36   9.936 -10.198 -10.788
  266   2HB   PRO  36          2HB       PRO  36   9.990  -9.054 -12.131
  267   1HG   PRO  36          1HG       PRO  36  12.148 -10.495 -11.342
  268   2HG   PRO  36          2HG       PRO  36  12.278  -8.881 -12.064
  269   1HD   PRO  36          1HD       PRO  36  12.375  -9.673  -9.171
  270   2HD   PRO  36          2HD       PRO  36  13.420  -8.543 -10.063
  271    H    TYR  37           H        TYR  37   7.766  -8.804 -10.496
  272    HA   TYR  37           HA       TYR  37   7.302  -9.537  -7.690
  273   1HB   TYR  37          1HB       TYR  37   5.920  -7.408  -9.272
  274   2HB   TYR  37          2HB       TYR  37   4.961  -8.379  -8.159
  275    HD1  TYR  37           HD1      TYR  37   5.497  -8.366  -5.740
  276    HD2  TYR  37           HD2      TYR  37   7.395  -5.710  -8.467
  277    HE1  TYR  37           HE1      TYR  37   6.201  -6.950  -3.861
  278    HE2  TYR  37           HE2      TYR  37   8.105  -4.286  -6.589
  279    HH   TYR  37           HH       TYR  37   7.917  -5.309  -3.343
  280    H    VAL  38           H        VAL  38   5.713 -11.271  -7.455
  281    HA   VAL  38           HA       VAL  38   4.721 -12.152 -10.084
  282    HB   VAL  38           HB       VAL  38   6.130 -13.989  -8.123
  283   1HG1  VAL  38          1HG1      VAL  38   4.820 -14.592 -10.782
  284   2HG1  VAL  38          2HG1      VAL  38   4.213 -15.072  -9.197
  285   3HG1  VAL  38          3HG1      VAL  38   5.730 -15.741  -9.800
  286   1HG2  VAL  38          1HG2      VAL  38   6.883 -13.171 -10.925
  287   2HG2  VAL  38          2HG2      VAL  38   7.753 -14.320  -9.909
  288   3HG2  VAL  38          3HG2      VAL  38   7.670 -12.619  -9.447
  289    H    VAL  39           H        VAL  39   2.974 -13.694  -9.887
  290    HA   VAL  39           HA       VAL  39   1.367 -12.027  -8.144
  291    HB   VAL  39           HB       VAL  39   1.540 -11.618 -11.135
  292   1HG1  VAL  39          1HG1      VAL  39  -0.028 -10.146  -9.031
  293   2HG1  VAL  39          2HG1      VAL  39  -0.689 -11.231 -10.252
  294   3HG1  VAL  39          3HG1      VAL  39   0.069  -9.716 -10.738
  295   1HG2  VAL  39          1HG2      VAL  39   2.479  -9.840  -8.883
  296   2HG2  VAL  39          2HG2      VAL  39   2.475  -9.416 -10.597
  297   3HG2  VAL  39          3HG2      VAL  39   3.511 -10.719 -10.012
  298    H    ARG  40           H        ARG  40  -0.673 -12.618  -7.952
  299    HA   ARG  40           HA       ARG  40  -1.768 -14.168 -10.173
  300   1HB   ARG  40          1HB       ARG  40  -1.277 -15.802  -8.430
  301   2HB   ARG  40          2HB       ARG  40  -2.057 -14.798  -7.220
  302   1HG   ARG  40          1HG       ARG  40  -4.207 -15.221  -8.142
  303   2HG   ARG  40          2HG       ARG  40  -3.507 -16.004  -9.561
  304   1HD   ARG  40          1HD       ARG  40  -4.362 -17.667  -8.020
  305   2HD   ARG  40          2HD       ARG  40  -2.605 -17.775  -8.125
  306    HE   ARG  40           HE       ARG  40  -3.615 -16.172  -5.936
  307   1HH1  ARG  40          1HH1      ARG  40  -2.466 -19.293  -7.017
  308   2HH1  ARG  40          2HH1      ARG  40  -2.172 -19.883  -5.410
  309   1HH2  ARG  40          1HH2      ARG  40  -3.230 -16.941  -3.815
  310   2HH2  ARG  40          2HH2      ARG  40  -2.604 -18.554  -3.594
  311    H    TRP  41           H        TRP  41  -3.788 -13.589 -10.661
  312    HA   TRP  41           HA       TRP  41  -4.714 -11.084  -9.441
  313   1HB   TRP  41          1HB       TRP  41  -5.462 -12.364 -12.097
  314   2HB   TRP  41          2HB       TRP  41  -5.970 -10.773 -11.541
  315    HD1  TRP  41           HD1      TRP  41  -2.354 -11.687 -10.931
  316    HE1  TRP  41           HE1      TRP  41  -0.848 -10.314 -12.491
  317    HE3  TRP  41           HE3      TRP  41  -5.938  -9.696 -13.944
  318    HZ2  TRP  41           HZ2      TRP  41  -1.132  -8.618 -14.714
  319    HZ3  TRP  41           HZ3      TRP  41  -5.230  -8.203 -15.740
  320    HH2  TRP  41           HH2      TRP  41  -2.894  -7.676 -16.142
  321    H    LEU  42           H        LEU  42  -5.572 -12.183  -7.650
  322    HA   LEU  42           HA       LEU  42  -6.275 -14.892  -8.065
  323   1HB   LEU  42          1HB       LEU  42  -7.326 -13.781  -5.600
  324   2HB   LEU  42          2HB       LEU  42  -6.151 -15.055  -5.853
  325    HG   LEU  42           HG       LEU  42  -5.402 -12.139  -6.111
  326   1HD1  LEU  42          1HD1      LEU  42  -5.356 -13.904  -3.670
  327   2HD1  LEU  42          2HD1      LEU  42  -6.377 -12.487  -3.923
  328   3HD1  LEU  42          3HD1      LEU  42  -4.625 -12.304  -3.801
  329   1HD2  LEU  42          1HD2      LEU  42  -3.795 -14.611  -5.478
  330   2HD2  LEU  42          2HD2      LEU  42  -3.181 -12.966  -5.634
  331   3HD2  LEU  42          3HD2      LEU  42  -3.852 -13.793  -7.040
  332    H    VAL  43           H        VAL  43  -8.383 -12.072  -7.418
  333    HA   VAL  43           HA       VAL  43 -10.764 -13.563  -7.410
  334    HB   VAL  43           HB       VAL  43 -11.668 -11.214  -8.314
  335   1HG1  VAL  43          1HG1      VAL  43 -12.139 -12.229  -6.120
  336   2HG1  VAL  43          2HG1      VAL  43 -11.796 -10.505  -5.969
  337   3HG1  VAL  43          3HG1      VAL  43 -10.562 -11.693  -5.543
  338   1HG2  VAL  43          1HG2      VAL  43  -9.447 -10.310  -8.780
  339   2HG2  VAL  43          2HG2      VAL  43  -8.975 -10.606  -7.107
  340   3HG2  VAL  43          3HG2      VAL  43 -10.222  -9.414  -7.471
  341    H    ASN  44           H        ASN  44  -9.004 -12.056 -10.063
  342    HA   ASN  44           HA       ASN  44 -10.742 -12.733 -12.158
  343   1HB   ASN  44          1HB       ASN  44  -7.771 -12.249 -12.152
  344   2HB   ASN  44          2HB       ASN  44  -8.716 -12.488 -13.621
  345   1HD2  ASN  44          1HD2      ASN  44  -8.041 -10.367 -10.961
  346   2HD2  ASN  44          2HD2      ASN  44  -8.840  -8.978 -11.605
  347    H    GLY  45           H        GLY  45  -8.134 -14.551 -10.664
  348   1HA   GLY  45          1HA       GLY  45  -7.923 -16.895 -10.658
  349   2HA   GLY  45          2HA       GLY  45  -9.092 -16.984 -11.965
  350    H    HIS  46           H        HIS  46  -5.949 -15.259 -11.665
  351    HA   HIS  46           HA       HIS  46  -4.868 -16.998 -13.772
  352   1HB   HIS  46          1HB       HIS  46  -5.779 -14.870 -14.807
  353   2HB   HIS  46          2HB       HIS  46  -4.555 -13.989 -13.899
  354    HD1  HIS  46           HD1      HIS  46  -3.095 -13.210 -15.815
  355    HD2  HIS  46           HD2      HIS  46  -3.865 -17.299 -15.927
  356    HE1  HIS  46           HE1      HIS  46  -1.575 -14.144 -17.590
  357    HE2  HIS  46           HE2      HIS  46  -1.959 -16.637 -17.544
  358    H    GLU  47           H        GLU  47  -2.451 -16.901 -13.899
  359    HA   GLU  47           HA       GLU  47  -1.160 -15.815 -11.486
  360   1HB   GLU  47          1HB       GLU  47  -0.868 -18.665 -12.464
  361   2HB   GLU  47          2HB       GLU  47   0.069 -17.942 -11.165
  362   1HG   GLU  47          1HG       GLU  47  -1.999 -17.604  -9.885
  363   2HG   GLU  47          2HG       GLU  47  -2.909 -18.381 -11.179
  364    H    THR  48           H        THR  48   0.450 -14.638 -12.039
  365    HA   THR  48           HA       THR  48   1.917 -15.009 -14.532
  366    HB   THR  48           HB       THR  48  -0.086 -13.681 -15.009
  367    HG1  THR  48           HG1      THR  48   1.651 -13.367 -16.357
  368   1HG2  THR  48          1HG2      THR  48  -0.180 -11.349 -14.257
  369   2HG2  THR  48          2HG2      THR  48   1.194 -11.668 -13.197
  370   3HG2  THR  48          3HG2      THR  48  -0.340 -12.498 -12.925
  371    H    THR  49           H        THR  49   3.338 -12.945 -14.777
  372    HA   THR  49           HA       THR  49   4.575 -12.173 -12.216
  373    HB   THR  49           HB       THR  49   6.099 -13.210 -14.631
  374    HG1  THR  49           HG1      THR  49   5.026 -14.518 -12.639
  375   1HG2  THR  49          1HG2      THR  49   8.121 -12.888 -13.276
  376   2HG2  THR  49          2HG2      THR  49   7.148 -12.184 -11.984
  377   3HG2  THR  49          3HG2      THR  49   7.284 -11.357 -13.535
  378    H    VAL  50           H        VAL  50   4.942 -10.016 -12.169
  379    HA   VAL  50           HA       VAL  50   4.635  -8.476 -14.671
  380    HB   VAL  50           HB       VAL  50   2.984  -7.740 -12.274
  381   1HG1  VAL  50          1HG1      VAL  50   2.600  -7.287 -15.230
  382   2HG1  VAL  50          2HG1      VAL  50   3.221  -6.109 -14.071
  383   3HG1  VAL  50          3HG1      VAL  50   1.556  -6.682 -13.943
  384   1HG2  VAL  50          1HG2      VAL  50   1.065  -8.936 -13.229
  385   2HG2  VAL  50          2HG2      VAL  50   2.343 -10.032 -12.705
  386   3HG2  VAL  50          3HG2      VAL  50   2.135  -9.675 -14.419
  387    H    TYR  51           H        TYR  51   4.620  -6.046 -14.000
  388    HA   TYR  51           HA       TYR  51   6.382  -5.408 -11.749
  389   1HB   TYR  51          1HB       TYR  51   6.739  -4.093 -14.448
  390   2HB   TYR  51          2HB       TYR  51   7.823  -4.054 -13.065
  391    HD1  TYR  51           HD1      TYR  51   9.312  -5.950 -12.606
  392    HD2  TYR  51           HD2      TYR  51   6.760  -5.931 -16.007
  393    HE1  TYR  51           HE1      TYR  51  10.620  -7.786 -13.594
  394    HE2  TYR  51           HE2      TYR  51   8.054  -7.763 -17.002
  395    HH   TYR  51           HH       TYR  51  10.250  -8.743 -16.874
  396    HA   PRO  52           HA       PRO  52   2.751  -2.709 -11.334
  397   1HB   PRO  52          1HB       PRO  52   4.360  -1.588  -9.119
  398   2HB   PRO  52          2HB       PRO  52   2.747  -2.305  -9.092
  399   1HG   PRO  52          1HG       PRO  52   4.845  -3.594  -8.064
  400   2HG   PRO  52          2HG       PRO  52   3.563  -4.462  -8.930
  401   1HD   PRO  52          1HD       PRO  52   6.291  -3.670  -9.878
  402   2HD   PRO  52          2HD       PRO  52   5.400  -5.185 -10.142
  403    H    GLY  53           H        GLY  53   5.766  -1.075 -10.320
  404   1HA   GLY  53          1HA       GLY  53   6.660   0.565 -12.038
  405   2HA   GLY  53          2HA       GLY  53   5.005   1.160 -12.082
  406    H    SER  54           H        SER  54   5.153   3.140 -11.213
  407    HA   SER  54           HA       SER  54   6.634   3.486  -8.712
  408   1HB   SER  54          1HB       SER  54   6.216   5.961  -9.260
  409   2HB   SER  54          2HB       SER  54   7.317   5.083 -10.323
  410    HG   SER  54           HG       SER  54   4.809   6.132 -10.831
  411    H    ASP  55           H        ASP  55   5.632   4.899  -7.057
  412    HA   ASP  55           HA       ASP  55   4.009   5.308  -5.528
  413   1HB   ASP  55          1HB       ASP  55   2.446   5.622  -8.083
  414   2HB   ASP  55          2HB       ASP  55   1.705   5.880  -6.506
  415    H    ALA  56           H        ALA  56   4.672   2.777  -5.724
  416    HA   ALA  56           HA       ALA  56   2.443   1.024  -6.136
  417   1HB   ALA  56          1HB       ALA  56   3.959  -0.762  -5.465
  418   2HB   ALA  56          2HB       ALA  56   5.159   0.431  -4.967
  419   3HB   ALA  56          3HB       ALA  56   4.711   0.288  -6.667
  420    H    VAL  57           H        VAL  57   1.007   0.350  -4.666
  421    HA   VAL  57           HA       VAL  57   1.577   0.666  -1.797
  422    HB   VAL  57           HB       VAL  57  -0.796   1.480  -1.471
  423   1HG1  VAL  57          1HG1      VAL  57  -0.228   3.825  -1.905
  424   2HG1  VAL  57          2HG1      VAL  57   1.132   3.307  -2.901
  425   3HG1  VAL  57          3HG1      VAL  57   1.115   2.951  -1.173
  426   1HG2  VAL  57          1HG2      VAL  57  -1.833   2.673  -3.341
  427   2HG2  VAL  57          2HG2      VAL  57  -1.670   0.951  -3.677
  428   3HG2  VAL  57          3HG2      VAL  57  -0.553   2.100  -4.413
  429    H    VAL  58           H        VAL  58  -0.395  -0.314  -0.553
  430    HA   VAL  58           HA       VAL  58  -1.040  -2.854  -1.844
  431    HB   VAL  58           HB       VAL  58  -0.404  -3.642   0.651
  432   1HG1  VAL  58          1HG1      VAL  58   0.301  -4.733  -1.415
  433   2HG1  VAL  58          2HG1      VAL  58   1.679  -4.528  -0.331
  434   3HG1  VAL  58          3HG1      VAL  58   1.466  -3.441  -1.706
  435   1HG2  VAL  58          1HG2      VAL  58   1.747  -2.673   1.261
  436   2HG2  VAL  58          2HG2      VAL  58   0.459  -1.469   1.300
  437   3HG2  VAL  58          3HG2      VAL  58   1.585  -1.511  -0.057
  438    H    VAL  59           H        VAL  59  -2.664  -4.056  -0.983
  439    HA   VAL  59           HA       VAL  59  -4.461  -2.977   1.014
  440    HB   VAL  59           HB       VAL  59  -6.208  -3.878  -0.573
  441   1HG1  VAL  59          1HG1      VAL  59  -6.379  -1.820  -1.878
  442   2HG1  VAL  59          2HG1      VAL  59  -4.721  -1.427  -1.428
  443   3HG1  VAL  59          3HG1      VAL  59  -5.978  -1.492  -0.192
  444   1HG2  VAL  59          1HG2      VAL  59  -5.674  -3.854  -2.958
  445   2HG2  VAL  59          2HG2      VAL  59  -4.822  -5.115  -2.067
  446   3HG2  VAL  59          3HG2      VAL  59  -3.977  -3.637  -2.530
  447    H    THR  60           H        THR  60  -6.232  -4.743   1.234
  448    HA   THR  60           HA       THR  60  -4.907  -7.381   1.587
  449    HB   THR  60           HB       THR  60  -6.570  -7.621   3.502
  450    HG1  THR  60           HG1      THR  60  -7.001  -4.899   2.823
  451   1HG2  THR  60          1HG2      THR  60  -4.220  -7.102   3.907
  452   2HG2  THR  60          2HG2      THR  60  -5.260  -6.271   5.065
  453   3HG2  THR  60          3HG2      THR  60  -4.561  -5.381   3.712
  454    H    ALA  61           H        ALA  61  -7.036  -8.892   2.329
  455    HA   ALA  61           HA       ALA  61  -7.998  -9.807  -0.098
  456   1HB   ALA  61          1HB       ALA  61  -9.304 -11.383   1.157
  457   2HB   ALA  61          2HB       ALA  61  -9.149 -10.402   2.613
  458   3HB   ALA  61          3HB       ALA  61  -7.725 -11.176   1.918
  459    H    THR  62           H        THR  62  -9.839  -7.924   2.344
  460    HA   THR  62           HA       THR  62 -12.343  -8.192   1.082
  461    HB   THR  62           HB       THR  62 -12.448  -5.662   2.128
  462    HG1  THR  62           HG1      THR  62 -10.880  -5.430   3.545
  463   1HG2  THR  62          1HG2      THR  62 -13.497  -6.742   4.071
  464   2HG2  THR  62          2HG2      THR  62 -12.846  -8.295   3.547
  465   3HG2  THR  62          3HG2      THR  62 -14.033  -7.454   2.550
  466    H    GLU  63           H        GLU  63 -10.037  -5.561   0.875
  467    HA   GLU  63           HA       GLU  63 -11.311  -4.005  -1.054
  468   1HB   GLU  63          1HB       GLU  63  -8.323  -4.342  -0.685
  469   2HB   GLU  63          2HB       GLU  63  -9.158  -2.930  -1.320
  470   1HG   GLU  63          1HG       GLU  63 -10.024  -2.365   0.802
  471   2HG   GLU  63          2HG       GLU  63  -9.604  -3.932   1.480
  472    H    HIS  64           H        HIS  64  -9.319  -6.815  -1.252
  473    HA   HIS  64           HA       HIS  64  -8.502  -6.782  -3.890
  474   1HB   HIS  64          1HB       HIS  64  -7.401  -8.511  -3.084
  475   2HB   HIS  64          2HB       HIS  64  -8.441  -8.547  -1.677
  476    HD1  HIS  64           HD1      HIS  64 -10.225 -10.402  -1.576
  477    HD2  HIS  64           HD2      HIS  64  -7.972 -10.451  -5.067
  478    HE1  HIS  64           HE1      HIS  64 -10.594 -12.668  -2.585
  479    HE2  HIS  64           HE2      HIS  64  -9.074 -12.738  -4.583
  480    H    ALA  65           H        ALA  65 -11.652  -7.850  -2.642
  481    HA   ALA  65           HA       ALA  65 -12.262  -9.604  -4.741
  482   1HB   ALA  65          1HB       ALA  65 -13.522  -9.513  -2.638
  483   2HB   ALA  65          2HB       ALA  65 -14.586  -9.354  -4.036
  484   3HB   ALA  65          3HB       ALA  65 -14.156  -7.931  -3.090
  485    H    GLU  66           H        GLU  66 -13.868  -6.570  -4.244
  486    HA   GLU  66           HA       GLU  66 -14.688  -6.133  -6.863
  487   1HB   GLU  66          1HB       GLU  66 -14.657  -3.633  -5.822
  488   2HB   GLU  66          2HB       GLU  66 -15.911  -4.821  -5.482
  489   1HG   GLU  66          1HG       GLU  66 -14.576  -5.511  -3.448
  490   2HG   GLU  66          2HG       GLU  66 -13.522  -4.131  -3.755
  491    H    ALA  67           H        ALA  67 -12.174  -4.392  -5.117
  492    HA   ALA  67           HA       ALA  67 -11.292  -2.873  -7.258
  493   1HB   ALA  67          1HB       ALA  67  -9.699  -3.702  -4.842
  494   2HB   ALA  67          2HB       ALA  67 -10.794  -2.322  -4.931
  495   3HB   ALA  67          3HB       ALA  67  -9.335  -2.356  -5.922
  496    H    GLU  68           H        GLU  68  -9.766  -5.877  -5.937
  497    HA   GLU  68           HA       GLU  68  -7.658  -5.749  -7.802
  498   1HB   GLU  68          1HB       GLU  68  -7.335  -7.154  -5.874
  499   2HB   GLU  68          2HB       GLU  68  -8.674  -8.193  -6.352
  500   1HG   GLU  68          1HG       GLU  68  -7.434  -8.806  -8.389
  501   2HG   GLU  68          2HG       GLU  68  -6.084  -7.818  -7.844
  502    H    LYS  69           H        LYS  69 -10.900  -7.229  -8.125
  503    HA   LYS  69           HA       LYS  69 -10.366  -8.561 -10.532
  504   1HB   LYS  69          1HB       LYS  69 -12.529  -8.657  -9.306
  505   2HB   LYS  69          2HB       LYS  69 -12.890  -7.032  -9.878
  506   1HG   LYS  69          1HG       LYS  69 -12.849  -7.821 -12.182
  507   2HG   LYS  69          2HG       LYS  69 -12.453  -9.446 -11.625
  508   1HD   LYS  69          1HD       LYS  69 -14.973  -7.919 -10.982
  509   2HD   LYS  69          2HD       LYS  69 -14.829  -9.240 -12.145
  510   1HE   LYS  69          1HE       LYS  69 -14.112 -10.726 -10.299
  511   2HE   LYS  69          2HE       LYS  69 -14.387  -9.405  -9.163
  512   1HZ   LYS  69          1HZ       LYS  69 -16.281 -10.844  -9.183
  513   2HZ   LYS  69          2HZ       LYS  69 -16.418 -10.734 -10.870
  514   3HZ   LYS  69          3HZ       LYS  69 -16.724  -9.371  -9.907
  515    H    ARG  70           H        ARG  70 -11.914  -5.347 -10.328
  516    HA   ARG  70           HA       ARG  70 -11.654  -4.773 -13.091
  517   1HB   ARG  70          1HB       ARG  70 -13.227  -3.586 -11.716
  518   2HB   ARG  70          2HB       ARG  70 -11.951  -2.989 -10.671
  519   1HG   ARG  70          1HG       ARG  70 -11.494  -2.149 -13.379
  520   2HG   ARG  70          2HG       ARG  70 -13.118  -1.701 -12.850
  521   1HD   ARG  70          1HD       ARG  70 -11.667  -1.034 -10.661
  522   2HD   ARG  70          2HD       ARG  70 -10.487  -0.734 -11.935
  523    HE   ARG  70           HE       ARG  70 -12.687   0.517 -12.873
  524   1HH1  ARG  70          1HH1      ARG  70 -10.862   0.712  -9.882
  525   2HH1  ARG  70          2HH1      ARG  70 -11.465   2.291  -9.467
  526   1HH2  ARG  70          1HH2      ARG  70 -13.432   2.621 -12.350
  527   2HH2  ARG  70          2HH2      ARG  70 -12.910   3.382 -10.881
  528    H    ALA  71           H        ALA  71  -9.813  -3.639 -10.379
  529    HA   ALA  71           HA       ALA  71  -7.928  -2.087 -11.663
  530   1HB   ALA  71          1HB       ALA  71  -8.448  -2.009  -9.294
  531   2HB   ALA  71          2HB       ALA  71  -6.720  -2.225  -9.571
  532   3HB   ALA  71          3HB       ALA  71  -7.712  -3.595  -9.076
  533    H    ALA  72           H        ALA  72  -7.808  -5.604 -10.934
  534    HA   ALA  72           HA       ALA  72  -5.110  -5.998 -11.594
  535   1HB   ALA  72          1HB       ALA  72  -6.486  -7.784 -10.611
  536   2HB   ALA  72          2HB       ALA  72  -5.633  -8.314 -12.061
  537   3HB   ALA  72          3HB       ALA  72  -7.354  -7.936 -12.139
  538    H    ALA  73           H        ALA  73  -8.032  -6.013 -13.606
  539    HA   ALA  73           HA       ALA  73  -6.769  -6.635 -16.027
  540   1HB   ALA  73          1HB       ALA  73  -9.091  -4.749 -15.595
  541   2HB   ALA  73          2HB       ALA  73  -9.197  -6.497 -15.813
  542   3HB   ALA  73          3HB       ALA  73  -8.629  -5.475 -17.134
  543    H    ARG  74           H        ARG  74  -7.174  -3.516 -14.407
  544    HA   ARG  74           HA       ARG  74  -5.795  -1.885 -16.238
  545   1HB   ARG  74          1HB       ARG  74  -6.574  -1.694 -13.433
  546   2HB   ARG  74          2HB       ARG  74  -5.090  -0.828 -13.795
  547   1HG   ARG  74          1HG       ARG  74  -6.787   0.741 -14.072
  548   2HG   ARG  74          2HG       ARG  74  -6.366   0.243 -15.711
  549   1HD   ARG  74          1HD       ARG  74  -8.278  -1.272 -15.742
  550   2HD   ARG  74          2HD       ARG  74  -8.696  -0.787 -14.099
  551    HE   ARG  74           HE       ARG  74  -9.085   0.752 -16.535
  552   1HH1  ARG  74          1HH1      ARG  74  -8.994   0.800 -13.019
  553   2HH1  ARG  74          2HH1      ARG  74 -10.053   2.177 -12.910
  554   1HH2  ARG  74          1HH2      ARG  74 -10.476   2.562 -16.356
  555   2HH2  ARG  74          2HH2      ARG  74 -10.881   3.181 -14.772
  556    H    ALA  75           H        ALA  75  -4.460  -3.526 -13.357
  557    HA   ALA  75           HA       ALA  75  -1.863  -2.587 -13.343
  558   1HB   ALA  75          1HB       ALA  75  -2.843  -3.969 -11.576
  559   2HB   ALA  75          2HB       ALA  75  -1.260  -4.560 -12.082
  560   3HB   ALA  75          3HB       ALA  75  -2.723  -5.387 -12.621
  561    H    GLY  76           H        GLY  76  -3.107  -5.294 -15.313
  562   1HA   GLY  76          1HA       GLY  76  -0.322  -5.569 -16.307
  563   2HA   GLY  76          2HA       GLY  76  -1.477  -6.883 -16.316
  564    H    HIS  77           H        HIS  77  -3.090  -4.118 -17.256
  565    HA   HIS  77           HA       HIS  77  -2.789  -4.764 -20.085
  566   1HB   HIS  77          1HB       HIS  77  -5.056  -4.356 -19.156
  567   2HB   HIS  77          2HB       HIS  77  -4.578  -2.712 -18.753
  568    HD1  HIS  77           HD1      HIS  77  -5.645  -4.861 -21.615
  569    HD2  HIS  77           HD2      HIS  77  -4.396  -0.949 -20.948
  570    HE1  HIS  77           HE1      HIS  77  -6.171  -3.611 -23.727
  571    HE2  HIS  77           HE2      HIS  77  -5.164  -1.324 -23.387
  572    H    ALA  78           H        ALA  78  -1.690  -2.520 -17.757
  573    HA   ALA  78           HA       ALA  78  -0.919  -0.470 -19.631
  574   1HB   ALA  78          1HB       ALA  78  -1.546   0.108 -17.339
  575   2HB   ALA  78          2HB       ALA  78   0.108   0.607 -17.697
  576   3HB   ALA  78          3HB       ALA  78  -0.186  -0.837 -16.728
  577    H    ALA  79           H        ALA  79   0.344  -3.446 -18.663
  578    HA   ALA  79           HA       ALA  79   3.057  -2.665 -19.479
  579   1HB   ALA  79          1HB       ALA  79   3.844  -4.680 -18.342
  580   2HB   ALA  79          2HB       ALA  79   2.184  -5.096 -17.917
  581   3HB   ALA  79          3HB       ALA  79   2.931  -3.650 -17.240
  582    H    THR  80           H        THR  80   2.750  -2.776 -21.695
  583    HA   THR  80           HA       THR  80   2.288  -5.490 -22.738
  584    HB   THR  80           HB       THR  80   1.504  -2.905 -24.108
  585    HG1  THR  80           HG1      THR  80   0.202  -4.492 -22.279
  586   1HG2  THR  80          1HG2      THR  80   2.066  -4.739 -25.645
  587   2HG2  THR  80          2HG2      THR  80   0.342  -4.363 -25.689
  588   3HG2  THR  80          3HG2      THR  80   0.914  -5.785 -24.811
  Start of MODEL    8
    1    H    MET   1           H        MET   1   9.868   1.261  -1.219
    2    HA   MET   1           HA       MET   1   7.504   1.228   0.565
    3   1HB   MET   1          1HB       MET   1   6.347   0.042  -1.202
    4   2HB   MET   1          2HB       MET   1   6.928   1.577  -1.833
    5   1HG   MET   1          1HG       MET   1   8.702   0.512  -3.007
    6   2HG   MET   1          2HG       MET   1   8.389  -1.024  -2.205
    7   1HE   MET   1          1HE       MET   1   4.951  -2.065  -3.765
    8   2HE   MET   1          2HE       MET   1   5.227  -1.178  -2.265
    9   3HE   MET   1          3HE       MET   1   6.261  -2.543  -2.686
   10    H    HIS   2           H        HIS   2   6.893  -0.900   1.229
   11    HA   HIS   2           HA       HIS   2   8.785  -3.037   0.605
   12   1HB   HIS   2          1HB       HIS   2   8.967  -3.781   2.896
   13   2HB   HIS   2          2HB       HIS   2   9.466  -2.099   2.808
   14    HD1  HIS   2           HD1      HIS   2   7.930  -0.341   3.982
   15    HD2  HIS   2           HD2      HIS   2   6.753  -4.302   4.482
   16    HE1  HIS   2           HE1      HIS   2   6.265  -0.326   5.868
   17    HE2  HIS   2           HE2      HIS   2   5.743  -2.756   6.294
   18    H    ALA   3           H        ALA   3   7.824  -4.925   0.188
   19    HA   ALA   3           HA       ALA   3   4.938  -5.140   0.755
   20   1HB   ALA   3          1HB       ALA   3   4.622  -6.193  -1.421
   21   2HB   ALA   3          2HB       ALA   3   6.337  -5.995  -1.779
   22   3HB   ALA   3          3HB       ALA   3   5.304  -4.577  -1.606
   23    H    LYS   4           H        LYS   4   4.163  -7.230   1.161
   24    HA   LYS   4           HA       LYS   4   6.211  -9.309   1.492
   25   1HB   LYS   4          1HB       LYS   4   4.117  -8.467   3.498
   26   2HB   LYS   4          2HB       LYS   4   4.990  -9.987   3.599
   27   1HG   LYS   4          1HG       LYS   4   6.522  -7.433   3.430
   28   2HG   LYS   4          2HG       LYS   4   5.773  -7.899   4.957
   29   1HD   LYS   4          1HD       LYS   4   7.931  -8.772   5.104
   30   2HD   LYS   4          2HD       LYS   4   6.952 -10.153   4.620
   31   1HE   LYS   4          1HE       LYS   4   8.975 -10.161   3.338
   32   2HE   LYS   4          2HE       LYS   4   7.638  -9.745   2.269
   33   1HZ   LYS   4          1HZ       LYS   4   9.229  -7.611   3.541
   34   2HZ   LYS   4          2HZ       LYS   4   8.337  -7.569   2.097
   35   3HZ   LYS   4          3HZ       LYS   4   9.813  -8.392   2.158
   36    H    VAL   5           H        VAL   5   5.103 -11.478   1.930
   37    HA   VAL   5           HA       VAL   5   3.200 -11.869  -0.225
   38    HB   VAL   5           HB       VAL   5   5.062 -13.407  -0.141
   39   1HG1  VAL   5          1HG1      VAL   5   5.633 -13.205   2.209
   40   2HG1  VAL   5          2HG1      VAL   5   5.450 -14.902   1.766
   41   3HG1  VAL   5          3HG1      VAL   5   4.169 -14.081   2.659
   42   1HG2  VAL   5          1HG2      VAL   5   3.926 -15.578  -0.010
   43   2HG2  VAL   5          2HG2      VAL   5   2.957 -14.386  -0.876
   44   3HG2  VAL   5          3HG2      VAL   5   2.556 -14.806   0.789
   45    H    GLY   6           H        GLY   6   1.187 -12.817  -0.012
   46   1HA   GLY   6          1HA       GLY   6  -0.667 -13.668   1.176
   47   2HA   GLY   6          2HA       GLY   6   0.134 -13.241   2.686
   48    H    ASP   7           H        ASP   7   0.430 -10.825   0.422
   49    HA   ASP   7           HA       ASP   7  -2.026  -9.382   1.395
   50   1HB   ASP   7          1HB       ASP   7   0.838  -8.363   1.314
   51   2HB   ASP   7          2HB       ASP   7  -0.552  -7.281   1.315
   52    H    TYR   8           H        TYR   8  -2.328  -7.396  -0.052
   53    HA   TYR   8           HA       TYR   8  -1.987  -8.407  -2.778
   54   1HB   TYR   8          1HB       TYR   8  -4.139  -6.658  -1.586
   55   2HB   TYR   8          2HB       TYR   8  -4.002  -7.010  -3.305
   56    HD1  TYR   8           HD1      TYR   8  -4.319  -9.356  -4.106
   57    HD2  TYR   8           HD2      TYR   8  -5.094  -8.249  -0.078
   58    HE1  TYR   8           HE1      TYR   8  -5.659 -11.402  -3.819
   59    HE2  TYR   8           HE2      TYR   8  -6.434 -10.292   0.217
   60    HH   TYR   8           HH       TYR   8  -6.341 -12.885  -1.836
   61    H    LEU   9           H        LEU   9  -1.573  -6.993  -4.460
   62    HA   LEU   9           HA       LEU   9   0.103  -4.727  -3.707
   63   1HB   LEU   9          1HB       LEU   9   1.178  -6.441  -5.033
   64   2HB   LEU   9          2HB       LEU   9  -0.109  -6.392  -6.219
   65    HG   LEU   9           HG       LEU   9   1.373  -3.858  -5.814
   66   1HD1  LEU   9          1HD1      LEU   9   2.594  -6.251  -7.183
   67   2HD1  LEU   9          2HD1      LEU   9   3.180  -5.492  -5.703
   68   3HD1  LEU   9          3HD1      LEU   9   3.225  -4.605  -7.227
   69   1HD2  LEU   9          1HD2      LEU   9  -0.406  -4.074  -7.477
   70   2HD2  LEU   9          2HD2      LEU   9   0.463  -5.405  -8.243
   71   3HD2  LEU   9          3HD2      LEU   9   1.152  -3.781  -8.250
   72    H    VAL  10           H        VAL  10  -0.114  -2.769  -4.673
   73    HA   VAL  10           HA       VAL  10  -2.686  -2.146  -5.974
   74    HB   VAL  10           HB       VAL  10  -1.237  -0.485  -3.906
   75   1HG1  VAL  10          1HG1      VAL  10  -2.491   0.854  -5.479
   76   2HG1  VAL  10          2HG1      VAL  10  -3.272   0.870  -3.897
   77   3HG1  VAL  10          3HG1      VAL  10  -3.931  -0.125  -5.195
   78   1HG2  VAL  10          1HG2      VAL  10  -3.729  -2.142  -3.600
   79   2HG2  VAL  10          2HG2      VAL  10  -3.080  -1.030  -2.395
   80   3HG2  VAL  10          3HG2      VAL  10  -2.160  -2.461  -2.863
   81    H    VAL  11           H        VAL  11  -2.605  -0.534  -7.546
   82    HA   VAL  11           HA       VAL  11  -0.026   0.794  -8.054
   83    HB   VAL  11           HB       VAL  11  -1.687  -0.243 -10.341
   84   1HG1  VAL  11          1HG1      VAL  11   0.410  -0.053 -11.581
   85   2HG1  VAL  11          2HG1      VAL  11   1.223   0.501 -10.118
   86   3HG1  VAL  11          3HG1      VAL  11  -0.053   1.480 -10.841
   87   1HG2  VAL  11          1HG2      VAL  11  -0.190  -2.176 -10.537
   88   2HG2  VAL  11          2HG2      VAL  11  -1.138  -2.217  -9.051
   89   3HG2  VAL  11          3HG2      VAL  11   0.559  -1.738  -9.001
   90    H    LYS  12           H        LYS  12  -0.259   2.763  -9.357
   91    HA   LYS  12           HA       LYS  12  -2.976   3.503 -10.108
   92   1HB   LYS  12          1HB       LYS  12  -2.452   4.595  -7.893
   93   2HB   LYS  12          2HB       LYS  12  -1.179   5.490  -8.714
   94   1HG   LYS  12          1HG       LYS  12  -3.271   6.778  -8.470
   95   2HG   LYS  12          2HG       LYS  12  -2.787   6.557 -10.155
   96   1HD   LYS  12          1HD       LYS  12  -4.403   4.815 -10.459
   97   2HD   LYS  12          2HD       LYS  12  -4.785   4.801  -8.736
   98   1HE   LYS  12          1HE       LYS  12  -5.646   7.095  -8.929
   99   2HE   LYS  12          2HE       LYS  12  -5.305   7.063 -10.659
  100   1HZ   LYS  12          1HZ       LYS  12  -7.655   6.556 -10.024
  101   2HZ   LYS  12          2HZ       LYS  12  -7.105   5.110  -9.320
  102   3HZ   LYS  12          3HZ       LYS  12  -6.914   5.376 -10.987
  103    H    GLY  13           H        GLY  13   0.116   5.309 -10.087
  104   1HA   GLY  13          1HA       GLY  13   1.463   4.894 -12.216
  105   2HA   GLY  13          2HA       GLY  13  -0.032   5.301 -13.042
  106    H    THR  14           H        THR  14  -0.081   7.243 -10.436
  107    HA   THR  14           HA       THR  14   1.751   9.277 -11.291
  108    HB   THR  14           HB       THR  14  -1.195   9.860 -11.682
  109    HG1  THR  14           HG1      THR  14   0.708   8.820 -13.388
  110   1HG2  THR  14          1HG2      THR  14  -0.377  11.946 -12.698
  111   2HG2  THR  14          2HG2      THR  14   1.277  11.484 -12.293
  112   3HG2  THR  14          3HG2      THR  14   0.112  11.806 -11.008
  113    H    THR  15           H        THR  15  -1.462   9.139  -9.735
  114    HA   THR  15           HA       THR  15  -0.434  10.821  -7.584
  115    HB   THR  15           HB       THR  15  -3.285   9.922  -8.003
  116    HG1  THR  15           HG1      THR  15  -2.265  12.437  -8.834
  117   1HG2  THR  15          1HG2      THR  15  -2.799  10.830  -5.790
  118   2HG2  THR  15          2HG2      THR  15  -3.809  11.948  -6.706
  119   3HG2  THR  15          3HG2      THR  15  -2.084  12.267  -6.521
  120    H    THR  16           H        THR  16   0.528   9.681  -6.011
  121    HA   THR  16           HA       THR  16  -0.349   7.090  -5.205
  122    HB   THR  16           HB       THR  16   1.979   7.606  -4.933
  123    HG1  THR  16           HG1      THR  16   0.935   6.301  -3.278
  124   1HG2  THR  16          1HG2      THR  16   1.846  10.026  -4.675
  125   2HG2  THR  16          2HG2      THR  16   2.804   9.311  -3.378
  126   3HG2  THR  16          3HG2      THR  16   1.146   9.828  -3.068
  127    H    GLU  17           H        GLU  17  -2.531   7.429  -4.828
  128    HA   GLU  17           HA       GLU  17  -3.245   8.119  -2.149
  129   1HB   GLU  17          1HB       GLU  17  -3.079  10.364  -3.369
  130   2HB   GLU  17          2HB       GLU  17  -4.448   9.836  -4.332
  131   1HG   GLU  17          1HG       GLU  17  -4.511  10.047  -1.334
  132   2HG   GLU  17          2HG       GLU  17  -4.982  11.354  -2.417
  133    H    ARG  18           H        ARG  18  -4.970   8.275  -5.265
  134    HA   ARG  18           HA       ARG  18  -6.988   6.462  -4.412
  135   1HB   ARG  18          1HB       ARG  18  -6.265   7.570  -7.125
  136   2HB   ARG  18          2HB       ARG  18  -7.590   6.434  -6.889
  137   1HG   ARG  18          1HG       ARG  18  -7.346   9.117  -5.541
  138   2HG   ARG  18          2HG       ARG  18  -8.343   8.772  -6.956
  139   1HD   ARG  18          1HD       ARG  18  -8.679   7.111  -4.502
  140   2HD   ARG  18          2HD       ARG  18  -9.376   8.728  -4.540
  141    HE   ARG  18           HE       ARG  18 -10.811   8.048  -6.288
  142   1HH1  ARG  18          1HH1      ARG  18  -8.873   5.405  -5.039
  143   2HH1  ARG  18          2HH1      ARG  18  -9.910   4.173  -5.679
  144   1HH2  ARG  18          1HH2      ARG  18 -12.181   6.428  -7.110
  145   2HH2  ARG  18          2HH2      ARG  18 -11.800   4.752  -6.853
  146    H    HIS  19           H        HIS  19  -6.367   4.526  -3.864
  147    HA   HIS  19           HA       HIS  19  -4.196   3.226  -5.270
  148   1HB   HIS  19          1HB       HIS  19  -4.459   1.540  -3.354
  149   2HB   HIS  19          2HB       HIS  19  -3.895   3.153  -2.944
  150    HD1  HIS  19           HD1      HIS  19  -5.636   4.729  -1.715
  151    HD2  HIS  19           HD2      HIS  19  -6.805   0.756  -2.137
  152    HE1  HIS  19           HE1      HIS  19  -7.540   4.402  -0.101
  153    HE2  HIS  19           HE2      HIS  19  -8.072   1.938  -0.219
  154    H    ASP  20           H        ASP  20  -4.870   2.324  -7.128
  155    HA   ASP  20           HA       ASP  20  -7.234   0.553  -7.020
  156   1HB   ASP  20          1HB       ASP  20  -6.084   2.123  -9.340
  157   2HB   ASP  20          2HB       ASP  20  -7.346   0.907  -9.511
  158    H    GLN  21           H        GLN  21  -6.901  -0.899  -9.267
  159    HA   GLN  21           HA       GLN  21  -5.849  -2.701 -10.172
  160   1HB   GLN  21          1HB       GLN  21  -3.411  -0.953  -9.784
  161   2HB   GLN  21          2HB       GLN  21  -3.517  -2.341 -10.859
  162   1HG   GLN  21          1HG       GLN  21  -5.028  -1.247 -12.293
  163   2HG   GLN  21          2HG       GLN  21  -5.337   0.030 -11.118
  164   1HE2  GLN  21          1HE2      GLN  21  -3.830   1.667 -10.846
  165   2HE2  GLN  21          2HE2      GLN  21  -2.579   1.970 -12.002
  166    H    HIS  22           H        HIS  22  -6.203  -4.246  -8.533
  167    HA   HIS  22           HA       HIS  22  -3.966  -4.588  -6.644
  168   1HB   HIS  22          1HB       HIS  22  -6.885  -5.235  -6.187
  169   2HB   HIS  22          2HB       HIS  22  -5.583  -5.584  -5.057
  170    HD1  HIS  22           HD1      HIS  22  -7.891  -3.816  -4.147
  171    HD2  HIS  22           HD2      HIS  22  -4.423  -2.327  -5.880
  172    HE1  HIS  22           HE1      HIS  22  -7.733  -1.427  -3.395
  173    HE2  HIS  22           HE2      HIS  22  -5.792  -0.486  -4.685
  174    H    ALA  23           H        ALA  23  -3.409  -6.695  -6.025
  175    HA   ALA  23           HA       ALA  23  -4.762  -9.105  -6.939
  176   1HB   ALA  23          1HB       ALA  23  -3.654  -8.515  -9.045
  177   2HB   ALA  23          2HB       ALA  23  -3.028 -10.004  -8.340
  178   3HB   ALA  23          3HB       ALA  23  -2.098  -8.510  -8.213
  179    H    GLU  24           H        GLU  24  -3.124 -10.999  -6.491
  180    HA   GLU  24           HA       GLU  24  -2.272 -10.406  -3.745
  181   1HB   GLU  24          1HB       GLU  24  -3.785 -12.252  -3.913
  182   2HB   GLU  24          2HB       GLU  24  -2.787 -13.025  -5.136
  183   1HG   GLU  24          1HG       GLU  24  -0.991 -13.255  -3.431
  184   2HG   GLU  24          2HG       GLU  24  -2.125 -12.638  -2.230
  185    H    ILE  25           H        ILE  25  -0.275 -10.222  -3.160
  186    HA   ILE  25           HA       ILE  25   1.876 -11.085  -4.915
  187    HB   ILE  25           HB       ILE  25   2.291  -9.918  -2.173
  188   1HG1  ILE  25          1HG1      ILE  25   1.845  -8.316  -4.703
  189   2HG1  ILE  25          2HG1      ILE  25   0.673  -8.462  -3.398
  190   1HG2  ILE  25          1HG2      ILE  25   4.330  -9.047  -3.222
  191   2HG2  ILE  25          2HG2      ILE  25   3.849  -9.778  -4.753
  192   3HG2  ILE  25          3HG2      ILE  25   4.223 -10.801  -3.365
  193   1HD1  ILE  25          1HD1      ILE  25   1.869  -6.369  -3.237
  194   2HD1  ILE  25          2HD1      ILE  25   3.410  -7.228  -3.201
  195   3HD1  ILE  25          3HD1      ILE  25   2.270  -7.405  -1.866
  196    H    ILE  26           H        ILE  26   2.191 -13.199  -4.849
  197    HA   ILE  26           HA       ILE  26   2.366 -14.525  -2.235
  198    HB   ILE  26           HB       ILE  26   2.382 -16.622  -3.911
  199   1HG1  ILE  26          1HG1      ILE  26   0.462 -16.142  -5.555
  200   2HG1  ILE  26          2HG1      ILE  26   0.855 -14.442  -5.331
  201   1HG2  ILE  26          1HG2      ILE  26   0.012 -16.891  -3.379
  202   2HG2  ILE  26          2HG2      ILE  26  -0.065 -15.198  -2.892
  203   3HG2  ILE  26          3HG2      ILE  26   0.941 -16.331  -1.990
  204   1HD1  ILE  26          1HD1      ILE  26   3.111 -14.859  -6.159
  205   2HD1  ILE  26          2HD1      ILE  26   1.882 -15.326  -7.336
  206   3HD1  ILE  26          3HD1      ILE  26   2.710 -16.560  -6.387
  207    H    GLU  27           H        GLU  27   4.107 -13.766  -5.147
  208    HA   GLU  27           HA       GLU  27   6.485 -14.956  -3.893
  209   1HB   GLU  27          1HB       GLU  27   5.865 -14.601  -6.825
  210   2HB   GLU  27          2HB       GLU  27   7.472 -14.971  -6.219
  211   1HG   GLU  27          1HG       GLU  27   6.550 -17.035  -5.197
  212   2HG   GLU  27          2HG       GLU  27   5.007 -16.675  -5.973
  213    H    VAL  28           H        VAL  28   7.318 -13.313  -2.808
  214    HA   VAL  28           HA       VAL  28   7.634 -10.725  -4.128
  215    HB   VAL  28           HB       VAL  28   8.278 -11.434  -1.263
  216   1HG1  VAL  28          1HG1      VAL  28   8.224  -9.004  -0.922
  217   2HG1  VAL  28          2HG1      VAL  28   7.939  -8.775  -2.648
  218   3HG1  VAL  28          3HG1      VAL  28   9.460  -9.472  -2.091
  219   1HG2  VAL  28          1HG2      VAL  28   6.164 -10.348  -0.688
  220   2HG2  VAL  28          2HG2      VAL  28   5.905 -11.763  -1.710
  221   3HG2  VAL  28          3HG2      VAL  28   5.806 -10.144  -2.403
  222    H    ARG  29           H        ARG  29   9.425 -10.734  -5.389
  223    HA   ARG  29           HA       ARG  29  11.687 -12.399  -4.635
  224   1HB   ARG  29          1HB       ARG  29  10.549 -12.049  -7.015
  225   2HB   ARG  29          2HB       ARG  29  11.711 -10.730  -7.102
  226   1HG   ARG  29          1HG       ARG  29  13.545 -12.217  -6.865
  227   2HG   ARG  29          2HG       ARG  29  12.479 -13.562  -6.451
  228   1HD   ARG  29          1HD       ARG  29  11.443 -13.227  -8.758
  229   2HD   ARG  29          2HD       ARG  29  12.842 -12.212  -9.110
  230    HE   ARG  29           HE       ARG  29  14.150 -14.311  -8.395
  231   1HH1  ARG  29          1HH1      ARG  29  11.071 -14.337 -10.055
  232   2HH1  ARG  29          2HH1      ARG  29  11.334 -15.875 -10.801
  233   1HH2  ARG  29          1HH2      ARG  29  14.509 -16.345  -9.371
  234   2HH2  ARG  29          2HH2      ARG  29  13.304 -17.023 -10.423
  235    H    SER  30           H        SER  30  11.167 -10.119  -3.034
  236    HA   SER  30           HA       SER  30  13.786  -8.929  -3.084
  237   1HB   SER  30          1HB       SER  30  11.330  -7.166  -3.352
  238   2HB   SER  30          2HB       SER  30  12.979  -6.598  -3.088
  239    HG   SER  30           HG       SER  30  13.021  -8.230  -5.172
  240    H    ALA  31           H        ALA  31  14.415  -8.286  -1.043
  241    HA   ALA  31           HA       ALA  31  12.959  -9.271   1.169
  242   1HB   ALA  31          1HB       ALA  31  15.238  -7.293   1.135
  243   2HB   ALA  31          2HB       ALA  31  15.393  -9.050   1.182
  244   3HB   ALA  31          3HB       ALA  31  14.668  -8.191   2.542
  245    H    ASP  32           H        ASP  32  13.420  -6.007  -0.108
  246    HA   ASP  32           HA       ASP  32  11.546  -4.928   1.862
  247   1HB   ASP  32          1HB       ASP  32  13.088  -3.488  -0.312
  248   2HB   ASP  32          2HB       ASP  32  12.164  -2.732   0.981
  249    H    GLY  33           H        GLY  33  11.958  -4.120  -1.557
  250   1HA   GLY  33          1HA       GLY  33   9.625  -5.199  -2.588
  251   2HA   GLY  33          2HA       GLY  33   9.188  -3.632  -1.922
  252    H    SER  34           H        SER  34  10.440  -5.273  -4.577
  253    HA   SER  34           HA       SER  34  10.575  -2.820  -6.066
  254   1HB   SER  34          1HB       SER  34  12.865  -3.419  -7.015
  255   2HB   SER  34          2HB       SER  34  12.854  -2.796  -5.366
  256    HG   SER  34           HG       SER  34  12.599  -5.528  -5.510
  257    HA   PRO  35           HA       PRO  35   8.727  -5.537  -9.049
  258   1HB   PRO  35          1HB       PRO  35   9.883  -3.657 -11.036
  259   2HB   PRO  35          2HB       PRO  35   8.205  -4.157 -10.803
  260   1HG   PRO  35          1HG       PRO  35   9.017  -1.729 -10.068
  261   2HG   PRO  35          2HG       PRO  35   7.850  -2.637  -9.088
  262   1HD   PRO  35          1HD       PRO  35  10.780  -2.213  -8.643
  263   2HD   PRO  35          2HD       PRO  35   9.451  -2.222  -7.464
  264    HA   PRO  36           HA       PRO  36   8.298  -6.420 -11.015
  265   1HB   PRO  36          1HB       PRO  36   8.221  -8.919 -11.958
  266   2HB   PRO  36          2HB       PRO  36   8.928  -7.599 -12.900
  267   1HG   PRO  36          1HG       PRO  36  10.284  -9.731 -11.306
  268   2HG   PRO  36          2HG       PRO  36  10.737  -9.042 -12.875
  269   1HD   PRO  36          1HD       PRO  36  11.845  -8.319 -10.437
  270   2HD   PRO  36          2HD       PRO  36  11.891  -7.335 -11.911
  271    H    TYR  37           H        TYR  37   6.504  -7.799 -10.359
  272    HA   TYR  37           HA       TYR  37   7.017  -9.291  -7.857
  273   1HB   TYR  37          1HB       TYR  37   4.648  -7.559  -8.600
  274   2HB   TYR  37          2HB       TYR  37   4.702  -8.612  -7.190
  275    HD1  TYR  37           HD1      TYR  37   5.849  -5.467  -8.644
  276    HD2  TYR  37           HD2      TYR  37   6.146  -8.069  -5.289
  277    HE1  TYR  37           HE1      TYR  37   6.857  -3.649  -7.330
  278    HE2  TYR  37           HE2      TYR  37   7.154  -6.257  -3.970
  279    HH   TYR  37           HH       TYR  37   7.145  -3.014  -4.990
  280    H    VAL  38           H        VAL  38   5.969 -11.270  -7.646
  281    HA   VAL  38           HA       VAL  38   4.570 -12.175 -10.060
  282    HB   VAL  38           HB       VAL  38   5.563 -13.825  -7.725
  283   1HG1  VAL  38          1HG1      VAL  38   5.092 -15.747  -9.181
  284   2HG1  VAL  38          2HG1      VAL  38   4.412 -14.657 -10.390
  285   3HG1  VAL  38          3HG1      VAL  38   3.632 -14.828  -8.818
  286   1HG2  VAL  38          1HG2      VAL  38   7.282 -14.619  -9.292
  287   2HG2  VAL  38          2HG2      VAL  38   7.409 -12.883  -9.008
  288   3HG2  VAL  38          3HG2      VAL  38   6.693 -13.482 -10.505
  289    H    VAL  39           H        VAL  39   2.478 -12.062 -10.058
  290    HA   VAL  39           HA       VAL  39   1.107 -11.748  -7.481
  291    HB   VAL  39           HB       VAL  39   1.725  -9.722  -9.312
  292   1HG1  VAL  39          1HG1      VAL  39  -0.062 -10.386 -10.787
  293   2HG1  VAL  39          2HG1      VAL  39  -0.457  -8.850 -10.015
  294   3HG1  VAL  39          3HG1      VAL  39  -1.217 -10.341  -9.456
  295   1HG2  VAL  39          1HG2      VAL  39   1.461  -9.428  -6.934
  296   2HG2  VAL  39          2HG2      VAL  39  -0.270  -9.743  -7.057
  297   3HG2  VAL  39          3HG2      VAL  39   0.420  -8.300  -7.803
  298    H    ARG  40           H        ARG  40  -1.068 -12.292  -7.450
  299    HA   ARG  40           HA       ARG  40  -1.924 -13.990  -9.700
  300   1HB   ARG  40          1HB       ARG  40  -1.433 -15.070  -7.443
  301   2HB   ARG  40          2HB       ARG  40  -2.834 -14.205  -6.829
  302   1HG   ARG  40          1HG       ARG  40  -4.141 -15.336  -8.695
  303   2HG   ARG  40          2HG       ARG  40  -2.737 -16.386  -8.882
  304   1HD   ARG  40          1HD       ARG  40  -4.551 -16.086  -6.513
  305   2HD   ARG  40          2HD       ARG  40  -4.194 -17.538  -7.443
  306    HE   ARG  40           HE       ARG  40  -2.539 -16.322  -5.360
  307   1HH1  ARG  40          1HH1      ARG  40  -2.882 -18.777  -7.833
  308   2HH1  ARG  40          2HH1      ARG  40  -1.664 -19.818  -7.166
  309   1HH2  ARG  40          1HH2      ARG  40  -0.955 -17.698  -4.459
  310   2HH2  ARG  40          2HH2      ARG  40  -0.594 -19.224  -5.214
  311    H    TRP  41           H        TRP  41  -3.560 -13.099 -10.833
  312    HA   TRP  41           HA       TRP  41  -5.465 -11.304  -9.579
  313   1HB   TRP  41          1HB       TRP  41  -5.939 -12.621 -12.243
  314   2HB   TRP  41          2HB       TRP  41  -6.443 -11.030 -11.697
  315    HD1  TRP  41           HD1      TRP  41  -3.863 -12.747 -13.724
  316    HE1  TRP  41           HE1      TRP  41  -2.083 -11.072 -14.518
  317    HE3  TRP  41           HE3      TRP  41  -5.098  -8.785 -10.742
  318    HZ2  TRP  41           HZ2      TRP  41  -1.297  -8.427 -13.948
  319    HZ3  TRP  41           HZ3      TRP  41  -3.779  -6.717 -10.930
  320    HH2  TRP  41           HH2      TRP  41  -1.916  -6.542 -12.500
  321    H    LEU  42           H        LEU  42  -6.188 -12.745  -7.900
  322    HA   LEU  42           HA       LEU  42  -6.867 -15.458  -8.632
  323   1HB   LEU  42          1HB       LEU  42  -7.547 -15.634  -6.197
  324   2HB   LEU  42          2HB       LEU  42  -5.858 -15.343  -6.557
  325    HG   LEU  42           HG       LEU  42  -7.508 -12.935  -6.047
  326   1HD1  LEU  42          1HD1      LEU  42  -6.696 -14.873  -3.868
  327   2HD1  LEU  42          2HD1      LEU  42  -8.352 -14.498  -4.347
  328   3HD1  LEU  42          3HD1      LEU  42  -7.342 -13.250  -3.617
  329   1HD2  LEU  42          1HD2      LEU  42  -4.794 -13.867  -5.154
  330   2HD2  LEU  42          2HD2      LEU  42  -5.483 -12.263  -4.895
  331   3HD2  LEU  42          3HD2      LEU  42  -5.134 -12.821  -6.532
  332    H    VAL  43           H        VAL  43  -8.735 -12.546  -7.857
  333    HA   VAL  43           HA       VAL  43 -11.178 -14.040  -7.717
  334    HB   VAL  43           HB       VAL  43 -12.131 -11.608  -8.036
  335   1HG1  VAL  43          1HG1      VAL  43 -10.724 -12.569  -5.557
  336   2HG1  VAL  43          2HG1      VAL  43 -12.379 -12.949  -6.032
  337   3HG1  VAL  43          3HG1      VAL  43 -11.943 -11.296  -5.599
  338   1HG2  VAL  43          1HG2      VAL  43 -10.010 -10.562  -8.617
  339   2HG2  VAL  43          2HG2      VAL  43  -9.331 -11.085  -7.075
  340   3HG2  VAL  43          3HG2      VAL  43 -10.645  -9.908  -7.106
  341    H    ASN  44           H        ASN  44  -9.211 -12.995 -10.234
  342    HA   ASN  44           HA       ASN  44 -11.411 -13.244 -12.153
  343   1HB   ASN  44          1HB       ASN  44  -8.613 -12.201 -12.373
  344   2HB   ASN  44          2HB       ASN  44  -9.447 -12.768 -13.818
  345   1HD2  ASN  44          1HD2      ASN  44 -11.120 -11.275 -11.139
  346   2HD2  ASN  44          2HD2      ASN  44 -11.526  -9.813 -11.963
  347    H    GLY  45           H        GLY  45  -8.503 -14.820 -11.029
  348   1HA   GLY  45          1HA       GLY  45  -8.412 -17.211 -10.990
  349   2HA   GLY  45          2HA       GLY  45  -9.383 -17.238 -12.453
  350    H    HIS  46           H        HIS  46  -6.538 -15.217 -11.879
  351    HA   HIS  46           HA       HIS  46  -5.020 -16.875 -13.769
  352   1HB   HIS  46          1HB       HIS  46  -5.417 -13.883 -14.021
  353   2HB   HIS  46          2HB       HIS  46  -4.216 -14.799 -14.923
  354    HD1  HIS  46           HD1      HIS  46  -5.004 -16.034 -17.002
  355    HD2  HIS  46           HD2      HIS  46  -8.121 -14.413 -14.770
  356    HE1  HIS  46           HE1      HIS  46  -7.071 -16.299 -18.416
  357    HE2  HIS  46           HE2      HIS  46  -8.954 -15.352 -17.025
  358    H    GLU  47           H        GLU  47  -2.682 -16.128 -13.856
  359    HA   GLU  47           HA       GLU  47  -1.680 -14.785 -11.485
  360   1HB   GLU  47          1HB       GLU  47  -2.090 -17.128 -10.736
  361   2HB   GLU  47          2HB       GLU  47  -1.048 -17.704 -12.024
  362   1HG   GLU  47          1HG       GLU  47   0.007 -15.798  -9.983
  363   2HG   GLU  47          2HG       GLU  47  -0.142 -17.513  -9.610
  364    H    THR  48           H        THR  48   0.446 -13.983 -11.845
  365    HA   THR  48           HA       THR  48   2.110 -14.807 -13.972
  366    HB   THR  48           HB       THR  48   0.251 -13.936 -15.335
  367    HG1  THR  48           HG1      THR  48   1.566 -13.013 -16.780
  368   1HG2  THR  48          1HG2      THR  48  -0.549 -12.169 -13.852
  369   2HG2  THR  48          2HG2      THR  48  -0.175 -11.529 -15.452
  370   3HG2  THR  48          3HG2      THR  48   0.948 -11.275 -14.116
  371    H    THR  49           H        THR  49   3.533 -12.856 -14.658
  372    HA   THR  49           HA       THR  49   4.489 -11.625 -12.162
  373    HB   THR  49           HB       THR  49   5.935 -11.773 -14.816
  374    HG1  THR  49           HG1      THR  49   5.510 -13.686 -12.868
  375   1HG2  THR  49          1HG2      THR  49   7.934 -11.395 -13.443
  376   2HG2  THR  49          2HG2      THR  49   6.922 -11.289 -12.001
  377   3HG2  THR  49          3HG2      THR  49   6.779 -10.073 -13.271
  378    H    VAL  50           H        VAL  50   3.711  -9.632 -11.832
  379    HA   VAL  50           HA       VAL  50   2.885  -8.061 -14.166
  380    HB   VAL  50           HB       VAL  50   1.206  -8.549 -12.389
  381   1HG1  VAL  50          1HG1      VAL  50   1.300  -7.298 -10.286
  382   2HG1  VAL  50          2HG1      VAL  50   2.907  -6.712 -10.714
  383   3HG1  VAL  50          3HG1      VAL  50   2.642  -8.433 -10.435
  384   1HG2  VAL  50          1HG2      VAL  50   0.308  -6.264 -12.266
  385   2HG2  VAL  50          2HG2      VAL  50   0.878  -6.676 -13.883
  386   3HG2  VAL  50          3HG2      VAL  50   1.856  -5.643 -12.840
  387    H    TYR  51           H        TYR  51   3.468  -5.952 -14.436
  388    HA   TYR  51           HA       TYR  51   5.627  -4.933 -12.714
  389   1HB   TYR  51          1HB       TYR  51   5.178  -4.149 -15.600
  390   2HB   TYR  51          2HB       TYR  51   6.594  -3.832 -14.605
  391    HD1  TYR  51           HD1      TYR  51   8.126  -5.732 -14.012
  392    HD2  TYR  51           HD2      TYR  51   4.960  -6.166 -16.822
  393    HE1  TYR  51           HE1      TYR  51   9.182  -7.778 -14.881
  394    HE2  TYR  51           HE2      TYR  51   6.005  -8.212 -17.693
  395    HH   TYR  51           HH       TYR  51   8.333  -9.183 -17.797
  396    HA   PRO  52           HA       PRO  52   2.101  -2.162 -12.048
  397   1HB   PRO  52          1HB       PRO  52   3.455  -1.337  -9.616
  398   2HB   PRO  52          2HB       PRO  52   1.968  -2.269  -9.789
  399   1HG   PRO  52          1HG       PRO  52   4.312  -3.297  -8.823
  400   2HG   PRO  52          2HG       PRO  52   3.053  -4.267  -9.604
  401   1HD   PRO  52          1HD       PRO  52   5.633  -3.248 -10.716
  402   2HD   PRO  52          2HD       PRO  52   4.814  -4.798 -11.002
  403    H    GLY  53           H        GLY  53   5.457  -1.221 -11.278
  404   1HA   GLY  53          1HA       GLY  53   6.566   0.611 -12.313
  405   2HA   GLY  53          2HA       GLY  53   4.996   1.309 -12.687
  406    H    SER  54           H        SER  54   3.914   2.518 -11.127
  407    HA   SER  54           HA       SER  54   5.511   3.184  -8.750
  408   1HB   SER  54          1HB       SER  54   4.012   5.162 -10.481
  409   2HB   SER  54          2HB       SER  54   5.023   5.538  -9.085
  410    HG   SER  54           HG       SER  54   6.784   4.532 -10.311
  411    H    ASP  55           H        ASP  55   4.227   4.426  -7.119
  412    HA   ASP  55           HA       ASP  55   2.506   4.673  -5.669
  413   1HB   ASP  55          1HB       ASP  55   0.745   3.974  -8.025
  414   2HB   ASP  55          2HB       ASP  55   0.184   4.626  -6.490
  415    H    ALA  56           H        ALA  56   3.780   2.041  -6.269
  416    HA   ALA  56           HA       ALA  56   1.763   0.055  -5.892
  417   1HB   ALA  56          1HB       ALA  56   3.842  -0.418  -7.104
  418   2HB   ALA  56          2HB       ALA  56   3.603  -1.518  -5.746
  419   3HB   ALA  56          3HB       ALA  56   4.755  -0.189  -5.612
  420    H    VAL  57           H        VAL  57   0.896  -0.624  -4.073
  421    HA   VAL  57           HA       VAL  57   2.429  -0.562  -1.590
  422    HB   VAL  57           HB       VAL  57   1.130   1.589  -1.736
  423   1HG1  VAL  57          1HG1      VAL  57  -1.219  -0.201  -1.263
  424   2HG1  VAL  57          2HG1      VAL  57  -0.928   0.794  -2.691
  425   3HG1  VAL  57          3HG1      VAL  57  -1.230   1.557  -1.130
  426   1HG2  VAL  57          1HG2      VAL  57   0.646  -0.192   0.616
  427   2HG2  VAL  57          2HG2      VAL  57   0.448   1.561   0.613
  428   3HG2  VAL  57          3HG2      VAL  57   2.041   0.853   0.347
  429    H    VAL  58           H        VAL  58   0.819  -1.383   0.171
  430    HA   VAL  58           HA       VAL  58  -0.135  -3.957  -0.857
  431    HB   VAL  58           HB       VAL  58   0.262  -4.540   1.668
  432   1HG1  VAL  58          1HG1      VAL  58   2.519  -5.310   1.095
  433   2HG1  VAL  58          2HG1      VAL  58   2.500  -4.262  -0.325
  434   3HG1  VAL  58          3HG1      VAL  58   1.379  -5.618  -0.215
  435   1HG2  VAL  58          1HG2      VAL  58   2.214  -3.392   2.592
  436   2HG2  VAL  58          2HG2      VAL  58   0.842  -2.301   2.388
  437   3HG2  VAL  58          3HG2      VAL  58   2.175  -2.268   1.232
  438    H    VAL  59           H        VAL  59  -2.228  -4.423  -0.648
  439    HA   VAL  59           HA       VAL  59  -3.781  -3.211   1.509
  440    HB   VAL  59           HB       VAL  59  -5.690  -3.895  -0.034
  441   1HG1  VAL  59          1HG1      VAL  59  -5.622  -1.751  -1.226
  442   2HG1  VAL  59          2HG1      VAL  59  -3.930  -1.578  -0.761
  443   3HG1  VAL  59          3HG1      VAL  59  -5.189  -1.585   0.475
  444   1HG2  VAL  59          1HG2      VAL  59  -5.195  -3.822  -2.429
  445   2HG2  VAL  59          2HG2      VAL  59  -4.462  -5.206  -1.616
  446   3HG2  VAL  59          3HG2      VAL  59  -3.475  -3.806  -2.038
  447    H    THR  60           H        THR  60  -5.823  -4.645   1.798
  448    HA   THR  60           HA       THR  60  -4.891  -7.433   2.194
  449    HB   THR  60           HB       THR  60  -6.777  -7.413   3.964
  450    HG1  THR  60           HG1      THR  60  -6.463  -4.606   3.549
  451   1HG2  THR  60          1HG2      THR  60  -4.414  -7.409   4.537
  452   2HG2  THR  60          2HG2      THR  60  -5.328  -6.379   5.639
  453   3HG2  THR  60          3HG2      THR  60  -4.365  -5.656   4.350
  454    H    ALA  61           H        ALA  61  -7.234  -8.660   2.764
  455    HA   ALA  61           HA       ALA  61  -7.993  -9.628   0.342
  456   1HB   ALA  61          1HB       ALA  61  -8.321 -10.762   2.477
  457   2HB   ALA  61          2HB       ALA  61  -9.775 -10.784   1.480
  458   3HB   ALA  61          3HB       ALA  61  -9.658  -9.670   2.843
  459    H    THR  62           H        THR  62  -9.905  -7.211   2.208
  460    HA   THR  62           HA       THR  62 -12.109  -7.491   0.426
  461    HB   THR  62           HB       THR  62 -12.622  -5.108   1.522
  462    HG1  THR  62           HG1      THR  62 -11.695  -4.988   3.558
  463   1HG2  THR  62          1HG2      THR  62 -12.909  -7.791   2.862
  464   2HG2  THR  62          2HG2      THR  62 -13.995  -7.109   1.651
  465   3HG2  THR  62          3HG2      THR  62 -13.850  -6.347   3.235
  466    H    GLU  63           H        GLU  63  -9.514  -5.116   0.674
  467    HA   GLU  63           HA       GLU  63 -10.451  -3.383  -1.338
  468   1HB   GLU  63          1HB       GLU  63  -7.655  -3.989  -0.371
  469   2HB   GLU  63          2HB       GLU  63  -8.034  -2.700  -1.506
  470   1HG   GLU  63          1HG       GLU  63  -9.219  -2.917   1.246
  471   2HG   GLU  63          2HG       GLU  63  -7.779  -1.973   0.859
  472    H    HIS  64           H        HIS  64  -9.003  -6.476  -1.438
  473    HA   HIS  64           HA       HIS  64  -7.720  -6.284  -3.936
  474   1HB   HIS  64          1HB       HIS  64  -6.853  -8.216  -3.291
  475   2HB   HIS  64          2HB       HIS  64  -7.858  -8.135  -1.856
  476    HD1  HIS  64           HD1      HIS  64  -7.481  -9.891  -5.124
  477    HD2  HIS  64           HD2      HIS  64 -10.052  -9.918  -1.847
  478    HE1  HIS  64           HE1      HIS  64  -8.843 -11.986  -5.332
  479    HE2  HIS  64           HE2      HIS  64 -10.231 -12.089  -3.235
  480    H    ALA  65           H        ALA  65 -10.992  -7.469  -3.098
  481    HA   ALA  65           HA       ALA  65 -11.361  -9.101  -5.303
  482   1HB   ALA  65          1HB       ALA  65 -12.795  -9.066  -3.315
  483   2HB   ALA  65          2HB       ALA  65 -13.735  -8.963  -4.802
  484   3HB   ALA  65          3HB       ALA  65 -13.463  -7.518  -3.829
  485    H    GLU  66           H        GLU  66 -12.836  -5.938  -4.923
  486    HA   GLU  66           HA       GLU  66 -13.828  -5.772  -7.538
  487   1HB   GLU  66          1HB       GLU  66 -13.731  -3.164  -6.712
  488   2HB   GLU  66          2HB       GLU  66 -15.011  -4.300  -6.321
  489   1HG   GLU  66          1HG       GLU  66 -13.950  -4.815  -4.191
  490   2HG   GLU  66          2HG       GLU  66 -12.598  -3.757  -4.587
  491    H    ALA  67           H        ALA  67 -10.998  -4.159  -6.103
  492    HA   ALA  67           HA       ALA  67 -10.371  -2.788  -8.519
  493   1HB   ALA  67          1HB       ALA  67  -8.411  -1.989  -7.367
  494   2HB   ALA  67          2HB       ALA  67  -8.640  -3.186  -6.093
  495   3HB   ALA  67          3HB       ALA  67  -9.819  -1.894  -6.310
  496    H    GLU  68           H        GLU  68  -9.689  -5.950  -7.425
  497    HA   GLU  68           HA       GLU  68  -7.254  -6.318  -8.909
  498   1HB   GLU  68          1HB       GLU  68  -7.858  -7.653  -6.890
  499   2HB   GLU  68          2HB       GLU  68  -9.136  -8.413  -7.825
  500   1HG   GLU  68          1HG       GLU  68  -7.575  -9.478  -9.252
  501   2HG   GLU  68          2HG       GLU  68  -6.237  -8.533  -8.593
  502    H    LYS  69           H        LYS  69 -10.682  -7.172  -9.360
  503    HA   LYS  69           HA       LYS  69 -10.469  -8.271 -11.918
  504   1HB   LYS  69          1HB       LYS  69 -12.595  -8.195 -10.706
  505   2HB   LYS  69          2HB       LYS  69 -12.625  -6.440 -10.833
  506   1HG   LYS  69          1HG       LYS  69 -12.790  -6.612 -13.258
  507   2HG   LYS  69          2HG       LYS  69 -12.761  -8.372 -13.136
  508   1HD   LYS  69          1HD       LYS  69 -14.837  -8.324 -11.860
  509   2HD   LYS  69          2HD       LYS  69 -14.856  -6.561 -11.943
  510   1HE   LYS  69          1HE       LYS  69 -14.965  -8.428 -14.309
  511   2HE   LYS  69          2HE       LYS  69 -16.346  -7.584 -13.609
  512   1HZ   LYS  69          1HZ       LYS  69 -15.465  -6.448 -15.565
  513   2HZ   LYS  69          2HZ       LYS  69 -13.964  -6.269 -14.804
  514   3HZ   LYS  69          3HZ       LYS  69 -15.332  -5.482 -14.176
  515    H    ARG  70           H        ARG  70 -10.831  -4.882 -10.943
  516    HA   ARG  70           HA       ARG  70 -10.585  -3.822 -13.560
  517   1HB   ARG  70          1HB       ARG  70 -11.558  -2.707 -11.481
  518   2HB   ARG  70          2HB       ARG  70  -9.898  -2.351 -11.026
  519   1HG   ARG  70          1HG       ARG  70  -9.723  -0.685 -12.503
  520   2HG   ARG  70          2HG       ARG  70 -10.578  -1.579 -13.763
  521   1HD   ARG  70          1HD       ARG  70 -11.807  -0.104 -11.441
  522   2HD   ARG  70          2HD       ARG  70 -11.869   0.363 -13.141
  523    HE   ARG  70           HE       ARG  70 -12.936  -2.206 -12.942
  524   1HH1  ARG  70          1HH1      ARG  70 -13.691   1.034 -11.864
  525   2HH1  ARG  70          2HH1      ARG  70 -15.410   0.755 -11.800
  526   1HH2  ARG  70          1HH2      ARG  70 -15.180  -2.596 -12.844
  527   2HH2  ARG  70          2HH2      ARG  70 -16.259  -1.317 -12.365
  528    H    ALA  71           H        ALA  71  -8.273  -5.084 -11.392
  529    HA   ALA  71           HA       ALA  71  -6.020  -3.609 -12.428
  530   1HB   ALA  71          1HB       ALA  71  -6.080  -6.102 -10.743
  531   2HB   ALA  71          2HB       ALA  71  -6.013  -4.447 -10.136
  532   3HB   ALA  71          3HB       ALA  71  -4.669  -5.098 -11.072
  533    H    ALA  72           H        ALA  72  -7.360  -6.877 -12.805
  534    HA   ALA  72           HA       ALA  72  -5.442  -7.790 -14.649
  535   1HB   ALA  72          1HB       ALA  72  -8.361  -8.539 -14.450
  536   2HB   ALA  72          2HB       ALA  72  -7.030  -9.302 -13.579
  537   3HB   ALA  72          3HB       ALA  72  -7.125  -9.435 -15.334
  538    H    ALA  73           H        ALA  73  -8.190  -5.684 -14.929
  539    HA   ALA  73           HA       ALA  73  -8.147  -5.591 -17.807
  540   1HB   ALA  73          1HB       ALA  73  -9.756  -3.784 -17.577
  541   2HB   ALA  73          2HB       ALA  73  -9.434  -3.700 -15.846
  542   3HB   ALA  73          3HB       ALA  73 -10.189  -5.138 -16.533
  543    H    ARG  74           H        ARG  74  -7.103  -3.326 -15.246
  544    HA   ARG  74           HA       ARG  74  -6.037  -1.476 -17.194
  545   1HB   ARG  74          1HB       ARG  74  -7.170  -0.733 -15.108
  546   2HB   ARG  74          2HB       ARG  74  -5.837  -1.405 -14.179
  547   1HG   ARG  74          1HG       ARG  74  -5.518   0.952 -14.360
  548   2HG   ARG  74          2HG       ARG  74  -4.305   0.154 -15.361
  549   1HD   ARG  74          1HD       ARG  74  -5.625   0.593 -17.352
  550   2HD   ARG  74          2HD       ARG  74  -6.892   1.328 -16.370
  551    HE   ARG  74           HE       ARG  74  -4.402   2.628 -15.931
  552   1HH1  ARG  74          1HH1      ARG  74  -7.048   2.380 -18.224
  553   2HH1  ARG  74          2HH1      ARG  74  -6.766   3.956 -18.914
  554   1HH2  ARG  74          1HH2      ARG  74  -4.037   4.697 -16.822
  555   2HH2  ARG  74          2HH2      ARG  74  -5.042   5.272 -18.121
  556    H    ALA  75           H        ALA  75  -4.550  -3.080 -14.374
  557    HA   ALA  75           HA       ALA  75  -1.886  -2.362 -15.086
  558   1HB   ALA  75          1HB       ALA  75  -2.567  -2.807 -12.776
  559   2HB   ALA  75          2HB       ALA  75  -1.213  -3.827 -13.265
  560   3HB   ALA  75          3HB       ALA  75  -2.840  -4.502 -13.183
  561    H    GLY  76           H        GLY  76  -3.723  -5.395 -15.316
  562   1HA   GLY  76          1HA       GLY  76  -1.543  -6.884 -16.416
  563   2HA   GLY  76          2HA       GLY  76  -3.216  -7.406 -16.319
  564    H    HIS  77           H        HIS  77  -3.466  -4.550 -17.806
  565    HA   HIS  77           HA       HIS  77  -3.880  -5.648 -20.389
  566   1HB   HIS  77          1HB       HIS  77  -5.058  -3.629 -19.491
  567   2HB   HIS  77          2HB       HIS  77  -3.552  -2.730 -19.650
  568    HD1  HIS  77           HD1      HIS  77  -3.142  -1.627 -21.857
  569    HD2  HIS  77           HD2      HIS  77  -6.095  -4.556 -22.067
  570    HE1  HIS  77           HE1      HIS  77  -4.119  -1.450 -24.168
  571    HE2  HIS  77           HE2      HIS  77  -5.783  -3.335 -24.331
  572    H    ALA  78           H        ALA  78  -1.185  -4.162 -18.785
  573    HA   ALA  78           HA       ALA  78   0.351  -3.632 -21.135
  574   1HB   ALA  78          1HB       ALA  78   1.270  -3.916 -18.275
  575   2HB   ALA  78          2HB       ALA  78   0.732  -2.420 -19.038
  576   3HB   ALA  78          3HB       ALA  78   2.198  -3.221 -19.604
  577    H    ALA  79           H        ALA  79   0.869  -6.009 -18.516
  578    HA   ALA  79           HA       ALA  79   1.688  -7.976 -20.504
  579   1HB   ALA  79          1HB       ALA  79   3.780  -8.466 -19.352
  580   2HB   ALA  79          2HB       ALA  79   3.472  -7.152 -18.216
  581   3HB   ALA  79          3HB       ALA  79   3.748  -6.798 -19.922
  582    H    THR  80           H        THR  80   0.808  -9.860 -20.036
  583    HA   THR  80           HA       THR  80   0.729 -10.820 -17.318
  584    HB   THR  80           HB       THR  80  -1.431  -9.646 -17.479
  585    HG1  THR  80           HG1      THR  80  -1.745 -12.483 -17.536
  586   1HG2  THR  80          1HG2      THR  80  -3.180 -10.443 -19.002
  587   2HG2  THR  80          2HG2      THR  80  -2.020 -11.532 -19.762
  588   3HG2  THR  80          3HG2      THR  80  -1.802  -9.787 -19.885
  Start of MODEL    9
    1    H    MET   1           H        MET   1   9.753   1.203   0.122
    2    HA   MET   1           HA       MET   1   7.368   0.893   0.057
    3   1HB   MET   1          1HB       MET   1   7.408   1.457  -2.498
    4   2HB   MET   1          2HB       MET   1   7.715  -0.260  -2.703
    5   1HG   MET   1          1HG       MET   1   5.358   0.801  -1.177
    6   2HG   MET   1          2HG       MET   1   5.321   0.503  -2.911
    7   1HE   MET   1          1HE       MET   1   6.945  -2.082  -3.359
    8   2HE   MET   1          2HE       MET   1   5.325  -1.854  -4.021
    9   3HE   MET   1          3HE       MET   1   5.726  -3.341  -3.158
   10    H    HIS   2           H        HIS   2   6.721  -1.084   0.887
   11    HA   HIS   2           HA       HIS   2   8.446  -3.405   0.375
   12   1HB   HIS   2          1HB       HIS   2   9.233  -2.133   2.438
   13   2HB   HIS   2          2HB       HIS   2   7.694  -2.551   3.181
   14    HD1  HIS   2           HD1      HIS   2   7.457  -4.919   4.133
   15    HD2  HIS   2           HD2      HIS   2  10.991  -4.333   2.023
   16    HE1  HIS   2           HE1      HIS   2   8.869  -6.944   4.599
   17    HE2  HIS   2           HE2      HIS   2  11.050  -6.515   3.411
   18    H    ALA   3           H        ALA   3   7.358  -5.326   0.408
   19    HA   ALA   3           HA       ALA   3   4.567  -5.322   1.293
   20   1HB   ALA   3          1HB       ALA   3   5.459  -6.188  -1.456
   21   2HB   ALA   3          2HB       ALA   3   4.527  -4.739  -1.080
   22   3HB   ALA   3          3HB       ALA   3   3.826  -6.334  -0.803
   23    H    LYS   4           H        LYS   4   3.650  -7.624   1.013
   24    HA   LYS   4           HA       LYS   4   5.679  -9.661   1.566
   25   1HB   LYS   4          1HB       LYS   4   4.998  -8.738   3.735
   26   2HB   LYS   4          2HB       LYS   4   3.310  -9.023   3.343
   27   1HG   LYS   4          1HG       LYS   4   3.687 -11.418   3.358
   28   2HG   LYS   4          2HG       LYS   4   5.404 -11.162   3.674
   29   1HD   LYS   4          1HD       LYS   4   4.887 -10.136   5.808
   30   2HD   LYS   4          2HD       LYS   4   3.159 -10.278   5.484
   31   1HE   LYS   4          1HE       LYS   4   3.343 -12.701   5.469
   32   2HE   LYS   4          2HE       LYS   4   5.083 -12.588   5.723
   33   1HZ   LYS   4          1HZ       LYS   4   3.833 -13.068   7.767
   34   2HZ   LYS   4          2HZ       LYS   4   3.037 -11.577   7.624
   35   3HZ   LYS   4          3HZ       LYS   4   4.713 -11.621   7.871
   36    H    VAL   5           H        VAL   5   4.922 -11.824   1.266
   37    HA   VAL   5           HA       VAL   5   2.893 -12.177  -0.717
   38    HB   VAL   5           HB       VAL   5   4.456 -14.107   1.031
   39   1HG1  VAL   5          1HG1      VAL   5   3.540 -15.960  -0.270
   40   2HG1  VAL   5          2HG1      VAL   5   2.471 -14.843  -1.118
   41   3HG1  VAL   5          3HG1      VAL   5   2.266 -15.116   0.611
   42   1HG2  VAL   5          1HG2      VAL   5   5.703 -13.025  -0.740
   43   2HG2  VAL   5          2HG2      VAL   5   4.514 -13.568  -1.925
   44   3HG2  VAL   5          3HG2      VAL   5   5.509 -14.747  -1.072
   45    H    GLY   6           H        GLY   6   0.813 -13.031  -0.467
   46   1HA   GLY   6          1HA       GLY   6  -1.110 -13.675   0.739
   47   2HA   GLY   6          2HA       GLY   6  -0.234 -13.393   2.241
   48    H    ASP   7           H        ASP   7   0.098 -11.087  -0.178
   49    HA   ASP   7           HA       ASP   7  -1.993  -9.237   0.962
   50   1HB   ASP   7          1HB       ASP   7   0.998  -8.784   0.806
   51   2HB   ASP   7          2HB       ASP   7  -0.136  -7.441   0.721
   52    H    TYR   8           H        TYR   8  -1.579  -7.136  -0.396
   53    HA   TYR   8           HA       TYR   8  -1.787  -7.983  -3.211
   54   1HB   TYR   8          1HB       TYR   8  -3.827  -6.402  -1.617
   55   2HB   TYR   8          2HB       TYR   8  -3.882  -6.621  -3.355
   56    HD1  TYR   8           HD1      TYR   8  -4.725  -8.636  -4.315
   57    HD2  TYR   8           HD2      TYR   8  -4.355  -8.280  -0.094
   58    HE1  TYR   8           HE1      TYR   8  -6.199 -10.591  -4.035
   59    HE2  TYR   8           HE2      TYR   8  -5.818 -10.244   0.186
   60    HH   TYR   8           HH       TYR   8  -6.517 -12.384  -2.154
   61    H    LEU   9           H        LEU   9  -2.132  -5.975  -4.599
   62    HA   LEU   9           HA       LEU   9  -0.410  -3.805  -3.636
   63   1HB   LEU   9          1HB       LEU   9   1.034  -5.560  -4.562
   64   2HB   LEU   9          2HB       LEU   9   0.101  -5.577  -6.039
   65    HG   LEU   9           HG       LEU   9   1.632  -3.120  -5.185
   66   1HD1  LEU   9          1HD1      LEU   9   3.190  -5.007  -5.240
   67   2HD1  LEU   9          2HD1      LEU   9   3.473  -3.891  -6.577
   68   3HD1  LEU   9          3HD1      LEU   9   2.633  -5.416  -6.861
   69   1HD2  LEU   9          1HD2      LEU   9   1.603  -2.649  -7.580
   70   2HD2  LEU   9          2HD2      LEU   9  -0.037  -2.848  -6.961
   71   3HD2  LEU   9          3HD2      LEU   9   0.725  -4.151  -7.874
   72    H    VAL  10           H        VAL  10  -0.830  -1.881  -4.557
   73    HA   VAL  10           HA       VAL  10  -2.559  -1.734  -6.925
   74    HB   VAL  10           HB       VAL  10  -3.057  -0.080  -4.432
   75   1HG1  VAL  10          1HG1      VAL  10  -5.109   0.601  -5.584
   76   2HG1  VAL  10          2HG1      VAL  10  -4.609  -0.322  -7.002
   77   3HG1  VAL  10          3HG1      VAL  10  -3.661   1.070  -6.475
   78   1HG2  VAL  10          1HG2      VAL  10  -4.646  -2.400  -5.512
   79   2HG2  VAL  10          2HG2      VAL  10  -5.138  -1.347  -4.185
   80   3HG2  VAL  10          3HG2      VAL  10  -3.714  -2.375  -4.014
   81    H    VAL  11           H        VAL  11  -2.386   0.359  -8.026
   82    HA   VAL  11           HA       VAL  11  -0.259   2.129  -7.039
   83    HB   VAL  11           HB       VAL  11   0.661   0.521  -8.771
   84   1HG1  VAL  11          1HG1      VAL  11  -1.112   2.110 -10.613
   85   2HG1  VAL  11          2HG1      VAL  11  -1.289   0.401 -10.217
   86   3HG1  VAL  11          3HG1      VAL  11   0.124   0.957 -11.113
   87   1HG2  VAL  11          1HG2      VAL  11   1.881   2.253  -9.998
   88   2HG2  VAL  11          2HG2      VAL  11   1.766   2.627  -8.278
   89   3HG2  VAL  11          3HG2      VAL  11   0.725   3.460  -9.433
   90    H    LYS  12           H        LYS  12  -0.300   4.255  -8.295
   91    HA   LYS  12           HA       LYS  12  -3.055   5.100  -8.514
   92   1HB   LYS  12          1HB       LYS  12  -1.284   6.412  -7.306
   93   2HB   LYS  12          2HB       LYS  12  -0.564   6.763  -8.869
   94   1HG   LYS  12          1HG       LYS  12  -2.419   8.059  -9.543
   95   2HG   LYS  12          2HG       LYS  12  -3.405   7.475  -8.198
   96   1HD   LYS  12          1HD       LYS  12  -0.903   9.143  -7.918
   97   2HD   LYS  12          2HD       LYS  12  -2.553   9.767  -7.830
   98   1HE   LYS  12          1HE       LYS  12  -3.010   8.440  -5.879
   99   2HE   LYS  12          2HE       LYS  12  -1.457   7.619  -6.017
  100   1HZ   LYS  12          1HZ       LYS  12  -1.561   9.409  -4.315
  101   2HZ   LYS  12          2HZ       LYS  12  -1.719  10.540  -5.564
  102   3HZ   LYS  12          3HZ       LYS  12  -0.317   9.597  -5.445
  103    H    GLY  13           H        GLY  13  -3.366   3.708 -10.438
  104   1HA   GLY  13          1HA       GLY  13  -2.397   4.801 -12.944
  105   2HA   GLY  13          2HA       GLY  13  -3.562   3.494 -12.751
  106    H    THR  14           H        THR  14  -4.847   5.431 -10.735
  107    HA   THR  14           HA       THR  14  -5.835   7.616 -12.290
  108    HB   THR  14           HB       THR  14  -7.308   5.938 -13.220
  109    HG1  THR  14           HG1      THR  14  -8.968   7.223 -12.975
  110   1HG2  THR  14          1HG2      THR  14  -7.080   4.226 -11.482
  111   2HG2  THR  14          2HG2      THR  14  -8.777   4.557 -11.837
  112   3HG2  THR  14          3HG2      THR  14  -8.037   5.217 -10.379
  113    H    THR  15           H        THR  15  -6.439   9.233 -10.936
  114    HA   THR  15           HA       THR  15  -6.204   8.711  -8.086
  115    HB   THR  15           HB       THR  15  -6.582  11.370  -9.477
  116    HG1  THR  15           HG1      THR  15  -4.234  11.490  -9.137
  117   1HG2  THR  15          1HG2      THR  15  -5.604  12.289  -7.423
  118   2HG2  THR  15          2HG2      THR  15  -5.520  10.666  -6.738
  119   3HG2  THR  15          3HG2      THR  15  -7.088  11.397  -7.082
  120    H    THR  16           H        THR  16  -8.603   9.768 -10.434
  121    HA   THR  16           HA       THR  16 -10.506  10.598  -8.478
  122    HB   THR  16           HB       THR  16 -12.067  10.492 -10.554
  123    HG1  THR  16           HG1      THR  16 -10.721  10.667 -12.513
  124   1HG2  THR  16          1HG2      THR  16 -11.172  12.562  -9.588
  125   2HG2  THR  16          2HG2      THR  16 -11.187  12.636 -11.350
  126   3HG2  THR  16          3HG2      THR  16  -9.674  12.339 -10.494
  127    H    GLU  17           H        GLU  17  -9.862   7.621 -10.210
  128    HA   GLU  17           HA       GLU  17 -12.329   6.433  -9.183
  129   1HB   GLU  17          1HB       GLU  17 -11.476   6.150 -11.594
  130   2HB   GLU  17          2HB       GLU  17 -10.283   5.052 -10.915
  131   1HG   GLU  17          1HG       GLU  17 -11.922   3.516 -10.234
  132   2HG   GLU  17          2HG       GLU  17 -13.224   4.685 -10.451
  133    H    ARG  18           H        ARG  18 -10.318   7.204  -7.359
  134    HA   ARG  18           HA       ARG  18  -9.629   6.468  -5.327
  135   1HB   ARG  18          1HB       ARG  18 -11.494   4.817  -5.466
  136   2HB   ARG  18          2HB       ARG  18 -10.384   3.681  -6.215
  137   1HG   ARG  18          1HG       ARG  18 -10.429   3.022  -3.990
  138   2HG   ARG  18          2HG       ARG  18  -8.957   3.986  -4.101
  139   1HD   ARG  18          1HD       ARG  18 -11.623   4.995  -3.110
  140   2HD   ARG  18          2HD       ARG  18 -10.296   4.475  -2.076
  141    HE   ARG  18           HE       ARG  18  -9.002   6.347  -3.038
  142   1HH1  ARG  18          1HH1      ARG  18 -12.503   6.419  -3.204
  143   2HH1  ARG  18          2HH1      ARG  18 -12.581   8.151  -3.333
  144   1HH2  ARG  18          1HH2      ARG  18  -9.116   8.639  -3.184
  145   2HH2  ARG  18          2HH2      ARG  18 -10.669   9.408  -3.318
  146    H    HIS  19           H        HIS  19  -8.790   3.705  -7.403
  147    HA   HIS  19           HA       HIS  19  -6.050   4.338  -7.666
  148   1HB   HIS  19          1HB       HIS  19  -6.815   3.003  -5.194
  149   2HB   HIS  19          2HB       HIS  19  -5.717   2.008  -6.140
  150    HD1  HIS  19           HD1      HIS  19  -5.437   4.105  -3.427
  151    HD2  HIS  19           HD2      HIS  19  -3.529   4.093  -7.125
  152    HE1  HIS  19           HE1      HIS  19  -3.271   5.337  -3.081
  153    HE2  HIS  19           HE2      HIS  19  -2.050   5.166  -5.286
  154    H    ASP  20           H        ASP  20  -4.852   2.354  -8.605
  155    HA   ASP  20           HA       ASP  20  -6.740   0.638 -10.052
  156   1HB   ASP  20          1HB       ASP  20  -6.597   2.578 -11.450
  157   2HB   ASP  20          2HB       ASP  20  -4.847   2.636 -11.295
  158    H    GLN  21           H        GLN  21  -5.536  -0.957 -11.473
  159    HA   GLN  21           HA       GLN  21  -4.194  -2.772 -11.602
  160   1HB   GLN  21          1HB       GLN  21  -2.106  -0.841 -10.583
  161   2HB   GLN  21          2HB       GLN  21  -1.761  -2.435 -11.245
  162   1HG   GLN  21          1HG       GLN  21  -2.747  -1.764 -13.377
  163   2HG   GLN  21          2HG       GLN  21  -3.086  -0.166 -12.717
  164   1HE2  GLN  21          1HE2      GLN  21  -1.839   0.877 -14.224
  165   2HE2  GLN  21          2HE2      GLN  21  -0.107   0.810 -14.227
  166    H    HIS  22           H        HIS  22  -4.767  -4.378 -10.263
  167    HA   HIS  22           HA       HIS  22  -3.755  -4.323  -7.515
  168   1HB   HIS  22          1HB       HIS  22  -6.098  -3.408  -7.567
  169   2HB   HIS  22          2HB       HIS  22  -6.635  -4.982  -8.141
  170    HD1  HIS  22           HD1      HIS  22  -6.939  -3.275  -5.246
  171    HD2  HIS  22           HD2      HIS  22  -5.175  -6.950  -6.040
  172    HE1  HIS  22           HE1      HIS  22  -6.953  -4.517  -3.062
  173    HE2  HIS  22           HE2      HIS  22  -5.870  -6.737  -3.568
  174    H    ALA  23           H        ALA  23  -2.899  -6.135  -6.946
  175    HA   ALA  23           HA       ALA  23  -3.740  -8.737  -8.052
  176   1HB   ALA  23          1HB       ALA  23  -0.879  -7.780  -7.925
  177   2HB   ALA  23          2HB       ALA  23  -1.832  -7.971  -9.396
  178   3HB   ALA  23          3HB       ALA  23  -1.431  -9.381  -8.416
  179    H    GLU  24           H        GLU  24  -2.355 -10.467  -6.867
  180    HA   GLU  24           HA       GLU  24  -1.764  -9.653  -4.094
  181   1HB   GLU  24          1HB       GLU  24  -3.929 -10.827  -3.987
  182   2HB   GLU  24          2HB       GLU  24  -3.250 -12.178  -4.888
  183   1HG   GLU  24          1HG       GLU  24  -1.525 -12.314  -2.976
  184   2HG   GLU  24          2HG       GLU  24  -2.654 -11.306  -2.080
  185    H    ILE  25           H        ILE  25   0.111 -10.220  -3.530
  186    HA   ILE  25           HA       ILE  25   1.745 -11.719  -5.373
  187    HB   ILE  25           HB       ILE  25   3.232 -10.929  -3.082
  188   1HG1  ILE  25          1HG1      ILE  25   1.514  -8.711  -4.231
  189   2HG1  ILE  25          2HG1      ILE  25   1.383  -9.363  -2.600
  190   1HG2  ILE  25          1HG2      ILE  25   3.108  -9.830  -5.886
  191   2HG2  ILE  25          2HG2      ILE  25   4.115 -11.166  -5.326
  192   3HG2  ILE  25          3HG2      ILE  25   4.405  -9.533  -4.729
  193   1HD1  ILE  25          1HD1      ILE  25   3.630  -8.560  -2.102
  194   2HD1  ILE  25          2HD1      ILE  25   2.571  -7.248  -2.619
  195   3HD1  ILE  25          3HD1      ILE  25   3.762  -7.913  -3.737
  196    H    ILE  26           H        ILE  26   1.759 -13.796  -5.196
  197    HA   ILE  26           HA       ILE  26   1.956 -15.010  -2.536
  198    HB   ILE  26           HB       ILE  26   1.685 -17.179  -4.019
  199   1HG1  ILE  26          1HG1      ILE  26  -0.091 -16.623  -5.806
  200   2HG1  ILE  26          2HG1      ILE  26   0.534 -14.981  -5.738
  201   1HG2  ILE  26          1HG2      ILE  26  -0.728 -17.074  -3.605
  202   2HG2  ILE  26          2HG2      ILE  26  -0.586 -15.345  -3.282
  203   3HG2  ILE  26          3HG2      ILE  26   0.213 -16.508  -2.224
  204   1HD1  ILE  26          1HD1      ILE  26   1.493 -16.209  -7.586
  205   2HD1  ILE  26          2HD1      ILE  26   2.093 -17.444  -6.479
  206   3HD1  ILE  26          3HD1      ILE  26   2.737 -15.803  -6.403
  207    H    GLU  27           H        GLU  27   3.753 -13.907  -5.042
  208    HA   GLU  27           HA       GLU  27   6.074 -15.305  -3.968
  209   1HB   GLU  27          1HB       GLU  27   5.084 -15.827  -6.522
  210   2HB   GLU  27          2HB       GLU  27   6.406 -14.699  -6.792
  211   1HG   GLU  27          1HG       GLU  27   6.614 -17.269  -5.241
  212   2HG   GLU  27          2HG       GLU  27   7.100 -17.054  -6.920
  213    H    VAL  28           H        VAL  28   7.576 -13.934  -3.365
  214    HA   VAL  28           HA       VAL  28   7.575 -11.207  -4.414
  215    HB   VAL  28           HB       VAL  28   7.409 -11.922  -1.482
  216   1HG1  VAL  28          1HG1      VAL  28   9.074 -10.172  -1.785
  217   2HG1  VAL  28          2HG1      VAL  28   7.617  -9.516  -1.038
  218   3HG1  VAL  28          3HG1      VAL  28   7.933  -9.232  -2.749
  219   1HG2  VAL  28          1HG2      VAL  28   5.438 -10.465  -1.495
  220   2HG2  VAL  28          2HG2      VAL  28   5.250 -11.828  -2.598
  221   3HG2  VAL  28          3HG2      VAL  28   5.632 -10.227  -3.232
  222    H    ARG  29           H        ARG  29   9.589 -11.337  -5.317
  223    HA   ARG  29           HA       ARG  29  11.762 -12.548  -3.749
  224   1HB   ARG  29          1HB       ARG  29  11.203 -13.426  -6.059
  225   2HB   ARG  29          2HB       ARG  29  11.751 -11.884  -6.698
  226   1HG   ARG  29          1HG       ARG  29  13.973 -12.309  -5.695
  227   2HG   ARG  29          2HG       ARG  29  13.401 -13.900  -5.190
  228   1HD   ARG  29          1HD       ARG  29  14.616 -14.149  -7.238
  229   2HD   ARG  29          2HD       ARG  29  12.903 -14.409  -7.571
  230    HE   ARG  29           HE       ARG  29  14.163 -11.804  -8.096
  231   1HH1  ARG  29          1HH1      ARG  29  12.303 -14.563  -9.170
  232   2HH1  ARG  29          2HH1      ARG  29  12.055 -13.934 -10.773
  233   1HH2  ARG  29          1HH2      ARG  29  13.843 -10.961 -10.186
  234   2HH2  ARG  29          2HH2      ARG  29  12.932 -11.880 -11.358
  235    H    SER  30           H        SER  30  10.445  -9.655  -4.435
  236    HA   SER  30           HA       SER  30  12.597  -8.016  -5.161
  237   1HB   SER  30          1HB       SER  30  10.181  -7.209  -3.541
  238   2HB   SER  30          2HB       SER  30  11.133  -6.203  -4.634
  239    HG   SER  30           HG       SER  30  10.045  -6.953  -6.268
  240    H    ALA  31           H        ALA  31  11.632  -9.381  -2.138
  241    HA   ALA  31           HA       ALA  31  12.422  -9.285  -0.020
  242   1HB   ALA  31          1HB       ALA  31  14.590  -9.735  -1.075
  243   2HB   ALA  31          2HB       ALA  31  14.756  -8.710   0.351
  244   3HB   ALA  31          3HB       ALA  31  14.854  -8.001  -1.260
  245    H    ASP  32           H        ASP  32  14.061  -6.336  -1.058
  246    HA   ASP  32           HA       ASP  32  12.928  -4.796   1.054
  247   1HB   ASP  32          1HB       ASP  32  14.741  -4.263  -1.247
  248   2HB   ASP  32          2HB       ASP  32  13.925  -2.885  -0.518
  249    H    GLY  33           H        GLY  33  12.383  -4.988  -2.431
  250   1HA   GLY  33          1HA       GLY  33   9.743  -4.641  -2.620
  251   2HA   GLY  33          2HA       GLY  33  10.275  -2.995  -2.296
  252    H    SER  34           H        SER  34   9.269  -2.664  -4.417
  253    HA   SER  34           HA       SER  34   9.438  -1.986  -6.549
  254   1HB   SER  34          1HB       SER  34  11.564  -1.553  -7.567
  255   2HB   SER  34          2HB       SER  34  11.707  -1.175  -5.854
  256    HG   SER  34           HG       SER  34  12.420  -3.647  -5.987
  257    HA   PRO  35           HA       PRO  35   8.753  -5.501  -9.083
  258   1HB   PRO  35          1HB       PRO  35   9.680  -3.969 -11.427
  259   2HB   PRO  35          2HB       PRO  35   8.082  -4.635 -11.082
  260   1HG   PRO  35          1HG       PRO  35   8.545  -1.999 -10.987
  261   2HG   PRO  35          2HG       PRO  35   7.429  -2.789  -9.856
  262   1HD   PRO  35          1HD       PRO  35  10.255  -1.897  -9.416
  263   2HD   PRO  35          2HD       PRO  35   8.848  -1.751  -8.342
  264    HA   PRO  36           HA       PRO  36   8.696  -6.656 -11.053
  265   1HB   PRO  36          1HB       PRO  36   9.113  -9.214 -11.681
  266   2HB   PRO  36          2HB       PRO  36   9.742  -7.908 -12.694
  267   1HG   PRO  36          1HG       PRO  36  11.165  -9.593 -10.674
  268   2HG   PRO  36          2HG       PRO  36  11.714  -9.055 -12.272
  269   1HD   PRO  36          1HD       PRO  36  12.406  -7.855  -9.886
  270   2HD   PRO  36          2HD       PRO  36  12.448  -7.055 -11.469
  271    H    TYR  37           H        TYR  37   7.221  -8.527 -10.568
  272    HA   TYR  37           HA       TYR  37   7.629  -9.777  -7.950
  273   1HB   TYR  37          1HB       TYR  37   5.221  -8.167  -8.816
  274   2HB   TYR  37          2HB       TYR  37   5.154  -9.344  -7.511
  275    HD1  TYR  37           HD1      TYR  37   6.343  -8.928  -5.408
  276    HD2  TYR  37           HD2      TYR  37   6.256  -6.017  -8.508
  277    HE1  TYR  37           HE1      TYR  37   7.070  -7.213  -3.807
  278    HE2  TYR  37           HE2      TYR  37   6.987  -4.291  -6.914
  279    HH   TYR  37           HH       TYR  37   8.211  -5.058  -3.841
  280    H    VAL  38           H        VAL  38   5.831 -11.490  -7.660
  281    HA   VAL  38           HA       VAL  38   4.875 -12.468 -10.256
  282    HB   VAL  38           HB       VAL  38   6.231 -14.242  -8.201
  283   1HG1  VAL  38          1HG1      VAL  38   4.846 -14.937 -10.799
  284   2HG1  VAL  38          2HG1      VAL  38   4.256 -15.304  -9.178
  285   3HG1  VAL  38          3HG1      VAL  38   5.729 -16.070  -9.774
  286   1HG2  VAL  38          1HG2      VAL  38   7.809 -14.751 -10.003
  287   2HG2  VAL  38          2HG2      VAL  38   7.824 -13.031  -9.609
  288   3HG2  VAL  38          3HG2      VAL  38   6.986 -13.598 -11.054
  289    H    VAL  39           H        VAL  39   2.834 -12.928 -10.136
  290    HA   VAL  39           HA       VAL  39   1.633 -12.504  -7.520
  291    HB   VAL  39           HB       VAL  39   2.406 -10.441  -9.198
  292   1HG1  VAL  39          1HG1      VAL  39  -0.557 -10.802  -9.532
  293   2HG1  VAL  39          2HG1      VAL  39   0.668 -10.898 -10.797
  294   3HG1  VAL  39          3HG1      VAL  39   0.362  -9.366  -9.980
  295   1HG2  VAL  39          1HG2      VAL  39   0.307 -10.421  -7.052
  296   2HG2  VAL  39          2HG2      VAL  39   1.117  -8.995  -7.704
  297   3HG2  VAL  39          3HG2      VAL  39   2.048 -10.221  -6.844
  298    H    ARG  40           H        ARG  40  -0.820 -12.283  -7.900
  299    HA   ARG  40           HA       ARG  40  -1.633 -14.100 -10.036
  300   1HB   ARG  40          1HB       ARG  40  -1.045 -15.299  -7.872
  301   2HB   ARG  40          2HB       ARG  40  -2.391 -14.452  -7.133
  302   1HG   ARG  40          1HG       ARG  40  -3.940 -15.553  -8.638
  303   2HG   ARG  40          2HG       ARG  40  -2.593 -16.369  -9.442
  304   1HD   ARG  40          1HD       ARG  40  -1.995 -17.461  -7.339
  305   2HD   ARG  40          2HD       ARG  40  -3.329 -16.643  -6.529
  306    HE   ARG  40           HE       ARG  40  -3.760 -18.551  -8.734
  307   1HH1  ARG  40          1HH1      ARG  40  -4.419 -17.394  -5.492
  308   2HH1  ARG  40          2HH1      ARG  40  -5.730 -18.503  -5.226
  309   1HH2  ARG  40          1HH2      ARG  40  -5.466 -20.028  -8.382
  310   2HH2  ARG  40          2HH2      ARG  40  -6.309 -20.025  -6.858
  311    H    TRP  41           H        TRP  41  -3.305 -13.214 -11.035
  312    HA   TRP  41           HA       TRP  41  -4.905 -11.161  -9.782
  313   1HB   TRP  41          1HB       TRP  41  -5.629 -12.608 -12.333
  314   2HB   TRP  41          2HB       TRP  41  -6.058 -10.975 -11.851
  315    HD1  TRP  41           HD1      TRP  41  -3.946 -12.654 -14.215
  316    HE1  TRP  41           HE1      TRP  41  -2.024 -11.163 -15.044
  317    HE3  TRP  41           HE3      TRP  41  -4.117  -9.028 -10.619
  318    HZ2  TRP  41           HZ2      TRP  41  -0.748  -8.781 -14.278
  319    HZ3  TRP  41           HZ3      TRP  41  -2.504  -7.178 -10.747
  320    HH2  TRP  41           HH2      TRP  41  -0.856  -7.058 -12.539
  321    H    LEU  42           H        LEU  42  -5.782 -12.206  -7.990
  322    HA   LEU  42           HA       LEU  42  -6.449 -14.951  -7.998
  323   1HB   LEU  42          1HB       LEU  42  -7.799 -13.072  -6.124
  324   2HB   LEU  42          2HB       LEU  42  -7.231 -14.702  -5.840
  325    HG   LEU  42           HG       LEU  42  -5.563 -12.209  -6.029
  326   1HD1  LEU  42          1HD1      LEU  42  -6.816 -12.478  -3.986
  327   2HD1  LEU  42          2HD1      LEU  42  -5.097 -12.751  -3.696
  328   3HD1  LEU  42          3HD1      LEU  42  -6.203 -14.121  -3.803
  329   1HD2  LEU  42          1HD2      LEU  42  -4.373 -14.091  -7.042
  330   2HD2  LEU  42          2HD2      LEU  42  -4.682 -15.062  -5.601
  331   3HD2  LEU  42          3HD2      LEU  42  -3.659 -13.629  -5.498
  332    H    VAL  43           H        VAL  43  -8.681 -12.257  -7.550
  333    HA   VAL  43           HA       VAL  43 -10.972 -13.833  -7.769
  334    HB   VAL  43           HB       VAL  43 -12.038 -11.462  -8.221
  335   1HG1  VAL  43          1HG1      VAL  43 -12.237 -12.758  -6.150
  336   2HG1  VAL  43          2HG1      VAL  43 -11.964 -11.050  -5.802
  337   3HG1  VAL  43          3HG1      VAL  43 -10.639 -12.202  -5.654
  338   1HG2  VAL  43          1HG2      VAL  43  -9.938 -10.319  -8.751
  339   2HG2  VAL  43          2HG2      VAL  43  -9.288 -10.780  -7.177
  340   3HG2  VAL  43          3HG2      VAL  43 -10.650  -9.666  -7.275
  341    H    ASN  44           H        ASN  44  -9.271 -11.883 -10.154
  342    HA   ASN  44           HA       ASN  44 -10.954 -12.373 -12.332
  343   1HB   ASN  44          1HB       ASN  44  -7.970 -11.917 -12.235
  344   2HB   ASN  44          2HB       ASN  44  -8.913 -11.946 -13.724
  345   1HD2  ASN  44          1HD2      ASN  44  -8.212 -10.196 -10.809
  346   2HD2  ASN  44          2HD2      ASN  44  -8.987  -8.723 -11.269
  347    H    GLY  45           H        GLY  45  -8.060 -14.161 -11.262
  348   1HA   GLY  45          1HA       GLY  45  -8.143 -16.567 -11.117
  349   2HA   GLY  45          2HA       GLY  45  -9.205 -16.571 -12.514
  350    H    HIS  46           H        HIS  46  -6.025 -15.006 -11.945
  351    HA   HIS  46           HA       HIS  46  -4.865 -16.748 -14.008
  352   1HB   HIS  46          1HB       HIS  46  -4.844 -13.732 -14.067
  353   2HB   HIS  46          2HB       HIS  46  -3.645 -14.689 -14.922
  354    HD1  HIS  46           HD1      HIS  46  -4.250 -15.447 -17.217
  355    HD2  HIS  46           HD2      HIS  46  -7.566 -14.187 -15.043
  356    HE1  HIS  46           HE1      HIS  46  -6.169 -15.452 -18.842
  357    HE2  HIS  46           HE2      HIS  46  -8.142 -14.576 -17.540
  358    H    GLU  47           H        GLU  47  -2.411 -16.415 -14.133
  359    HA   GLU  47           HA       GLU  47  -1.223 -15.648 -11.551
  360   1HB   GLU  47          1HB       GLU  47  -1.697 -18.085 -11.480
  361   2HB   GLU  47          2HB       GLU  47  -0.734 -18.302 -12.929
  362   1HG   GLU  47          1HG       GLU  47   0.493 -17.065 -10.507
  363   2HG   GLU  47          2HG       GLU  47   0.269 -18.810 -10.590
  364    H    THR  48           H        THR  48   0.543 -14.405 -11.889
  365    HA   THR  48           HA       THR  48   1.754 -14.420 -14.554
  366    HB   THR  48           HB       THR  48  -0.214 -12.913 -14.519
  367    HG1  THR  48           HG1      THR  48   0.759 -11.550 -15.858
  368   1HG2  THR  48          1HG2      THR  48  -0.026 -12.073 -12.252
  369   2HG2  THR  48          2HG2      THR  48  -0.016 -10.743 -13.410
  370   3HG2  THR  48          3HG2      THR  48   1.492 -11.281 -12.670
  371    H    THR  49           H        THR  49   3.277 -12.490 -14.698
  372    HA   THR  49           HA       THR  49   4.769 -11.914 -12.236
  373    HB   THR  49           HB       THR  49   6.087 -12.762 -14.839
  374    HG1  THR  49           HG1      THR  49   5.044 -14.356 -13.161
  375   1HG2  THR  49          1HG2      THR  49   7.294 -12.080 -12.150
  376   2HG2  THR  49          2HG2      THR  49   7.391 -11.094 -13.608
  377   3HG2  THR  49          3HG2      THR  49   8.183 -12.669 -13.555
  378    H    VAL  50           H        VAL  50   4.867  -9.692 -12.132
  379    HA   VAL  50           HA       VAL  50   4.540  -8.214 -14.652
  380    HB   VAL  50           HB       VAL  50   2.656  -6.885 -13.621
  381   1HG1  VAL  50          1HG1      VAL  50   2.297  -8.463 -15.432
  382   2HG1  VAL  50          2HG1      VAL  50   0.950  -8.507 -14.294
  383   3HG1  VAL  50          3HG1      VAL  50   2.165  -9.785 -14.274
  384   1HG2  VAL  50          1HG2      VAL  50   1.310  -8.028 -11.912
  385   2HG2  VAL  50          2HG2      VAL  50   2.915  -7.605 -11.315
  386   3HG2  VAL  50          3HG2      VAL  50   2.555  -9.269 -11.775
  387    H    TYR  51           H        TYR  51   4.058  -5.787 -14.016
  388    HA   TYR  51           HA       TYR  51   5.991  -4.893 -12.003
  389   1HB   TYR  51          1HB       TYR  51   5.951  -3.897 -14.871
  390   2HB   TYR  51          2HB       TYR  51   7.044  -3.373 -13.598
  391    HD1  TYR  51           HD1      TYR  51   6.186  -6.190 -15.840
  392    HD2  TYR  51           HD2      TYR  51   9.027  -4.586 -13.111
  393    HE1  TYR  51           HE1      TYR  51   7.815  -7.892 -16.549
  394    HE2  TYR  51           HE2      TYR  51  10.662  -6.281 -13.812
  395    HH   TYR  51           HH       TYR  51  10.258  -8.228 -16.573
  396    HA   PRO  52           HA       PRO  52   2.342  -2.144 -11.578
  397   1HB   PRO  52          1HB       PRO  52   2.976  -1.318  -9.091
  398   2HB   PRO  52          2HB       PRO  52   2.242  -2.896  -9.395
  399   1HG   PRO  52          1HG       PRO  52   5.117  -2.210  -8.905
  400   2HG   PRO  52          2HG       PRO  52   4.152  -3.532  -8.220
  401   1HD   PRO  52          1HD       PRO  52   5.859  -3.885 -10.299
  402   2HD   PRO  52          2HD       PRO  52   4.375  -4.839 -10.103
  403    H    GLY  53           H        GLY  53   2.498   0.238 -10.372
  404   1HA   GLY  53          1HA       GLY  53   4.593   1.664 -11.858
  405   2HA   GLY  53          2HA       GLY  53   3.116   2.377 -11.225
  406    H    SER  54           H        SER  54   4.682   4.042 -10.455
  407    HA   SER  54           HA       SER  54   6.305   3.187  -8.179
  408   1HB   SER  54          1HB       SER  54   6.238   5.822  -9.658
  409   2HB   SER  54          2HB       SER  54   7.344   5.425  -8.342
  410    HG   SER  54           HG       SER  54   7.197   4.291 -10.936
  411    H    ASP  55           H        ASP  55   3.324   3.623  -8.249
  412    HA   ASP  55           HA       ASP  55   3.256   5.117  -5.706
  413   1HB   ASP  55          1HB       ASP  55   1.934   6.208  -7.604
  414   2HB   ASP  55          2HB       ASP  55   0.883   4.796  -7.565
  415    H    ALA  56           H        ALA  56   4.036   2.535  -6.028
  416    HA   ALA  56           HA       ALA  56   1.977   0.627  -5.887
  417   1HB   ALA  56          1HB       ALA  56   4.852   0.350  -5.025
  418   2HB   ALA  56          2HB       ALA  56   4.222   0.062  -6.647
  419   3HB   ALA  56          3HB       ALA  56   3.714  -0.968  -5.309
  420    H    VAL  57           H        VAL  57   0.955  -0.280  -4.241
  421    HA   VAL  57           HA       VAL  57   1.510   0.522  -1.465
  422    HB   VAL  57           HB       VAL  57  -1.316   0.519  -2.504
  423   1HG1  VAL  57          1HG1      VAL  57  -0.999   0.446  -0.096
  424   2HG1  VAL  57          2HG1      VAL  57  -1.720   1.980  -0.579
  425   3HG1  VAL  57          3HG1      VAL  57  -0.008   1.903  -0.165
  426   1HG2  VAL  57          1HG2      VAL  57   0.483   2.940  -2.465
  427   2HG2  VAL  57          2HG2      VAL  57  -1.257   2.955  -2.758
  428   3HG2  VAL  57          3HG2      VAL  57  -0.176   2.155  -3.900
  429    H    VAL  58           H        VAL  58  -0.273  -0.721  -0.157
  430    HA   VAL  58           HA       VAL  58  -0.395  -3.485  -1.143
  431    HB   VAL  58           HB       VAL  58   0.683  -2.686   1.575
  432   1HG1  VAL  58          1HG1      VAL  58  -0.566  -4.766   1.661
  433   2HG1  VAL  58          2HG1      VAL  58   1.160  -5.073   1.855
  434   3HG1  VAL  58          3HG1      VAL  58   0.374  -5.406   0.311
  435   1HG2  VAL  58          1HG2      VAL  58   2.124  -3.881  -0.791
  436   2HG2  VAL  58          2HG2      VAL  58   2.818  -3.611   0.808
  437   3HG2  VAL  58          3HG2      VAL  58   2.313  -2.238  -0.178
  438    H    VAL  59           H        VAL  59  -2.114  -4.610  -0.474
  439    HA   VAL  59           HA       VAL  59  -4.075  -3.337   1.275
  440    HB   VAL  59           HB       VAL  59  -5.623  -4.292  -0.720
  441   1HG1  VAL  59          1HG1      VAL  59  -4.457  -1.519  -0.564
  442   2HG1  VAL  59          2HG1      VAL  59  -5.847  -2.108   0.347
  443   3HG1  VAL  59          3HG1      VAL  59  -5.941  -1.964  -1.408
  444   1HG2  VAL  59          1HG2      VAL  59  -4.704  -3.476  -2.849
  445   2HG2  VAL  59          2HG2      VAL  59  -3.777  -4.815  -2.175
  446   3HG2  VAL  59          3HG2      VAL  59  -3.170  -3.165  -2.038
  447    H    THR  60           H        THR  60  -6.068  -4.875   1.236
  448    HA   THR  60           HA       THR  60  -5.001  -7.569   1.884
  449    HB   THR  60           HB       THR  60  -5.519  -6.014   3.821
  450    HG1  THR  60           HG1      THR  60  -6.848  -7.681   4.928
  451   1HG2  THR  60          1HG2      THR  60  -7.858  -5.689   4.466
  452   2HG2  THR  60          2HG2      THR  60  -8.367  -6.415   2.941
  453   3HG2  THR  60          3HG2      THR  60  -7.477  -4.892   2.940
  454    H    ALA  61           H        ALA  61  -7.443  -8.632   2.718
  455    HA   ALA  61           HA       ALA  61  -8.340  -9.767   0.330
  456   1HB   ALA  61          1HB       ALA  61  -9.932 -10.969   1.696
  457   2HB   ALA  61          2HB       ALA  61  -9.681  -9.836   3.024
  458   3HB   ALA  61          3HB       ALA  61  -8.367 -10.891   2.505
  459    H    THR  62           H        THR  62  -9.982  -7.302   2.376
  460    HA   THR  62           HA       THR  62 -12.372  -7.381   0.815
  461    HB   THR  62           HB       THR  62 -12.512  -4.925   1.870
  462    HG1  THR  62           HG1      THR  62 -11.237  -4.689   3.601
  463   1HG2  THR  62          1HG2      THR  62 -13.686  -5.962   3.781
  464   2HG2  THR  62          2HG2      THR  62 -13.011  -7.527   3.323
  465   3HG2  THR  62          3HG2      THR  62 -14.123  -6.694   2.236
  466    H    GLU  63           H        GLU  63  -9.535  -5.282   0.886
  467    HA   GLU  63           HA       GLU  63 -10.411  -3.426  -1.050
  468   1HB   GLU  63          1HB       GLU  63  -7.565  -4.334  -0.597
  469   2HB   GLU  63          2HB       GLU  63  -8.101  -2.779  -1.212
  470   1HG   GLU  63          1HG       GLU  63  -8.615  -3.792   1.574
  471   2HG   GLU  63          2HG       GLU  63  -7.310  -2.699   1.120
  472    H    HIS  64           H        HIS  64  -9.604  -6.659  -1.248
  473    HA   HIS  64           HA       HIS  64  -8.373  -6.634  -3.830
  474   1HB   HIS  64          1HB       HIS  64  -7.426  -8.397  -2.894
  475   2HB   HIS  64          2HB       HIS  64  -8.601  -8.406  -1.594
  476    HD1  HIS  64           HD1      HIS  64 -10.381 -10.199  -1.634
  477    HD2  HIS  64           HD2      HIS  64  -7.995 -10.183  -5.036
  478    HE1  HIS  64           HE1      HIS  64 -10.793 -12.404  -2.757
  479    HE2  HIS  64           HE2      HIS  64  -9.172 -12.452  -4.680
  480    H    ALA  65           H        ALA  65 -11.627  -7.555  -2.637
  481    HA   ALA  65           HA       ALA  65 -12.274  -9.274  -4.730
  482   1HB   ALA  65          1HB       ALA  65 -13.583  -9.055  -2.658
  483   2HB   ALA  65          2HB       ALA  65 -14.594  -8.947  -4.099
  484   3HB   ALA  65          3HB       ALA  65 -14.167  -7.485  -3.209
  485    H    GLU  66           H        GLU  66 -13.561  -6.025  -4.374
  486    HA   GLU  66           HA       GLU  66 -14.484  -5.908  -7.060
  487   1HB   GLU  66          1HB       GLU  66 -14.746  -3.386  -6.321
  488   2HB   GLU  66          2HB       GLU  66 -15.793  -4.637  -5.670
  489   1HG   GLU  66          1HG       GLU  66 -14.543  -4.714  -3.614
  490   2HG   GLU  66          2HG       GLU  66 -13.303  -3.644  -4.269
  491    H    ALA  67           H        ALA  67 -11.954  -4.132  -5.333
  492    HA   ALA  67           HA       ALA  67 -11.119  -2.568  -7.475
  493   1HB   ALA  67          1HB       ALA  67 -10.580  -2.060  -5.144
  494   2HB   ALA  67          2HB       ALA  67  -9.141  -2.076  -6.164
  495   3HB   ALA  67          3HB       ALA  67  -9.485  -3.441  -5.101
  496    H    GLU  68           H        GLU  68  -9.950  -5.772  -6.403
  497    HA   GLU  68           HA       GLU  68  -7.774  -5.739  -8.247
  498   1HB   GLU  68          1HB       GLU  68  -7.694  -7.175  -6.274
  499   2HB   GLU  68          2HB       GLU  68  -9.054  -8.104  -6.885
  500   1HG   GLU  68          1HG       GLU  68  -7.728  -8.825  -8.786
  501   2HG   GLU  68          2HG       GLU  68  -6.364  -7.868  -8.208
  502    H    LYS  69           H        LYS  69 -11.108  -6.986  -8.401
  503    HA   LYS  69           HA       LYS  69 -10.877  -8.409 -10.767
  504   1HB   LYS  69          1HB       LYS  69 -12.970  -7.740  -9.234
  505   2HB   LYS  69          2HB       LYS  69 -13.219  -6.585 -10.537
  506   1HG   LYS  69          1HG       LYS  69 -14.494  -8.575 -10.973
  507   2HG   LYS  69          2HG       LYS  69 -13.185  -8.452 -12.151
  508   1HD   LYS  69          1HD       LYS  69 -11.851 -10.021 -10.800
  509   2HD   LYS  69          2HD       LYS  69 -13.196 -10.172  -9.671
  510   1HE   LYS  69          1HE       LYS  69 -13.224 -10.933 -12.588
  511   2HE   LYS  69          2HE       LYS  69 -13.140 -12.045 -11.224
  512   1HZ   LYS  69          1HZ       LYS  69 -15.381 -11.932 -12.024
  513   2HZ   LYS  69          2HZ       LYS  69 -15.399 -10.240 -11.902
  514   3HZ   LYS  69          3HZ       LYS  69 -15.317 -11.191 -10.499
  515    H    ARG  70           H        ARG  70 -11.759  -4.955 -10.504
  516    HA   ARG  70           HA       ARG  70 -11.552  -4.482 -13.315
  517   1HB   ARG  70          1HB       ARG  70 -12.886  -3.134 -11.697
  518   2HB   ARG  70          2HB       ARG  70 -11.385  -2.486 -11.056
  519   1HG   ARG  70          1HG       ARG  70 -10.893  -1.562 -13.307
  520   2HG   ARG  70          2HG       ARG  70 -12.495  -2.098 -13.824
  521   1HD   ARG  70          1HD       ARG  70 -11.830  -0.088 -11.683
  522   2HD   ARG  70          2HD       ARG  70 -12.652   0.208 -13.214
  523    HE   ARG  70           HE       ARG  70 -13.977  -1.668 -11.447
  524   1HH1  ARG  70          1HH1      ARG  70 -13.617   1.683 -12.389
  525   2HH1  ARG  70          2HH1      ARG  70 -15.209   2.141 -11.853
  526   1HH2  ARG  70          1HH2      ARG  70 -16.056  -1.077 -10.698
  527   2HH2  ARG  70          2HH2      ARG  70 -16.601   0.565 -10.884
  528    H    ALA  71           H        ALA  71  -9.416  -3.664 -10.625
  529    HA   ALA  71           HA       ALA  71  -7.599  -2.192 -12.209
  530   1HB   ALA  71          1HB       ALA  71  -6.253  -2.073 -10.187
  531   2HB   ALA  71          2HB       ALA  71  -7.260  -3.312  -9.437
  532   3HB   ALA  71          3HB       ALA  71  -7.951  -1.743  -9.848
  533    H    ALA  72           H        ALA  72  -7.680  -5.583 -11.206
  534    HA   ALA  72           HA       ALA  72  -4.998  -6.149 -12.001
  535   1HB   ALA  72          1HB       ALA  72  -7.335  -8.051 -11.875
  536   2HB   ALA  72          2HB       ALA  72  -6.256  -7.667 -10.534
  537   3HB   ALA  72          3HB       ALA  72  -5.628  -8.490 -11.961
  538    H    ALA  73           H        ALA  73  -8.170  -6.361 -13.576
  539    HA   ALA  73           HA       ALA  73  -7.387  -7.360 -16.029
  540   1HB   ALA  73          1HB       ALA  73  -9.313  -6.204 -16.968
  541   2HB   ALA  73          2HB       ALA  73  -9.420  -5.192 -15.528
  542   3HB   ALA  73          3HB       ALA  73  -9.709  -6.928 -15.410
  543    H    ARG  74           H        ARG  74  -7.043  -4.023 -14.802
  544    HA   ARG  74           HA       ARG  74  -5.816  -3.171 -17.289
  545   1HB   ARG  74          1HB       ARG  74  -7.083  -1.635 -15.743
  546   2HB   ARG  74          2HB       ARG  74  -5.684  -1.682 -14.674
  547   1HG   ARG  74          1HG       ARG  74  -4.281  -0.732 -16.390
  548   2HG   ARG  74          2HG       ARG  74  -5.606  -0.792 -17.551
  549   1HD   ARG  74          1HD       ARG  74  -6.882   0.745 -16.068
  550   2HD   ARG  74          2HD       ARG  74  -5.444   0.890 -15.058
  551    HE   ARG  74           HE       ARG  74  -5.197   1.553 -17.901
  552   1HH1  ARG  74          1HH1      ARG  74  -5.221   2.580 -14.557
  553   2HH1  ARG  74          2HH1      ARG  74  -4.809   4.233 -14.930
  554   1HH2  ARG  74          1HH2      ARG  74  -4.597   3.701 -18.389
  555   2HH2  ARG  74          2HH2      ARG  74  -4.434   4.866 -17.110
  556    H    ALA  75           H        ALA  75  -4.501  -3.831 -14.025
  557    HA   ALA  75           HA       ALA  75  -1.845  -3.106 -14.230
  558   1HB   ALA  75          1HB       ALA  75  -2.898  -5.633 -12.957
  559   2HB   ALA  75          2HB       ALA  75  -2.892  -4.030 -12.222
  560   3HB   ALA  75          3HB       ALA  75  -1.367  -4.832 -12.600
  561    H    GLY  76           H        GLY  76  -3.214  -6.254 -15.249
  562   1HA   GLY  76          1HA       GLY  76  -0.647  -6.812 -16.595
  563   2HA   GLY  76          2HA       GLY  76  -1.802  -8.033 -16.089
  564    H    HIS  77           H        HIS  77  -2.908  -5.133 -17.624
  565    HA   HIS  77           HA       HIS  77  -4.223  -6.614 -19.680
  566   1HB   HIS  77          1HB       HIS  77  -4.987  -4.426 -18.606
  567   2HB   HIS  77          2HB       HIS  77  -3.800  -3.626 -19.626
  568    HD1  HIS  77           HD1      HIS  77  -7.230  -4.873 -19.598
  569    HD2  HIS  77           HD2      HIS  77  -4.380  -3.899 -22.471
  570    HE1  HIS  77           HE1      HIS  77  -8.499  -4.600 -21.748
  571    HE2  HIS  77           HE2      HIS  77  -6.788  -3.808 -23.417
  572    H    ALA  78           H        ALA  78  -1.381  -4.527 -19.562
  573    HA   ALA  78           HA       ALA  78  -0.390  -5.668 -22.034
  574   1HB   ALA  78          1HB       ALA  78  -0.113  -3.518 -23.155
  575   2HB   ALA  78          2HB       ALA  78  -0.919  -2.704 -21.814
  576   3HB   ALA  78          3HB       ALA  78  -1.815  -3.837 -22.826
  577    H    ALA  79           H        ALA  79   0.611  -5.996 -19.527
  578    HA   ALA  79           HA       ALA  79   2.399  -4.152 -18.498
  579   1HB   ALA  79          1HB       ALA  79   2.675  -7.156 -18.495
  580   2HB   ALA  79          2HB       ALA  79   1.752  -6.201 -17.335
  581   3HB   ALA  79          3HB       ALA  79   3.507  -6.038 -17.413
  582    H    THR  80           H        THR  80   3.107  -6.769 -20.814
  583    HA   THR  80           HA       THR  80   5.054  -5.074 -22.112
  584    HB   THR  80           HB       THR  80   5.906  -7.776 -21.034
  585    HG1  THR  80           HG1      THR  80   5.978  -5.279 -19.955
  586   1HG2  THR  80          1HG2      THR  80   6.915  -7.202 -23.209
  587   2HG2  THR  80          2HG2      THR  80   8.110  -7.191 -21.911
  588   3HG2  THR  80          3HG2      THR  80   7.474  -5.669 -22.534
  Start of MODEL   10
    1    H    MET   1           H        MET   1  11.484   0.742   0.588
    2    HA   MET   1           HA       MET   1   8.557   0.909   0.213
    3   1HB   MET   1          1HB       MET   1   9.643   1.098  -1.927
    4   2HB   MET   1          2HB       MET   1  10.745  -0.216  -1.539
    5   1HG   MET   1          1HG       MET   1   9.005  -0.921  -3.086
    6   2HG   MET   1          2HG       MET   1   8.918  -1.799  -1.560
    7   1HE   MET   1          1HE       MET   1   6.483  -2.649  -2.094
    8   2HE   MET   1          2HE       MET   1   6.573  -1.828  -3.653
    9   3HE   MET   1          3HE       MET   1   5.169  -1.591  -2.613
   10    H    HIS   2           H        HIS   2   7.480  -0.670   1.207
   11    HA   HIS   2           HA       HIS   2   8.902  -3.160   1.793
   12   1HB   HIS   2          1HB       HIS   2   8.128  -3.269   4.046
   13   2HB   HIS   2          2HB       HIS   2   8.852  -1.682   3.838
   14    HD1  HIS   2           HD1      HIS   2   5.964  -3.279   5.200
   15    HD2  HIS   2           HD2      HIS   2   6.699   0.364   3.331
   16    HE1  HIS   2           HE1      HIS   2   4.033  -1.793   5.824
   17    HE2  HIS   2           HE2      HIS   2   4.394   0.328   4.510
   18    H    ALA   3           H        ALA   3   7.825  -4.889   1.219
   19    HA   ALA   3           HA       ALA   3   4.948  -5.052   1.336
   20   1HB   ALA   3          1HB       ALA   3   4.664  -5.641  -1.030
   21   2HB   ALA   3          2HB       ALA   3   6.365  -5.280  -1.326
   22   3HB   ALA   3          3HB       ALA   3   5.259  -3.990  -0.854
   23    H    LYS   4           H        LYS   4   4.264  -7.232   1.384
   24    HA   LYS   4           HA       LYS   4   6.310  -9.262   0.970
   25   1HB   LYS   4          1HB       LYS   4   5.842  -8.268   3.507
   26   2HB   LYS   4          2HB       LYS   4   4.870  -9.735   3.461
   27   1HG   LYS   4          1HG       LYS   4   6.818 -11.028   2.815
   28   2HG   LYS   4          2HG       LYS   4   7.799  -9.562   2.796
   29   1HD   LYS   4          1HD       LYS   4   7.276  -9.257   5.209
   30   2HD   LYS   4          2HD       LYS   4   6.457 -10.821   5.183
   31   1HE   LYS   4          1HE       LYS   4   9.359 -10.329   4.522
   32   2HE   LYS   4          2HE       LYS   4   8.745 -11.022   6.022
   33   1HZ   LYS   4          1HZ       LYS   4   7.898 -12.901   4.804
   34   2HZ   LYS   4          2HZ       LYS   4   9.546 -12.708   4.459
   35   3HZ   LYS   4          3HZ       LYS   4   8.385 -12.224   3.327
   36    H    VAL   5           H        VAL   5   5.363 -11.480   1.412
   37    HA   VAL   5           HA       VAL   5   3.108 -11.789  -0.302
   38    HB   VAL   5           HB       VAL   5   4.805 -13.453  -0.457
   39   1HG1  VAL   5          1HG1      VAL   5   5.835 -13.139   1.717
   40   2HG1  VAL   5          2HG1      VAL   5   5.517 -14.849   1.426
   41   3HG1  VAL   5          3HG1      VAL   5   4.465 -13.926   2.501
   42   1HG2  VAL   5          1HG2      VAL   5   2.486 -14.674   1.042
   43   2HG2  VAL   5          2HG2      VAL   5   3.644 -15.558   0.047
   44   3HG2  VAL   5          3HG2      VAL   5   2.566 -14.377  -0.695
   45    H    GLY   6           H        GLY   6   1.099 -12.652   0.156
   46   1HA   GLY   6          1HA       GLY   6  -0.554 -13.519   1.670
   47   2HA   GLY   6          2HA       GLY   6   0.324 -12.764   2.997
   48    H    ASP   7           H        ASP   7   0.405 -10.680   0.479
   49    HA   ASP   7           HA       ASP   7  -2.103  -9.260   1.352
   50   1HB   ASP   7          1HB       ASP   7   0.725  -8.168   1.279
   51   2HB   ASP   7          2HB       ASP   7  -0.685  -7.122   1.160
   52    H    TYR   8           H        TYR   8  -2.250  -7.250  -0.144
   53    HA   TYR   8           HA       TYR   8  -1.931  -8.314  -2.861
   54   1HB   TYR   8          1HB       TYR   8  -4.180  -6.669  -1.692
   55   2HB   TYR   8          2HB       TYR   8  -4.051  -7.131  -3.387
   56    HD1  TYR   8           HD1      TYR   8  -4.660  -8.374   0.024
   57    HD2  TYR   8           HD2      TYR   8  -4.528  -9.385  -4.098
   58    HE1  TYR   8           HE1      TYR   8  -5.821 -10.491   0.501
   59    HE2  TYR   8           HE2      TYR   8  -5.695 -11.501  -3.630
   60    HH   TYR   8           HH       TYR   8  -5.894 -13.041  -1.533
   61    H    LEU   9           H        LEU   9  -1.637  -6.834  -4.557
   62    HA   LEU   9           HA       LEU   9  -0.063  -4.509  -3.738
   63   1HB   LEU   9          1HB       LEU   9   1.013  -6.231  -5.139
   64   2HB   LEU   9          2HB       LEU   9  -0.212  -5.999  -6.366
   65    HG   LEU   9           HG       LEU   9   1.475  -3.656  -5.585
   66   1HD1  LEU   9          1HD1      LEU   9   3.068  -5.489  -5.879
   67   2HD1  LEU   9          2HD1      LEU   9   3.171  -4.331  -7.205
   68   3HD1  LEU   9          3HD1      LEU   9   2.343  -5.870  -7.442
   69   1HD2  LEU   9          1HD2      LEU   9   0.298  -4.618  -8.193
   70   2HD2  LEU   9          2HD2      LEU   9   1.183  -3.112  -7.954
   71   3HD2  LEU   9          3HD2      LEU   9  -0.373  -3.356  -7.158
   72    H    VAL  10           H        VAL  10  -0.442  -2.517  -4.499
   73    HA   VAL  10           HA       VAL  10  -2.867  -1.964  -6.079
   74    HB   VAL  10           HB       VAL  10  -2.002  -0.470  -3.592
   75   1HG1  VAL  10          1HG1      VAL  10  -3.165   0.938  -5.188
   76   2HG1  VAL  10          2HG1      VAL  10  -4.158   0.660  -3.757
   77   3HG1  VAL  10          3HG1      VAL  10  -4.501  -0.211  -5.252
   78   1HG2  VAL  10          1HG2      VAL  10  -4.261  -2.422  -3.931
   79   2HG2  VAL  10          2HG2      VAL  10  -3.977  -1.419  -2.508
   80   3HG2  VAL  10          3HG2      VAL  10  -2.803  -2.653  -2.967
   81    H    VAL  11           H        VAL  11  -2.731   0.029  -7.287
   82    HA   VAL  11           HA       VAL  11  -0.204   1.518  -6.978
   83    HB   VAL  11           HB       VAL  11  -0.252   2.150  -9.329
   84   1HG1  VAL  11          1HG1      VAL  11   0.282  -0.020 -10.339
   85   2HG1  VAL  11          2HG1      VAL  11  -0.430  -0.832  -8.944
   86   3HG1  VAL  11          3HG1      VAL  11   1.006   0.171  -8.743
   87   1HG2  VAL  11          1HG2      VAL  11  -2.652   0.336  -9.573
   88   2HG2  VAL  11          2HG2      VAL  11  -1.809   1.114 -10.913
   89   3HG2  VAL  11          3HG2      VAL  11  -2.654   2.095  -9.717
   90    H    LYS  12           H        LYS  12  -0.363   3.798  -7.189
   91    HA   LYS  12           HA       LYS  12  -3.105   4.868  -7.146
   92   1HB   LYS  12          1HB       LYS  12  -0.859   5.761  -5.322
   93   2HB   LYS  12          2HB       LYS  12  -2.477   6.445  -5.382
   94   1HG   LYS  12          1HG       LYS  12  -3.396   4.292  -4.634
   95   2HG   LYS  12          2HG       LYS  12  -1.756   3.649  -4.533
   96   1HD   LYS  12          1HD       LYS  12  -2.842   5.987  -2.963
   97   2HD   LYS  12          2HD       LYS  12  -2.565   4.363  -2.337
   98   1HE   LYS  12          1HE       LYS  12  -0.162   4.611  -2.861
   99   2HE   LYS  12          2HE       LYS  12  -0.473   6.263  -3.390
  100   1HZ   LYS  12          1HZ       LYS  12  -1.301   6.741  -1.135
  101   2HZ   LYS  12          2HZ       LYS  12   0.329   6.287  -1.145
  102   3HZ   LYS  12          3HZ       LYS  12  -0.860   5.179  -0.649
  103    H    GLY  13           H        GLY  13   0.004   6.482  -6.713
  104   1HA   GLY  13          1HA       GLY  13   0.985   7.433  -8.868
  105   2HA   GLY  13          2HA       GLY  13  -0.623   8.115  -9.081
  106    H    THR  14           H        THR  14   2.388   8.835  -8.129
  107    HA   THR  14           HA       THR  14   3.324  10.661  -7.172
  108    HB   THR  14           HB       THR  14   0.542  11.725  -6.673
  109    HG1  THR  14           HG1      THR  14   1.897  11.313  -9.023
  110   1HG2  THR  14          1HG2      THR  14   3.201  13.110  -7.051
  111   2HG2  THR  14          2HG2      THR  14   2.339  12.928  -5.523
  112   3HG2  THR  14          3HG2      THR  14   1.647  13.910  -6.815
  113    H    THR  15           H        THR  15   0.355  10.628  -5.229
  114    HA   THR  15           HA       THR  15   1.611   9.384  -2.967
  115    HB   THR  15           HB       THR  15   0.946  12.337  -2.777
  116    HG1  THR  15           HG1      THR  15   3.017  12.683  -3.018
  117   1HG2  THR  15          1HG2      THR  15   1.771  12.158  -0.474
  118   2HG2  THR  15          2HG2      THR  15   1.975  10.420  -0.683
  119   3HG2  THR  15          3HG2      THR  15   0.362  11.133  -0.736
  120    H    THR  16           H        THR  16  -1.010  11.667  -3.827
  121    HA   THR  16           HA       THR  16  -2.722  10.261  -1.893
  122    HB   THR  16           HB       THR  16  -4.051  12.438  -1.992
  123    HG1  THR  16           HG1      THR  16  -2.302  14.171  -2.599
  124   1HG2  THR  16          1HG2      THR  16  -2.617  11.837  -0.099
  125   2HG2  THR  16          2HG2      THR  16  -2.543  13.569  -0.425
  126   3HG2  THR  16          3HG2      THR  16  -1.222  12.517  -0.936
  127    H    GLU  17           H        GLU  17  -2.311   9.934  -5.016
  128    HA   GLU  17           HA       GLU  17  -4.885  10.614  -6.061
  129   1HB   GLU  17          1HB       GLU  17  -2.520   9.140  -7.161
  130   2HB   GLU  17          2HB       GLU  17  -4.057   9.127  -8.017
  131   1HG   GLU  17          1HG       GLU  17  -2.435  11.553  -7.280
  132   2HG   GLU  17          2HG       GLU  17  -2.640  10.868  -8.893
  133    H    ARG  18           H        ARG  18  -5.971   8.795  -7.421
  134    HA   ARG  18           HA       ARG  18  -7.415   7.238  -5.620
  135   1HB   ARG  18          1HB       ARG  18  -8.107   8.013  -7.921
  136   2HB   ARG  18          2HB       ARG  18  -7.115   6.721  -8.580
  137   1HG   ARG  18          1HG       ARG  18  -8.569   5.226  -6.988
  138   2HG   ARG  18          2HG       ARG  18  -9.702   6.575  -7.123
  139   1HD   ARG  18          1HD       ARG  18  -8.721   4.693  -9.217
  140   2HD   ARG  18          2HD       ARG  18 -10.360   5.247  -8.884
  141    HE   ARG  18           HE       ARG  18  -8.425   7.169  -9.950
  142   1HH1  ARG  18          1HH1      ARG  18 -11.319   5.262 -10.379
  143   2HH1  ARG  18          2HH1      ARG  18 -11.725   5.977 -11.911
  144   1HH2  ARG  18          1HH2      ARG  18  -8.945   8.137 -11.936
  145   2HH2  ARG  18          2HH2      ARG  18 -10.388   7.647 -12.779
  146    H    HIS  19           H        HIS  19  -7.095   5.268  -4.753
  147    HA   HIS  19           HA       HIS  19  -4.843   3.689  -5.695
  148   1HB   HIS  19          1HB       HIS  19  -5.131   2.296  -3.765
  149   2HB   HIS  19          2HB       HIS  19  -5.266   3.965  -3.240
  150    HD1  HIS  19           HD1      HIS  19  -7.449   4.672  -2.131
  151    HD2  HIS  19           HD2      HIS  19  -7.538   0.798  -3.644
  152    HE1  HIS  19           HE1      HIS  19  -9.524   3.614  -1.182
  153    HE2  HIS  19           HE2      HIS  19  -9.387   1.194  -1.885
  154    H    ASP  20           H        ASP  20  -4.999   2.122  -7.112
  155    HA   ASP  20           HA       ASP  20  -7.467   0.626  -7.467
  156   1HB   ASP  20          1HB       ASP  20  -7.740   2.680  -8.871
  157   2HB   ASP  20          2HB       ASP  20  -6.279   2.244  -9.742
  158    H    GLN  21           H        GLN  21  -7.054  -0.986  -9.401
  159    HA   GLN  21           HA       GLN  21  -5.853  -2.721 -10.253
  160   1HB   GLN  21          1HB       GLN  21  -4.450  -0.781 -11.093
  161   2HB   GLN  21          2HB       GLN  21  -3.385  -1.061  -9.728
  162   1HG   GLN  21          1HG       GLN  21  -4.005  -3.193 -11.741
  163   2HG   GLN  21          2HG       GLN  21  -2.709  -2.026 -11.971
  164   1HE2  GLN  21          1HE2      GLN  21  -0.917  -2.092 -10.590
  165   2HE2  GLN  21          2HE2      GLN  21  -0.537  -3.499  -9.665
  166    H    HIS  22           H        HIS  22  -6.118  -4.349  -8.843
  167    HA   HIS  22           HA       HIS  22  -4.185  -4.563  -6.637
  168   1HB   HIS  22          1HB       HIS  22  -7.156  -5.077  -6.527
  169   2HB   HIS  22          2HB       HIS  22  -6.037  -5.667  -5.310
  170    HD1  HIS  22           HD1      HIS  22  -6.161  -2.169  -6.831
  171    HD2  HIS  22           HD2      HIS  22  -6.664  -4.111  -3.199
  172    HE1  HIS  22           HE1      HIS  22  -6.602  -0.352  -5.150
  173    HE2  HIS  22           HE2      HIS  22  -7.070  -1.566  -2.984
  174    H    ALA  23           H        ALA  23  -3.406  -6.567  -6.208
  175    HA   ALA  23           HA       ALA  23  -4.733  -9.026  -7.118
  176   1HB   ALA  23          1HB       ALA  23  -3.503  -8.403  -9.148
  177   2HB   ALA  23          2HB       ALA  23  -2.862  -9.869  -8.407
  178   3HB   ALA  23          3HB       ALA  23  -2.009  -8.337  -8.215
  179    H    GLU  24           H        GLU  24  -3.168 -10.923  -6.507
  180    HA   GLU  24           HA       GLU  24  -2.278 -10.188  -3.805
  181   1HB   GLU  24          1HB       GLU  24  -3.859 -12.056  -3.929
  182   2HB   GLU  24          2HB       GLU  24  -2.730 -12.951  -4.943
  183   1HG   GLU  24          1HG       GLU  24  -1.126 -13.059  -3.147
  184   2HG   GLU  24          2HG       GLU  24  -2.140 -12.036  -2.134
  185    H    ILE  25           H        ILE  25  -0.282 -10.208  -3.146
  186    HA   ILE  25           HA       ILE  25   1.795 -11.119  -4.995
  187    HB   ILE  25           HB       ILE  25   2.443  -9.774  -2.405
  188   1HG1  ILE  25          1HG1      ILE  25   1.575  -8.274  -4.888
  189   2HG1  ILE  25          2HG1      ILE  25   0.614  -8.414  -3.419
  190   1HG2  ILE  25          1HG2      ILE  25   4.280  -8.863  -3.757
  191   2HG2  ILE  25          2HG2      ILE  25   3.622  -9.670  -5.181
  192   3HG2  ILE  25          3HG2      ILE  25   4.224 -10.624  -3.825
  193   1HD1  ILE  25          1HD1      ILE  25   3.320  -7.112  -3.632
  194   2HD1  ILE  25          2HD1      ILE  25   2.341  -7.236  -2.171
  195   3HD1  ILE  25          3HD1      ILE  25   1.769  -6.278  -3.537
  196    H    ILE  26           H        ILE  26   2.212 -13.178  -4.760
  197    HA   ILE  26           HA       ILE  26   2.496 -14.284  -2.056
  198    HB   ILE  26           HB       ILE  26   2.384 -16.532  -3.048
  199   1HG1  ILE  26          1HG1      ILE  26   3.155 -15.802  -5.371
  200   2HG1  ILE  26          2HG1      ILE  26   1.814 -16.938  -5.338
  201   1HG2  ILE  26          1HG2      ILE  26   0.353 -15.518  -2.170
  202   2HG2  ILE  26          2HG2      ILE  26  -0.040 -16.487  -3.591
  203   3HG2  ILE  26          3HG2      ILE  26   0.037 -14.731  -3.715
  204   1HD1  ILE  26          1HD1      ILE  26   1.512 -15.220  -7.030
  205   2HD1  ILE  26          2HD1      ILE  26   1.592 -13.971  -5.787
  206   3HD1  ILE  26          3HD1      ILE  26   0.260 -15.125  -5.792
  207    H    GLU  27           H        GLU  27   4.102 -13.748  -5.116
  208    HA   GLU  27           HA       GLU  27   6.585 -14.772  -3.913
  209   1HB   GLU  27          1HB       GLU  27   5.908 -14.392  -6.838
  210   2HB   GLU  27          2HB       GLU  27   7.447 -14.974  -6.217
  211   1HG   GLU  27          1HG       GLU  27   4.817 -16.363  -5.768
  212   2HG   GLU  27          2HG       GLU  27   5.929 -16.748  -7.079
  213    H    VAL  28           H        VAL  28   7.422 -13.093  -2.905
  214    HA   VAL  28           HA       VAL  28   7.468 -10.475  -4.239
  215    HB   VAL  28           HB       VAL  28   8.007 -11.038  -1.325
  216   1HG1  VAL  28          1HG1      VAL  28   7.290  -8.504  -2.791
  217   2HG1  VAL  28          2HG1      VAL  28   8.871  -8.916  -2.128
  218   3HG1  VAL  28          3HG1      VAL  28   7.502  -8.656  -1.047
  219   1HG2  VAL  28          1HG2      VAL  28   5.761 -11.793  -1.853
  220   2HG2  VAL  28          2HG2      VAL  28   5.405 -10.244  -2.619
  221   3HG2  VAL  28          3HG2      VAL  28   5.709 -10.321  -0.882
  222    H    ARG  29           H        ARG  29   9.456  -9.405  -4.526
  223    HA   ARG  29           HA       ARG  29  11.846 -10.937  -4.479
  224   1HB   ARG  29          1HB       ARG  29  11.280  -8.015  -4.870
  225   2HB   ARG  29          2HB       ARG  29  12.930  -8.598  -4.727
  226   1HG   ARG  29          1HG       ARG  29  12.184 -10.238  -6.631
  227   2HG   ARG  29          2HG       ARG  29  10.956  -8.999  -6.913
  228   1HD   ARG  29          1HD       ARG  29  12.930  -8.576  -8.279
  229   2HD   ARG  29          2HD       ARG  29  12.713  -7.298  -7.080
  230    HE   ARG  29           HE       ARG  29  14.716  -9.464  -6.929
  231   1HH1  ARG  29          1HH1      ARG  29  13.616  -6.250  -6.065
  232   2HH1  ARG  29          2HH1      ARG  29  15.022  -5.882  -5.109
  233   1HH2  ARG  29          1HH2      ARG  29  16.596  -8.963  -5.715
  234   2HH2  ARG  29          2HH2      ARG  29  16.725  -7.416  -4.931
  235    H    SER  30           H        SER  30  10.347  -8.671  -2.287
  236    HA   SER  30           HA       SER  30  10.823  -7.938  -0.208
  237   1HB   SER  30          1HB       SER  30  12.249 -10.604  -0.130
  238   2HB   SER  30          2HB       SER  30  12.036  -9.575   1.288
  239    HG   SER  30           HG       SER  30   9.728  -9.663   0.764
  240    H    ALA  31           H        ALA  31  13.178  -8.271   1.360
  241    HA   ALA  31           HA       ALA  31  15.196  -7.340   1.753
  242   1HB   ALA  31          1HB       ALA  31  16.866  -7.271  -0.019
  243   2HB   ALA  31          2HB       ALA  31  15.615  -7.571  -1.225
  244   3HB   ALA  31          3HB       ALA  31  16.000  -8.808  -0.028
  245    H    ASP  32           H        ASP  32  15.022  -5.832  -1.426
  246    HA   ASP  32           HA       ASP  32  14.975  -3.221  -0.120
  247   1HB   ASP  32          1HB       ASP  32  15.604  -2.312  -2.297
  248   2HB   ASP  32          2HB       ASP  32  16.679  -3.634  -1.861
  249    H    GLY  33           H        GLY  33  12.996  -5.316  -2.049
  250   1HA   GLY  33          1HA       GLY  33  10.699  -5.210  -2.351
  251   2HA   GLY  33          2HA       GLY  33  10.696  -3.658  -1.529
  252    H    SER  34           H        SER  34  11.168  -5.272  -4.599
  253    HA   SER  34           HA       SER  34  10.147  -2.986  -5.993
  254   1HB   SER  34          1HB       SER  34  12.152  -2.800  -7.508
  255   2HB   SER  34          2HB       SER  34  12.442  -2.251  -5.858
  256    HG   SER  34           HG       SER  34  13.827  -3.814  -5.565
  257    HA   PRO  35           HA       PRO  35   8.825  -6.060  -8.960
  258   1HB   PRO  35          1HB       PRO  35   9.879  -4.289 -11.100
  259   2HB   PRO  35          2HB       PRO  35   8.251  -4.938 -10.877
  260   1HG   PRO  35          1HG       PRO  35   8.776  -2.373 -10.383
  261   2HG   PRO  35          2HG       PRO  35   7.661  -3.292  -9.354
  262   1HD   PRO  35          1HD       PRO  35  10.502  -2.504  -8.845
  263   2HD   PRO  35          2HD       PRO  35   9.123  -2.544  -7.726
  264    HA   PRO  36           HA       PRO  36   8.683  -6.971 -11.268
  265   1HB   PRO  36          1HB       PRO  36   9.255  -9.801 -11.542
  266   2HB   PRO  36          2HB       PRO  36   8.997  -8.598 -12.805
  267   1HG   PRO  36          1HG       PRO  36  11.403  -9.789 -12.326
  268   2HG   PRO  36          2HG       PRO  36  11.232  -8.171 -13.031
  269   1HD   PRO  36          1HD       PRO  36  11.876  -8.961 -10.216
  270   2HD   PRO  36          2HD       PRO  36  12.546  -7.641 -11.200
  271    H    TYR  37           H        TYR  37   6.769  -7.810 -10.475
  272    HA   TYR  37           HA       TYR  37   6.994  -9.375  -7.983
  273   1HB   TYR  37          1HB       TYR  37   4.912  -7.402  -8.905
  274   2HB   TYR  37          2HB       TYR  37   4.606  -8.547  -7.602
  275    HD1  TYR  37           HD1      TYR  37   6.221  -8.505  -5.603
  276    HD2  TYR  37           HD2      TYR  37   5.947  -5.354  -8.450
  277    HE1  TYR  37           HE1      TYR  37   7.258  -6.966  -3.990
  278    HE2  TYR  37           HE2      TYR  37   6.984  -3.807  -6.844
  279    HH   TYR  37           HH       TYR  37   7.297  -3.594  -4.431
  280    H    VAL  38           H        VAL  38   5.919 -11.299  -7.819
  281    HA   VAL  38           HA       VAL  38   4.613 -12.206 -10.285
  282    HB   VAL  38           HB       VAL  38   5.439 -13.845  -7.873
  283   1HG1  VAL  38          1HG1      VAL  38   4.489 -14.702 -10.606
  284   2HG1  VAL  38          2HG1      VAL  38   3.572 -14.825  -9.103
  285   3HG1  VAL  38          3HG1      VAL  38   5.042 -15.777  -9.323
  286   1HG2  VAL  38          1HG2      VAL  38   7.253 -14.681  -9.293
  287   2HG2  VAL  38          2HG2      VAL  38   7.383 -12.941  -9.031
  288   3HG2  VAL  38          3HG2      VAL  38   6.769 -13.559 -10.565
  289    H    VAL  39           H        VAL  39   2.600 -11.623 -10.293
  290    HA   VAL  39           HA       VAL  39   1.164 -11.484  -7.745
  291    HB   VAL  39           HB       VAL  39   1.716  -9.490  -9.626
  292   1HG1  VAL  39          1HG1      VAL  39  -1.215 -10.173  -9.725
  293   2HG1  VAL  39          2HG1      VAL  39  -0.074 -10.262 -11.067
  294   3HG1  VAL  39          3HG1      VAL  39  -0.478  -8.699 -10.354
  295   1HG2  VAL  39          1HG2      VAL  39   0.363  -8.080  -8.145
  296   2HG2  VAL  39          2HG2      VAL  39   1.455  -9.147  -7.261
  297   3HG2  VAL  39          3HG2      VAL  39  -0.265  -9.530  -7.361
  298    H    ARG  40           H        ARG  40  -0.908 -12.262  -7.629
  299    HA   ARG  40           HA       ARG  40  -1.745 -13.859  -9.954
  300   1HB   ARG  40          1HB       ARG  40  -0.805 -15.164  -8.026
  301   2HB   ARG  40          2HB       ARG  40  -2.145 -14.574  -7.052
  302   1HG   ARG  40          1HG       ARG  40  -3.723 -15.663  -8.569
  303   2HG   ARG  40          2HG       ARG  40  -2.369 -16.271  -9.528
  304   1HD   ARG  40          1HD       ARG  40  -1.525 -17.416  -7.491
  305   2HD   ARG  40          2HD       ARG  40  -2.989 -16.910  -6.650
  306    HE   ARG  40           HE       ARG  40  -3.400 -18.399  -9.111
  307   1HH1  ARG  40          1HH1      ARG  40  -3.139 -18.479  -5.611
  308   2HH1  ARG  40          2HH1      ARG  40  -3.900 -20.039  -5.465
  309   1HH2  ARG  40          1HH2      ARG  40  -4.432 -20.426  -8.921
  310   2HH2  ARG  40          2HH2      ARG  40  -4.663 -21.134  -7.348
  311    H    TRP  41           H        TRP  41  -3.707 -13.438 -10.702
  312    HA   TRP  41           HA       TRP  41  -5.504 -11.704  -9.245
  313   1HB   TRP  41          1HB       TRP  41  -6.281 -13.245 -11.712
  314   2HB   TRP  41          2HB       TRP  41  -6.817 -11.652 -11.194
  315    HD1  TRP  41           HD1      TRP  41  -4.468 -13.312 -13.509
  316    HE1  TRP  41           HE1      TRP  41  -2.877 -11.604 -14.582
  317    HE3  TRP  41           HE3      TRP  41  -5.435  -9.299 -10.492
  318    HZ2  TRP  41           HZ2      TRP  41  -2.134  -8.912 -14.210
  319    HZ3  TRP  41           HZ3      TRP  41  -4.238  -7.193 -10.922
  320    HH2  TRP  41           HH2      TRP  41  -2.624  -7.005 -12.741
  321    H    LEU  42           H        LEU  42  -6.398 -12.661  -7.505
  322    HA   LEU  42           HA       LEU  42  -6.748 -15.526  -7.408
  323   1HB   LEU  42          1HB       LEU  42  -7.798 -13.520  -5.429
  324   2HB   LEU  42          2HB       LEU  42  -7.498 -15.224  -5.165
  325    HG   LEU  42           HG       LEU  42  -5.517 -12.990  -5.382
  326   1HD1  LEU  42          1HD1      LEU  42  -4.804 -13.881  -3.237
  327   2HD1  LEU  42          2HD1      LEU  42  -6.023 -15.150  -3.355
  328   3HD1  LEU  42          3HD1      LEU  42  -6.517 -13.462  -3.223
  329   1HD2  LEU  42          1HD2      LEU  42  -4.680 -14.784  -6.812
  330   2HD2  LEU  42          2HD2      LEU  42  -4.913 -15.943  -5.501
  331   3HD2  LEU  42          3HD2      LEU  42  -3.729 -14.646  -5.333
  332    H    VAL  43           H        VAL  43  -8.943 -12.758  -7.163
  333    HA   VAL  43           HA       VAL  43 -11.224 -14.480  -7.067
  334    HB   VAL  43           HB       VAL  43 -12.410 -12.166  -7.133
  335   1HG1  VAL  43          1HG1      VAL  43 -10.621 -12.995  -4.862
  336   2HG1  VAL  43          2HG1      VAL  43 -12.238 -13.620  -5.188
  337   3HG1  VAL  43          3HG1      VAL  43 -12.020 -11.929  -4.731
  338   1HG2  VAL  43          1HG2      VAL  43  -9.590 -11.353  -6.434
  339   2HG2  VAL  43          2HG2      VAL  43 -11.020 -10.335  -6.281
  340   3HG2  VAL  43          3HG2      VAL  43 -10.476 -10.856  -7.876
  341    H    ASN  44           H        ASN  44  -9.373 -13.106  -9.502
  342    HA   ASN  44           HA       ASN  44 -11.541 -13.379 -11.428
  343   1HB   ASN  44          1HB       ASN  44  -8.698 -12.394 -11.673
  344   2HB   ASN  44          2HB       ASN  44  -9.678 -12.743 -13.092
  345   1HD2  ASN  44          1HD2      ASN  44  -9.320 -10.703 -10.281
  346   2HD2  ASN  44          2HD2      ASN  44 -10.348  -9.427 -10.850
  347    H    GLY  45           H        GLY  45  -8.306 -14.719 -10.771
  348   1HA   GLY  45          1HA       GLY  45  -8.021 -17.092 -10.627
  349   2HA   GLY  45          2HA       GLY  45  -9.294 -17.283 -11.819
  350    H    HIS  46           H        HIS  46  -6.034 -15.845 -11.495
  351    HA   HIS  46           HA       HIS  46  -4.944 -17.528 -13.480
  352   1HB   HIS  46          1HB       HIS  46  -6.251 -16.036 -14.991
  353   2HB   HIS  46          2HB       HIS  46  -5.313 -14.669 -14.412
  354    HD1  HIS  46           HD1      HIS  46  -3.808 -14.044 -16.301
  355    HD2  HIS  46           HD2      HIS  46  -4.023 -18.160 -15.778
  356    HE1  HIS  46           HE1      HIS  46  -2.171 -15.019 -17.935
  357    HE2  HIS  46           HE2      HIS  46  -2.143 -17.485 -17.419
  358    H    GLU  47           H        GLU  47  -2.715 -17.351 -13.622
  359    HA   GLU  47           HA       GLU  47  -1.478 -15.597 -11.616
  360   1HB   GLU  47          1HB       GLU  47  -0.433 -18.043 -13.058
  361   2HB   GLU  47          2HB       GLU  47   0.551 -17.050 -11.996
  362   1HG   GLU  47          1HG       GLU  47  -0.137 -18.916 -10.737
  363   2HG   GLU  47          2HG       GLU  47  -1.089 -17.549 -10.166
  364    H    THR  48           H        THR  48   0.220 -14.183 -12.139
  365    HA   THR  48           HA       THR  48   1.062 -13.905 -14.901
  366    HB   THR  48           HB       THR  48  -0.475 -11.646 -13.577
  367    HG1  THR  48           HG1      THR  48  -1.318 -13.814 -15.006
  368   1HG2  THR  48          1HG2      THR  48  -0.449 -10.615 -15.798
  369   2HG2  THR  48          2HG2      THR  48   0.524 -11.953 -16.411
  370   3HG2  THR  48          3HG2      THR  48   1.189 -10.862 -15.194
  371    H    THR  49           H        THR  49   2.661 -12.050 -15.091
  372    HA   THR  49           HA       THR  49   3.913 -11.369 -12.515
  373    HB   THR  49           HB       THR  49   5.428 -11.957 -15.074
  374    HG1  THR  49           HG1      THR  49   4.317 -13.682 -13.462
  375   1HG2  THR  49          1HG2      THR  49   6.567 -10.389 -13.586
  376   2HG2  THR  49          2HG2      THR  49   7.397 -11.945 -13.589
  377   3HG2  THR  49          3HG2      THR  49   6.359 -11.501 -12.233
  378    H    VAL  50           H        VAL  50   3.993  -9.182 -12.250
  379    HA   VAL  50           HA       VAL  50   3.717  -7.563 -14.691
  380    HB   VAL  50           HB       VAL  50   2.081  -6.111 -13.553
  381   1HG1  VAL  50          1HG1      VAL  50   1.275  -9.009 -13.752
  382   2HG1  VAL  50          2HG1      VAL  50   1.283  -7.829 -15.063
  383   3HG1  VAL  50          3HG1      VAL  50   0.162  -7.640 -13.714
  384   1HG2  VAL  50          1HG2      VAL  50   0.953  -6.912 -11.524
  385   2HG2  VAL  50          2HG2      VAL  50   2.662  -6.579 -11.244
  386   3HG2  VAL  50          3HG2      VAL  50   2.106  -8.242 -11.422
  387    H    TYR  51           H        TYR  51   4.143  -5.334 -14.465
  388    HA   TYR  51           HA       TYR  51   5.832  -4.568 -12.180
  389   1HB   TYR  51          1HB       TYR  51   5.993  -3.519 -15.024
  390   2HB   TYR  51          2HB       TYR  51   7.027  -3.042 -13.683
  391    HD1  TYR  51           HD1      TYR  51   6.306  -5.649 -16.153
  392    HD2  TYR  51           HD2      TYR  51   8.804  -4.506 -12.906
  393    HE1  TYR  51           HE1      TYR  51   7.892  -7.427 -16.758
  394    HE2  TYR  51           HE2      TYR  51  10.399  -6.279 -13.502
  395    HH   TYR  51           HH       TYR  51  10.410  -7.856 -16.417
  396    HA   PRO  52           HA       PRO  52   2.024  -2.091 -11.872
  397   1HB   PRO  52          1HB       PRO  52   2.523  -1.218  -9.335
  398   2HB   PRO  52          2HB       PRO  52   1.843  -2.808  -9.696
  399   1HG   PRO  52          1HG       PRO  52   4.677  -2.058  -9.077
  400   2HG   PRO  52          2HG       PRO  52   3.723  -3.422  -8.462
  401   1HD   PRO  52          1HD       PRO  52   5.515  -3.726 -10.445
  402   2HD   PRO  52          2HD       PRO  52   4.001  -4.654 -10.404
  403    H    GLY  53           H        GLY  53   1.598   0.123 -11.932
  404   1HA   GLY  53          1HA       GLY  53   3.855   1.743 -12.738
  405   2HA   GLY  53          2HA       GLY  53   2.158   2.175 -12.867
  406    H    SER  54           H        SER  54   4.600   1.554 -10.366
  407    HA   SER  54           HA       SER  54   5.353   2.800  -8.630
  408   1HB   SER  54          1HB       SER  54   3.666   5.045  -9.755
  409   2HB   SER  54          2HB       SER  54   4.996   5.200  -8.608
  410    HG   SER  54           HG       SER  54   5.103   5.189 -11.262
  411    H    ASP  55           H        ASP  55   4.641   3.976  -6.634
  412    HA   ASP  55           HA       ASP  55   3.423   4.025  -4.723
  413   1HB   ASP  55          1HB       ASP  55   1.384   4.596  -6.839
  414   2HB   ASP  55          2HB       ASP  55   0.885   4.459  -5.156
  415    H    ALA  56           H        ALA  56   4.025   1.453  -5.470
  416    HA   ALA  56           HA       ALA  56   1.684  -0.200  -5.395
  417   1HB   ALA  56          1HB       ALA  56   3.696  -0.911  -6.596
  418   2HB   ALA  56          2HB       ALA  56   3.236  -2.073  -5.352
  419   3HB   ALA  56          3HB       ALA  56   4.584  -0.969  -5.074
  420    H    VAL  57           H        VAL  57   0.529  -0.368  -3.598
  421    HA   VAL  57           HA       VAL  57   1.970  -0.668  -1.048
  422    HB   VAL  57           HB       VAL  57   0.902   1.347  -0.765
  423   1HG1  VAL  57          1HG1      VAL  57  -1.545   0.224  -2.109
  424   2HG1  VAL  57          2HG1      VAL  57  -0.414   1.389  -2.797
  425   3HG1  VAL  57          3HG1      VAL  57  -1.422   1.843  -1.422
  426   1HG2  VAL  57          1HG2      VAL  57  -0.952   1.049   0.799
  427   2HG2  VAL  57          2HG2      VAL  57   0.378  -0.064   1.115
  428   3HG2  VAL  57          3HG2      VAL  57  -1.078  -0.639   0.304
  429    H    VAL  58           H        VAL  58   0.890  -1.935   0.560
  430    HA   VAL  58           HA       VAL  58  -0.243  -4.321  -0.695
  431    HB   VAL  58           HB       VAL  58   0.491  -5.266   1.649
  432   1HG1  VAL  58          1HG1      VAL  58   1.316  -6.037  -0.508
  433   2HG1  VAL  58          2HG1      VAL  58   2.641  -5.893   0.647
  434   3HG1  VAL  58          3HG1      VAL  58   2.410  -4.657  -0.589
  435   1HG2  VAL  58          1HG2      VAL  58   2.566  -4.218   2.436
  436   2HG2  VAL  58          2HG2      VAL  58   1.174  -3.148   2.605
  437   3HG2  VAL  58          3HG2      VAL  58   2.317  -2.907   1.284
  438    H    VAL  59           H        VAL  59  -2.393  -4.309  -0.571
  439    HA   VAL  59           HA       VAL  59  -3.735  -3.522   1.882
  440    HB   VAL  59           HB       VAL  59  -5.746  -3.743   0.456
  441   1HG1  VAL  59          1HG1      VAL  59  -5.394  -1.661  -0.771
  442   2HG1  VAL  59          2HG1      VAL  59  -3.659  -1.820  -0.502
  443   3HG1  VAL  59          3HG1      VAL  59  -4.746  -1.576   0.866
  444   1HG2  VAL  59          1HG2      VAL  59  -5.470  -3.801  -1.973
  445   2HG2  VAL  59          2HG2      VAL  59  -4.925  -5.285  -1.192
  446   3HG2  VAL  59          3HG2      VAL  59  -3.745  -4.095  -1.740
  447    H    THR  60           H        THR  60  -5.864  -4.837   2.069
  448    HA   THR  60           HA       THR  60  -5.083  -7.646   2.436
  449    HB   THR  60           HB       THR  60  -6.053  -6.225   4.304
  450    HG1  THR  60           HG1      THR  60  -6.495  -8.170   5.004
  451   1HG2  THR  60          1HG2      THR  60  -8.582  -6.452   2.687
  452   2HG2  THR  60          2HG2      THR  60  -7.696  -4.970   3.054
  453   3HG2  THR  60          3HG2      THR  60  -8.482  -5.871   4.349
  454    H    ALA  61           H        ALA  61  -7.530  -8.847   2.511
  455    HA   ALA  61           HA       ALA  61  -7.751  -9.638  -0.180
  456   1HB   ALA  61          1HB       ALA  61  -9.603 -10.285   2.104
  457   2HB   ALA  61          2HB       ALA  61  -8.107 -11.137   1.723
  458   3HB   ALA  61          3HB       ALA  61  -9.455 -11.172   0.588
  459    H    THR  62           H        THR  62 -10.065  -7.817   1.859
  460    HA   THR  62           HA       THR  62 -12.068  -7.825  -0.173
  461    HB   THR  62           HB       THR  62 -13.001  -5.942   1.346
  462    HG1  THR  62           HG1      THR  62 -12.028  -5.731   3.295
  463   1HG2  THR  62          1HG2      THR  62 -12.672  -8.769   2.350
  464   2HG2  THR  62          2HG2      THR  62 -13.909  -8.210   1.225
  465   3HG2  THR  62          3HG2      THR  62 -13.901  -7.624   2.888
  466    H    GLU  63           H        GLU  63  -9.724  -5.465   0.982
  467    HA   GLU  63           HA       GLU  63 -10.467  -3.234  -0.509
  468   1HB   GLU  63          1HB       GLU  63  -8.347  -3.985   1.140
  469   2HB   GLU  63          2HB       GLU  63  -7.580  -3.634  -0.400
  470   1HG   GLU  63          1HG       GLU  63  -9.358  -1.773   1.149
  471   2HG   GLU  63          2HG       GLU  63  -7.600  -1.706   1.080
  472    H    HIS  64           H        HIS  64  -8.976  -6.188  -1.407
  473    HA   HIS  64           HA       HIS  64  -7.750  -5.199  -3.795
  474   1HB   HIS  64          1HB       HIS  64  -6.391  -6.896  -3.408
  475   2HB   HIS  64          2HB       HIS  64  -7.398  -7.386  -2.058
  476    HD1  HIS  64           HD1      HIS  64  -8.965  -9.409  -2.414
  477    HD2  HIS  64           HD2      HIS  64  -6.686  -8.404  -5.744
  478    HE1  HIS  64           HE1      HIS  64  -9.130 -11.379  -3.971
  479    HE2  HIS  64           HE2      HIS  64  -7.700 -10.763  -5.964
  480    H    ALA  65           H        ALA  65 -10.670  -7.185  -3.164
  481    HA   ALA  65           HA       ALA  65 -10.588  -8.715  -5.462
  482   1HB   ALA  65          1HB       ALA  65 -12.062  -9.151  -3.564
  483   2HB   ALA  65          2HB       ALA  65 -12.936  -9.184  -5.095
  484   3HB   ALA  65          3HB       ALA  65 -13.068  -7.782  -4.035
  485    H    GLU  66           H        GLU  66 -12.610  -5.855  -5.035
  486    HA   GLU  66           HA       GLU  66 -13.770  -5.795  -7.556
  487   1HB   GLU  66          1HB       GLU  66 -13.230  -3.133  -6.464
  488   2HB   GLU  66          2HB       GLU  66 -14.766  -3.915  -6.793
  489   1HG   GLU  66          1HG       GLU  66 -14.659  -5.073  -4.641
  490   2HG   GLU  66          2HG       GLU  66 -13.082  -4.351  -4.318
  491    H    ALA  67           H        ALA  67 -10.997  -3.982  -6.362
  492    HA   ALA  67           HA       ALA  67 -10.336  -2.808  -8.835
  493   1HB   ALA  67          1HB       ALA  67  -8.350  -2.013  -7.733
  494   2HB   ALA  67          2HB       ALA  67  -8.605  -3.142  -6.403
  495   3HB   ALA  67          3HB       ALA  67  -9.750  -1.828  -6.677
  496    H    GLU  68           H        GLU  68  -9.693  -5.976  -7.616
  497    HA   GLU  68           HA       GLU  68  -7.319  -6.447  -9.136
  498   1HB   GLU  68          1HB       GLU  68  -7.979  -7.944  -7.259
  499   2HB   GLU  68          2HB       GLU  68  -9.339  -8.512  -8.223
  500   1HG   GLU  68          1HG       GLU  68  -7.632  -9.162  -9.983
  501   2HG   GLU  68          2HG       GLU  68  -6.404  -8.876  -8.755
  502    H    LYS  69           H        LYS  69 -10.777  -7.020  -9.679
  503    HA   LYS  69           HA       LYS  69 -10.558  -8.035 -12.289
  504   1HB   LYS  69          1HB       LYS  69 -12.691  -6.262 -11.078
  505   2HB   LYS  69          2HB       LYS  69 -12.841  -7.040 -12.649
  506   1HG   LYS  69          1HG       LYS  69 -12.585  -9.235 -11.535
  507   2HG   LYS  69          2HG       LYS  69 -12.572  -8.403  -9.978
  508   1HD   LYS  69          1HD       LYS  69 -14.807  -7.582 -10.347
  509   2HD   LYS  69          2HD       LYS  69 -14.823  -8.245 -11.982
  510   1HE   LYS  69          1HE       LYS  69 -14.585 -10.512 -11.026
  511   2HE   LYS  69          2HE       LYS  69 -14.666  -9.814  -9.410
  512   1HZ   LYS  69          1HZ       LYS  69 -16.889  -9.118  -9.779
  513   2HZ   LYS  69          2HZ       LYS  69 -16.800 -10.738 -10.280
  514   3HZ   LYS  69          3HZ       LYS  69 -16.815  -9.495 -11.433
  515    H    ARG  70           H        ARG  70 -10.806  -4.700 -11.133
  516    HA   ARG  70           HA       ARG  70 -10.477  -3.411 -13.618
  517   1HB   ARG  70          1HB       ARG  70  -9.695  -2.520 -10.840
  518   2HB   ARG  70          2HB       ARG  70  -9.729  -1.468 -12.248
  519   1HG   ARG  70          1HG       ARG  70 -12.103  -1.755 -12.472
  520   2HG   ARG  70          2HG       ARG  70 -12.118  -2.953 -11.176
  521   1HD   ARG  70          1HD       ARG  70 -12.863  -0.655 -10.505
  522   2HD   ARG  70          2HD       ARG  70 -11.534  -1.315  -9.551
  523    HE   ARG  70           HE       ARG  70 -10.025   0.101 -10.838
  524   1HH1  ARG  70          1HH1      ARG  70 -13.439   0.873 -10.916
  525   2HH1  ARG  70          2HH1      ARG  70 -13.182   2.541 -11.350
  526   1HH2  ARG  70          1HH2      ARG  70  -9.675   2.251 -11.474
  527   2HH2  ARG  70          2HH2      ARG  70 -11.038   3.309 -11.717
  528    H    ALA  71           H        ALA  71  -8.202  -5.063 -11.639
  529    HA   ALA  71           HA       ALA  71  -5.873  -3.667 -12.596
  530   1HB   ALA  71          1HB       ALA  71  -5.960  -4.538 -10.321
  531   2HB   ALA  71          2HB       ALA  71  -4.623  -5.237 -11.234
  532   3HB   ALA  71          3HB       ALA  71  -6.089  -6.177 -10.956
  533    H    ALA  72           H        ALA  72  -7.171  -6.977 -12.931
  534    HA   ALA  72           HA       ALA  72  -5.270  -7.818 -14.818
  535   1HB   ALA  72          1HB       ALA  72  -6.867  -9.556 -15.438
  536   2HB   ALA  72          2HB       ALA  72  -8.139  -8.711 -14.553
  537   3HB   ALA  72          3HB       ALA  72  -6.757  -9.384 -13.686
  538    H    ALA  73           H        ALA  73  -8.038  -5.756 -15.048
  539    HA   ALA  73           HA       ALA  73  -8.251  -5.721 -17.879
  540   1HB   ALA  73          1HB       ALA  73  -8.999  -3.582 -15.892
  541   2HB   ALA  73          2HB       ALA  73 -10.032  -4.916 -16.408
  542   3HB   ALA  73          3HB       ALA  73  -9.539  -3.682 -17.567
  543    H    ARG  74           H        ARG  74  -6.837  -3.233 -15.697
  544    HA   ARG  74           HA       ARG  74  -5.587  -1.971 -17.973
  545   1HB   ARG  74          1HB       ARG  74  -5.566  -1.236 -15.048
  546   2HB   ARG  74          2HB       ARG  74  -4.798  -0.285 -16.314
  547   1HG   ARG  74          1HG       ARG  74  -7.165  -0.348 -17.407
  548   2HG   ARG  74          2HG       ARG  74  -7.697  -0.716 -15.765
  549   1HD   ARG  74          1HD       ARG  74  -5.965   1.645 -16.467
  550   2HD   ARG  74          2HD       ARG  74  -7.723   1.719 -16.408
  551    HE   ARG  74           HE       ARG  74  -7.230   0.831 -13.973
  552   1HH1  ARG  74          1HH1      ARG  74  -5.521   3.269 -15.793
  553   2HH1  ARG  74          2HH1      ARG  74  -5.154   4.256 -14.409
  554   1HH2  ARG  74          1HH2      ARG  74  -6.768   2.112 -12.122
  555   2HH2  ARG  74          2HH2      ARG  74  -5.834   3.576 -12.309
  556    H    ALA  75           H        ALA  75  -4.280  -3.268 -14.898
  557    HA   ALA  75           HA       ALA  75  -1.578  -2.693 -15.331
  558   1HB   ALA  75          1HB       ALA  75  -1.093  -4.366 -13.657
  559   2HB   ALA  75          2HB       ALA  75  -2.712  -5.043 -13.825
  560   3HB   ALA  75          3HB       ALA  75  -2.499  -3.413 -13.186
  561    H    GLY  76           H        GLY  76  -3.361  -5.682 -16.111
  562   1HA   GLY  76          1HA       GLY  76  -0.939  -6.703 -17.424
  563   2HA   GLY  76          2HA       GLY  76  -2.305  -7.674 -16.901
  564    H    HIS  77           H        HIS  77  -2.978  -4.725 -18.571
  565    HA   HIS  77           HA       HIS  77  -4.313  -6.114 -20.671
  566   1HB   HIS  77          1HB       HIS  77  -4.902  -3.807 -19.779
  567   2HB   HIS  77          2HB       HIS  77  -3.526  -3.197 -20.690
  568    HD1  HIS  77           HD1      HIS  77  -4.596  -1.924 -22.543
  569    HD2  HIS  77           HD2      HIS  77  -6.309  -5.680 -22.012
  570    HE1  HIS  77           HE1      HIS  77  -6.231  -2.203 -24.438
  571    HE2  HIS  77           HE2      HIS  77  -7.397  -4.390 -23.972
  572    H    ALA  78           H        ALA  78  -1.426  -4.061 -20.600
  573    HA   ALA  78           HA       ALA  78  -0.289  -5.664 -22.761
  574   1HB   ALA  78          1HB       ALA  78   0.469  -3.675 -23.960
  575   2HB   ALA  78          2HB       ALA  78  -0.370  -2.647 -22.799
  576   3HB   ALA  78          3HB       ALA  78  -1.291  -3.718 -23.855
  577    H    ALA  79           H        ALA  79   0.975  -6.556 -21.088
  578    HA   ALA  79           HA       ALA  79   2.816  -4.771 -19.682
  579   1HB   ALA  79          1HB       ALA  79   1.689  -6.534 -18.403
  580   2HB   ALA  79          2HB       ALA  79   3.441  -6.744 -18.392
  581   3HB   ALA  79          3HB       ALA  79   2.438  -7.756 -19.432
  582    H    THR  80           H        THR  80   2.856  -7.495 -21.926
  583    HA   THR  80           HA       THR  80   5.689  -6.976 -22.472
  584    HB   THR  80           HB       THR  80   4.038  -9.366 -23.325
  585    HG1  THR  80           HG1      THR  80   6.017  -9.618 -21.369
  586   1HG2  THR  80          1HG2      THR  80   6.225 -10.401 -23.742
  587   2HG2  THR  80          2HG2      THR  80   7.025  -8.899 -23.276
  588   3HG2  THR  80          3HG2      THR  80   6.012  -8.948 -24.718
  Start of MODEL   11
    1    H    MET   1           H        MET   1  11.019   0.499   2.502
    2    HA   MET   1           HA       MET   1   8.716   0.665   1.840
    3   1HB   MET   1          1HB       MET   1   9.025   0.811  -0.564
    4   2HB   MET   1          2HB       MET   1   9.718  -0.804  -0.611
    5   1HG   MET   1          1HG       MET   1   7.505  -1.666   0.204
    6   2HG   MET   1          2HG       MET   1   6.865  -0.043  -0.045
    7   1HE   MET   1          1HE       MET   1   5.409  -2.271  -2.980
    8   2HE   MET   1          2HE       MET   1   5.003  -1.302  -1.564
    9   3HE   MET   1          3HE       MET   1   5.828  -2.847  -1.366
   10    H    HIS   2           H        HIS   2   7.242  -1.079   2.347
   11    HA   HIS   2           HA       HIS   2   8.594  -3.628   2.928
   12   1HB   HIS   2          1HB       HIS   2   7.009  -3.977   4.804
   13   2HB   HIS   2          2HB       HIS   2   8.047  -2.581   5.047
   14    HD1  HIS   2           HD1      HIS   2   6.932  -0.277   5.155
   15    HD2  HIS   2           HD2      HIS   2   4.266  -3.396   4.475
   16    HE1  HIS   2           HE1      HIS   2   4.644   0.698   5.513
   17    HE2  HIS   2           HE2      HIS   2   3.037  -1.172   4.981
   18    H    ALA   3           H        ALA   3   7.862  -5.304   1.862
   19    HA   ALA   3           HA       ALA   3   5.123  -5.200   0.765
   20   1HB   ALA   3          1HB       ALA   3   7.564  -6.471  -0.473
   21   2HB   ALA   3          2HB       ALA   3   6.773  -4.992  -1.018
   22   3HB   ALA   3          3HB       ALA   3   5.926  -6.534  -1.126
   23    H    LYS   4           H        LYS   4   3.995  -7.226   0.699
   24    HA   LYS   4           HA       LYS   4   5.181  -9.329   2.360
   25   1HB   LYS   4          1HB       LYS   4   3.728  -7.776   3.737
   26   2HB   LYS   4          2HB       LYS   4   2.363  -8.326   2.775
   27   1HG   LYS   4          1HG       LYS   4   3.303 -10.699   3.522
   28   2HG   LYS   4          2HG       LYS   4   3.897  -9.735   4.877
   29   1HD   LYS   4          1HD       LYS   4   1.045  -9.955   3.929
   30   2HD   LYS   4          2HD       LYS   4   1.722 -10.645   5.403
   31   1HE   LYS   4          1HE       LYS   4   2.107  -8.459   6.316
   32   2HE   LYS   4          2HE       LYS   4   1.641  -7.696   4.795
   33   1HZ   LYS   4          1HZ       LYS   4  -0.163  -7.594   6.369
   34   2HZ   LYS   4          2HZ       LYS   4  -0.137  -9.276   6.577
   35   3HZ   LYS   4          3HZ       LYS   4  -0.589  -8.610   5.079
   36    H    VAL   5           H        VAL   5   4.488 -11.377   1.922
   37    HA   VAL   5           HA       VAL   5   2.903 -11.777  -0.482
   38    HB   VAL   5           HB       VAL   5   4.875 -13.147  -0.341
   39   1HG1  VAL   5          1HG1      VAL   5   5.270 -14.718   1.508
   40   2HG1  VAL   5          2HG1      VAL   5   3.864 -14.062   2.349
   41   3HG1  VAL   5          3HG1      VAL   5   5.269 -13.038   2.048
   42   1HG2  VAL   5          1HG2      VAL   5   3.954 -15.409  -0.429
   43   2HG2  VAL   5          2HG2      VAL   5   2.917 -14.260  -1.275
   44   3HG2  VAL   5          3HG2      VAL   5   2.470 -14.837   0.331
   45    H    GLY   6           H        GLY   6   0.872 -12.663  -0.501
   46   1HA   GLY   6          1HA       GLY   6  -1.024 -13.723   0.506
   47   2HA   GLY   6          2HA       GLY   6  -0.350 -13.354   2.090
   48    H    ASP   7           H        ASP   7   0.140 -10.773   0.187
   49    HA   ASP   7           HA       ASP   7  -2.395  -9.402   1.002
   50   1HB   ASP   7          1HB       ASP   7   0.453  -8.646   1.391
   51   2HB   ASP   7          2HB       ASP   7  -0.574  -7.375   0.741
   52    H    TYR   8           H        TYR   8  -2.529  -7.327  -0.408
   53    HA   TYR   8           HA       TYR   8  -2.193  -8.328  -3.149
   54   1HB   TYR   8          1HB       TYR   8  -4.365  -6.585  -1.981
   55   2HB   TYR   8          2HB       TYR   8  -4.241  -7.029  -3.685
   56    HD1  TYR   8           HD1      TYR   8  -4.761  -9.243  -4.431
   57    HD2  TYR   8           HD2      TYR   8  -4.925  -8.296  -0.294
   58    HE1  TYR   8           HE1      TYR   8  -5.910 -11.370  -3.998
   59    HE2  TYR   8           HE2      TYR   8  -6.073 -10.430   0.149
   60    HH   TYR   8           HH       TYR   8  -6.146 -12.945  -2.030
   61    H    LEU   9           H        LEU   9  -2.075  -6.681  -4.847
   62    HA   LEU   9           HA       LEU   9  -0.278  -4.527  -3.980
   63   1HB   LEU   9          1HB       LEU   9   0.644  -6.303  -5.462
   64   2HB   LEU   9          2HB       LEU   9  -0.531  -5.863  -6.681
   65    HG   LEU   9           HG       LEU   9   1.355  -3.760  -5.704
   66   1HD1  LEU   9          1HD1      LEU   9   2.052  -5.919  -7.692
   67   2HD1  LEU   9          2HD1      LEU   9   2.795  -5.681  -6.109
   68   3HD1  LEU   9          3HD1      LEU   9   3.003  -4.468  -7.373
   69   1HD2  LEU   9          1HD2      LEU   9   0.154  -4.404  -8.397
   70   2HD2  LEU   9          2HD2      LEU   9   1.159  -3.005  -8.020
   71   3HD2  LEU   9          3HD2      LEU   9  -0.430  -3.176  -7.275
   72    H    VAL  10           H        VAL  10  -0.737  -2.477  -4.431
   73    HA   VAL  10           HA       VAL  10  -2.714  -1.817  -6.497
   74    HB   VAL  10           HB       VAL  10  -2.697  -0.848  -3.638
   75   1HG1  VAL  10          1HG1      VAL  10  -2.617   1.166  -5.018
   76   2HG1  VAL  10          2HG1      VAL  10  -4.201   0.974  -4.267
   77   3HG1  VAL  10          3HG1      VAL  10  -3.979   0.574  -5.970
   78   1HG2  VAL  10          1HG2      VAL  10  -4.893  -1.740  -5.498
   79   2HG2  VAL  10          2HG2      VAL  10  -5.109  -1.227  -3.824
   80   3HG2  VAL  10          3HG2      VAL  10  -4.185  -2.685  -4.188
   81    H    VAL  11           H        VAL  11  -2.239   0.159  -7.583
   82    HA   VAL  11           HA       VAL  11   0.252   1.484  -6.734
   83    HB   VAL  11           HB       VAL  11  -0.608   0.952  -9.589
   84   1HG1  VAL  11          1HG1      VAL  11   0.455   3.130  -9.393
   85   2HG1  VAL  11          2HG1      VAL  11   1.512   1.995 -10.231
   86   3HG1  VAL  11          3HG1      VAL  11   1.820   2.405  -8.543
   87   1HG2  VAL  11          1HG2      VAL  11   0.309  -1.020  -8.492
   88   2HG2  VAL  11          2HG2      VAL  11   1.735  -0.103  -8.005
   89   3HG2  VAL  11          3HG2      VAL  11   1.422  -0.408  -9.715
   90    H    LYS  12           H        LYS  12   0.297   3.696  -6.851
   91    HA   LYS  12           HA       LYS  12  -2.231   5.058  -6.967
   92   1HB   LYS  12          1HB       LYS  12   0.552   6.224  -6.775
   93   2HB   LYS  12          2HB       LYS  12  -0.954   7.062  -6.437
   94   1HG   LYS  12          1HG       LYS  12  -1.337   5.765  -4.485
   95   2HG   LYS  12          2HG       LYS  12  -0.017   4.661  -4.889
   96   1HD   LYS  12          1HD       LYS  12   1.535   6.630  -4.749
   97   2HD   LYS  12          2HD       LYS  12   0.184   7.560  -4.102
   98   1HE   LYS  12          1HE       LYS  12   0.143   6.369  -2.123
   99   2HE   LYS  12          2HE       LYS  12   0.949   4.968  -2.830
  100   1HZ   LYS  12          1HZ       LYS  12   2.382   6.283  -1.318
  101   2HZ   LYS  12          2HZ       LYS  12   2.269   7.589  -2.390
  102   3HZ   LYS  12          3HZ       LYS  12   3.000   6.147  -2.890
  103    H    GLY  13           H        GLY  13  -2.713   4.445  -9.222
  104   1HA   GLY  13          1HA       GLY  13  -1.174   5.710 -11.317
  105   2HA   GLY  13          2HA       GLY  13  -2.691   4.840 -11.512
  106    H    THR  14           H        THR  14  -1.220   7.913 -10.718
  107    HA   THR  14           HA       THR  14  -1.981  10.058 -10.815
  108    HB   THR  14           HB       THR  14  -4.542   8.987 -12.036
  109    HG1  THR  14           HG1      THR  14  -3.020   8.183 -13.395
  110   1HG2  THR  14          1HG2      THR  14  -3.099  11.622 -12.372
  111   2HG2  THR  14          2HG2      THR  14  -4.575  11.366 -11.439
  112   3HG2  THR  14          3HG2      THR  14  -4.589  11.148 -13.189
  113    H    THR  15           H        THR  15  -4.131  11.382 -10.014
  114    HA   THR  15           HA       THR  15  -4.738  10.418  -7.390
  115    HB   THR  15           HB       THR  15  -6.177  12.668  -8.802
  116    HG1  THR  15           HG1      THR  15  -4.505  14.009  -8.253
  117   1HG2  THR  15          1HG2      THR  15  -6.368  13.575  -6.529
  118   2HG2  THR  15          2HG2      THR  15  -5.507  12.172  -5.896
  119   3HG2  THR  15          3HG2      THR  15  -7.093  11.971  -6.641
  120    H    THR  16           H        THR  16  -5.618   8.348  -8.101
  121    HA   THR  16           HA       THR  16  -8.380   8.538  -9.076
  122    HB   THR  16           HB       THR  16  -7.994   5.971  -9.391
  123    HG1  THR  16           HG1      THR  16  -5.372   6.492 -10.004
  124   1HG2  THR  16          1HG2      THR  16  -7.108   6.364 -11.648
  125   2HG2  THR  16          2HG2      THR  16  -6.664   8.007 -11.183
  126   3HG2  THR  16          3HG2      THR  16  -8.363   7.531 -11.231
  127    H    GLU  17           H        GLU  17  -9.932   8.242  -7.642
  128    HA   GLU  17           HA       GLU  17  -9.431   7.379  -4.988
  129   1HB   GLU  17          1HB       GLU  17 -11.532   8.637  -6.330
  130   2HB   GLU  17          2HB       GLU  17 -12.205   7.098  -5.806
  131   1HG   GLU  17          1HG       GLU  17 -10.835   9.103  -4.028
  132   2HG   GLU  17          2HG       GLU  17 -12.576   8.875  -4.170
  133    H    ARG  18           H        ARG  18  -9.941   5.463  -3.982
  134    HA   ARG  18           HA       ARG  18 -10.162   3.211  -3.725
  135   1HB   ARG  18          1HB       ARG  18 -12.047   3.569  -5.509
  136   2HB   ARG  18          2HB       ARG  18 -10.901   2.808  -6.600
  137   1HG   ARG  18          1HG       ARG  18 -10.834   0.834  -5.175
  138   2HG   ARG  18          2HG       ARG  18 -11.968   1.599  -4.057
  139   1HD   ARG  18          1HD       ARG  18 -13.416   1.862  -6.239
  140   2HD   ARG  18          2HD       ARG  18 -12.429   0.511  -6.792
  141    HE   ARG  18           HE       ARG  18 -13.230  -0.519  -4.534
  142   1HH1  ARG  18          1HH1      ARG  18 -15.105   1.406  -6.793
  143   2HH1  ARG  18          2HH1      ARG  18 -16.627   0.765  -6.267
  144   1HH2  ARG  18          1HH2      ARG  18 -15.246  -1.360  -3.859
  145   2HH2  ARG  18          2HH2      ARG  18 -16.713  -0.803  -4.616
  146    H    HIS  19           H        HIS  19  -8.358   4.624  -6.276
  147    HA   HIS  19           HA       HIS  19  -6.221   4.313  -6.980
  148   1HB   HIS  19          1HB       HIS  19  -6.153   2.073  -4.957
  149   2HB   HIS  19          2HB       HIS  19  -4.759   2.658  -5.861
  150    HD1  HIS  19           HD1      HIS  19  -6.159   2.966  -2.658
  151    HD2  HIS  19           HD2      HIS  19  -4.594   5.705  -5.367
  152    HE1  HIS  19           HE1      HIS  19  -5.560   4.994  -1.298
  153    HE2  HIS  19           HE2      HIS  19  -4.737   6.691  -2.976
  154    H    ASP  20           H        ASP  20  -4.772   2.569  -8.066
  155    HA   ASP  20           HA       ASP  20  -6.558   0.772  -9.577
  156   1HB   ASP  20          1HB       ASP  20  -6.009   3.089 -10.649
  157   2HB   ASP  20          2HB       ASP  20  -4.436   2.371 -10.973
  158    H    GLN  21           H        GLN  21  -4.798  -0.248 -11.379
  159    HA   GLN  21           HA       GLN  21  -3.493  -2.101 -11.555
  160   1HB   GLN  21          1HB       GLN  21  -1.634  -0.242 -10.074
  161   2HB   GLN  21          2HB       GLN  21  -1.124  -1.720 -10.881
  162   1HG   GLN  21          1HG       GLN  21  -1.938  -0.827 -13.012
  163   2HG   GLN  21          2HG       GLN  21  -2.415   0.661 -12.200
  164   1HE2  GLN  21          1HE2      GLN  21  -1.076   1.911 -13.465
  165   2HE2  GLN  21          2HE2      GLN  21   0.642   1.903 -13.300
  166    H    HIS  22           H        HIS  22  -4.420  -3.768 -10.444
  167    HA   HIS  22           HA       HIS  22  -3.546  -4.155  -7.664
  168   1HB   HIS  22          1HB       HIS  22  -5.760  -3.082  -7.653
  169   2HB   HIS  22          2HB       HIS  22  -6.393  -4.389  -8.643
  170    HD1  HIS  22           HD1      HIS  22  -6.628  -6.739  -7.468
  171    HD2  HIS  22           HD2      HIS  22  -5.679  -3.575  -4.956
  172    HE1  HIS  22           HE1      HIS  22  -7.091  -7.565  -5.143
  173    HE2  HIS  22           HE2      HIS  22  -6.790  -5.527  -3.691
  174    H    ALA  23           H        ALA  23  -3.355  -6.232  -6.967
  175    HA   ALA  23           HA       ALA  23  -4.388  -8.558  -8.306
  176   1HB   ALA  23          1HB       ALA  23  -2.293  -9.493  -9.061
  177   2HB   ALA  23          2HB       ALA  23  -1.438  -8.020  -8.601
  178   3HB   ALA  23          3HB       ALA  23  -2.630  -7.982  -9.903
  179    H    GLU  24           H        GLU  24  -3.081 -10.525  -7.420
  180    HA   GLU  24           HA       GLU  24  -2.814 -10.123  -4.521
  181   1HB   GLU  24          1HB       GLU  24  -4.443 -11.800  -5.266
  182   2HB   GLU  24          2HB       GLU  24  -3.181 -12.658  -6.136
  183   1HG   GLU  24          1HG       GLU  24  -2.114 -13.310  -4.119
  184   2HG   GLU  24          2HG       GLU  24  -3.126 -12.229  -3.162
  185    H    ILE  25           H        ILE  25  -0.861 -10.168  -3.585
  186    HA   ILE  25           HA       ILE  25   1.428 -10.918  -5.242
  187    HB   ILE  25           HB       ILE  25   1.551  -9.752  -2.463
  188   1HG1  ILE  25          1HG1      ILE  25   1.506  -8.246  -5.090
  189   2HG1  ILE  25          2HG1      ILE  25   0.188  -8.278  -3.923
  190   1HG2  ILE  25          1HG2      ILE  25   3.482  -9.746  -4.784
  191   2HG2  ILE  25          2HG2      ILE  25   3.604 -10.743  -3.334
  192   3HG2  ILE  25          3HG2      ILE  25   3.759  -8.991  -3.214
  193   1HD1  ILE  25          1HD1      ILE  25   1.478  -6.232  -3.744
  194   2HD1  ILE  25          2HD1      ILE  25   2.944  -7.166  -3.445
  195   3HD1  ILE  25          3HD1      ILE  25   1.625  -7.196  -2.274
  196    H    ILE  26           H        ILE  26   1.842 -13.021  -5.212
  197    HA   ILE  26           HA       ILE  26   1.804 -14.413  -2.626
  198    HB   ILE  26           HB       ILE  26   1.646 -16.520  -4.137
  199   1HG1  ILE  26          1HG1      ILE  26   0.133 -15.981  -6.145
  200   2HG1  ILE  26          2HG1      ILE  26   0.719 -14.332  -5.999
  201   1HG2  ILE  26          1HG2      ILE  26  -0.800 -16.397  -4.028
  202   2HG2  ILE  26          2HG2      ILE  26  -0.689 -14.666  -3.709
  203   3HG2  ILE  26          3HG2      ILE  26  -0.039 -15.821  -2.544
  204   1HD1  ILE  26          1HD1      ILE  26   2.996 -15.103  -6.377
  205   2HD1  ILE  26          2HD1      ILE  26   1.929 -15.566  -7.703
  206   3HD1  ILE  26          3HD1      ILE  26   2.417 -16.762  -6.503
  207    H    GLU  27           H        GLU  27   3.838 -13.342  -5.112
  208    HA   GLU  27           HA       GLU  27   6.029 -14.731  -3.766
  209   1HB   GLU  27          1HB       GLU  27   5.498 -14.780  -6.712
  210   2HB   GLU  27          2HB       GLU  27   7.156 -14.805  -6.126
  211   1HG   GLU  27          1HG       GLU  27   6.457 -16.782  -4.697
  212   2HG   GLU  27          2HG       GLU  27   4.991 -16.829  -5.678
  213    H    VAL  28           H        VAL  28   7.084 -13.154  -2.838
  214    HA   VAL  28           HA       VAL  28   7.423 -10.616  -4.268
  215    HB   VAL  28           HB       VAL  28   7.853 -11.198  -1.332
  216   1HG1  VAL  28          1HG1      VAL  28   9.205  -9.339  -2.130
  217   2HG1  VAL  28          2HG1      VAL  28   7.898  -8.754  -1.101
  218   3HG1  VAL  28          3HG1      VAL  28   7.779  -8.594  -2.854
  219   1HG2  VAL  28          1HG2      VAL  28   5.517 -11.420  -1.944
  220   2HG2  VAL  28          2HG2      VAL  28   5.564  -9.855  -2.757
  221   3HG2  VAL  28          3HG2      VAL  28   5.764  -9.947  -1.006
  222    H    ARG  29           H        ARG  29   9.367 -10.066  -5.025
  223    HA   ARG  29           HA       ARG  29  11.514 -11.942  -4.894
  224   1HB   ARG  29          1HB       ARG  29  10.855 -10.479  -6.866
  225   2HB   ARG  29          2HB       ARG  29  11.629  -9.149  -6.018
  226   1HG   ARG  29          1HG       ARG  29  13.758 -10.224  -6.134
  227   2HG   ARG  29          2HG       ARG  29  13.031 -11.706  -6.760
  228   1HD   ARG  29          1HD       ARG  29  13.208  -9.029  -8.140
  229   2HD   ARG  29          2HD       ARG  29  14.022 -10.527  -8.599
  230    HE   ARG  29           HE       ARG  29  11.082 -10.327  -8.623
  231   1HH1  ARG  29          1HH1      ARG  29  14.097 -11.026 -10.265
  232   2HH1  ARG  29          2HH1      ARG  29  13.315 -11.588 -11.716
  233   1HH2  ARG  29          1HH2      ARG  29  10.063 -11.085 -10.489
  234   2HH2  ARG  29          2HH2      ARG  29  11.009 -11.641 -11.839
  235    H    SER  30           H        SER  30  10.833  -8.843  -3.410
  236    HA   SER  30           HA       SER  30  12.995  -9.307  -1.519
  237   1HB   SER  30          1HB       SER  30  14.067  -7.887  -3.181
  238   2HB   SER  30          2HB       SER  30  12.720  -6.751  -3.125
  239    HG   SER  30           HG       SER  30  14.792  -7.180  -1.288
  240    H    ALA  31           H        ALA  31  12.502  -8.615   0.515
  241    HA   ALA  31           HA       ALA  31   9.773  -8.109   1.096
  242   1HB   ALA  31          1HB       ALA  31  11.262  -9.322   2.619
  243   2HB   ALA  31          2HB       ALA  31  10.486  -7.952   3.413
  244   3HB   ALA  31          3HB       ALA  31  12.170  -7.836   2.904
  245    H    ASP  32           H        ASP  32  12.388  -6.051   0.316
  246    HA   ASP  32           HA       ASP  32  11.164  -3.708   1.540
  247   1HB   ASP  32          1HB       ASP  32  13.735  -4.220   1.270
  248   2HB   ASP  32          2HB       ASP  32  13.494  -3.539  -0.335
  249    H    GLY  33           H        GLY  33  10.551  -5.493  -1.098
  250   1HA   GLY  33          1HA       GLY  33   9.011  -5.025  -2.768
  251   2HA   GLY  33          2HA       GLY  33   9.098  -3.324  -2.337
  252    H    SER  34           H        SER  34  10.240  -5.798  -4.411
  253    HA   SER  34           HA       SER  34  11.584  -3.778  -6.036
  254   1HB   SER  34          1HB       SER  34  12.787  -6.479  -5.362
  255   2HB   SER  34          2HB       SER  34  13.445  -5.330  -6.528
  256    HG   SER  34           HG       SER  34  13.520  -3.812  -4.697
  257    HA   PRO  35           HA       PRO  35   8.981  -5.934  -8.981
  258   1HB   PRO  35          1HB       PRO  35   9.898  -3.971 -10.916
  259   2HB   PRO  35          2HB       PRO  35   8.294  -4.152 -10.203
  260   1HG   PRO  35          1HG       PRO  35   9.948  -2.051  -9.676
  261   2HG   PRO  35          2HG       PRO  35   8.732  -2.647  -8.532
  262   1HD   PRO  35          1HD       PRO  35  11.686  -3.140  -8.593
  263   2HD   PRO  35          2HD       PRO  35  10.620  -2.839  -7.203
  264    HA   PRO  36           HA       PRO  36   8.284  -6.420 -10.985
  265   1HB   PRO  36          1HB       PRO  36   7.947  -8.653 -12.427
  266   2HB   PRO  36          2HB       PRO  36   8.574  -7.164 -13.142
  267   1HG   PRO  36          1HG       PRO  36  10.035  -9.629 -12.316
  268   2HG   PRO  36          2HG       PRO  36  10.308  -8.574 -13.712
  269   1HD   PRO  36          1HD       PRO  36  11.753  -8.512 -11.341
  270   2HD   PRO  36          2HD       PRO  36  11.680  -7.200 -12.531
  271    H    TYR  37           H        TYR  37   6.500  -7.891 -10.434
  272    HA   TYR  37           HA       TYR  37   7.245  -9.640  -8.165
  273   1HB   TYR  37          1HB       TYR  37   4.710  -8.078  -8.701
  274   2HB   TYR  37          2HB       TYR  37   4.903  -9.230  -7.385
  275    HD1  TYR  37           HD1      TYR  37   6.260  -8.693  -5.448
  276    HD2  TYR  37           HD2      TYR  37   5.825  -5.916  -8.642
  277    HE1  TYR  37           HE1      TYR  37   7.145  -6.904  -4.009
  278    HE2  TYR  37           HE2      TYR  37   6.710  -4.125  -7.217
  279    HH   TYR  37           HH       TYR  37   6.953  -3.604  -4.853
  280    H    VAL  38           H        VAL  38   6.131 -11.650  -7.944
  281    HA   VAL  38           HA       VAL  38   4.800 -12.541 -10.402
  282    HB   VAL  38           HB       VAL  38   5.731 -14.195  -8.043
  283   1HG1  VAL  38          1HG1      VAL  38   4.489 -15.032 -10.668
  284   2HG1  VAL  38          2HG1      VAL  38   3.730 -15.143  -9.081
  285   3HG1  VAL  38          3HG1      VAL  38   5.144 -16.128  -9.453
  286   1HG2  VAL  38          1HG2      VAL  38   6.783 -13.963 -10.861
  287   2HG2  VAL  38          2HG2      VAL  38   7.371 -15.089  -9.638
  288   3HG2  VAL  38          3HG2      VAL  38   7.570 -13.351  -9.408
  289    H    VAL  39           H        VAL  39   2.723 -12.432 -10.473
  290    HA   VAL  39           HA       VAL  39   1.307 -11.974  -7.946
  291    HB   VAL  39           HB       VAL  39   1.763 -10.220 -10.115
  292   1HG1  VAL  39          1HG1      VAL  39  -0.501  -9.537 -10.738
  293   2HG1  VAL  39          2HG1      VAL  39  -1.158 -10.914  -9.853
  294   3HG1  VAL  39          3HG1      VAL  39  -0.145 -11.180 -11.272
  295   1HG2  VAL  39          1HG2      VAL  39   1.710  -9.577  -7.793
  296   2HG2  VAL  39          2HG2      VAL  39  -0.005  -9.972  -7.695
  297   3HG2  VAL  39          3HG2      VAL  39   0.534  -8.631  -8.706
  298    H    ARG  40           H        ARG  40  -0.825 -12.620  -7.832
  299    HA   ARG  40           HA       ARG  40  -1.751 -14.396  -9.993
  300   1HB   ARG  40          1HB       ARG  40  -1.308 -15.589  -7.886
  301   2HB   ARG  40          2HB       ARG  40  -2.367 -14.480  -7.029
  302   1HG   ARG  40          1HG       ARG  40  -4.246 -15.284  -8.446
  303   2HG   ARG  40          2HG       ARG  40  -3.153 -16.498  -9.115
  304   1HD   ARG  40          1HD       ARG  40  -3.922 -16.183  -6.215
  305   2HD   ARG  40          2HD       ARG  40  -4.491 -17.439  -7.311
  306    HE   ARG  40           HE       ARG  40  -1.924 -17.938  -7.442
  307   1HH1  ARG  40          1HH1      ARG  40  -3.640 -16.840  -4.600
  308   2HH1  ARG  40          2HH1      ARG  40  -2.710 -17.828  -3.508
  309   1HH2  ARG  40          1HH2      ARG  40  -0.668 -19.178  -6.028
  310   2HH2  ARG  40          2HH2      ARG  40  -0.985 -19.140  -4.318
  311    H    TRP  41           H        TRP  41  -3.686 -13.839 -10.937
  312    HA   TRP  41           HA       TRP  41  -5.166 -11.578  -9.951
  313   1HB   TRP  41          1HB       TRP  41  -6.087 -13.714 -11.918
  314   2HB   TRP  41          2HB       TRP  41  -6.802 -12.123 -11.686
  315    HD1  TRP  41           HD1      TRP  41  -5.001 -13.699 -14.225
  316    HE1  TRP  41           HE1      TRP  41  -3.438 -12.127 -15.522
  317    HE3  TRP  41           HE3      TRP  41  -4.741  -9.839 -10.871
  318    HZ2  TRP  41           HZ2      TRP  41  -2.234  -9.612 -15.174
  319    HZ3  TRP  41           HZ3      TRP  41  -3.347  -7.890 -11.437
  320    HH2  TRP  41           HH2      TRP  41  -2.120  -7.782 -13.544
  321    H    LEU  42           H        LEU  42  -5.493 -12.083  -7.901
  322    HA   LEU  42           HA       LEU  42  -5.783 -14.099  -6.366
  323   1HB   LEU  42          1HB       LEU  42  -7.729 -12.756  -5.192
  324   2HB   LEU  42          2HB       LEU  42  -6.067 -12.193  -5.215
  325    HG   LEU  42           HG       LEU  42  -7.748 -11.297  -7.478
  326   1HD1  LEU  42          1HD1      LEU  42  -8.787  -9.533  -6.155
  327   2HD1  LEU  42          2HD1      LEU  42  -8.147 -10.263  -4.682
  328   3HD1  LEU  42          3HD1      LEU  42  -9.337 -11.131  -5.652
  329   1HD2  LEU  42          1HD2      LEU  42  -5.822  -9.899  -5.637
  330   2HD2  LEU  42          2HD2      LEU  42  -6.572  -9.205  -7.076
  331   3HD2  LEU  42          3HD2      LEU  42  -5.451 -10.559  -7.229
  332    H    VAL  43           H        VAL  43  -8.995 -12.887  -7.446
  333    HA   VAL  43           HA       VAL  43  -9.976 -15.506  -6.611
  334    HB   VAL  43           HB       VAL  43 -12.251 -14.113  -6.986
  335   1HG1  VAL  43          1HG1      VAL  43 -10.472 -14.033  -4.553
  336   2HG1  VAL  43          2HG1      VAL  43 -11.623 -15.307  -4.960
  337   3HG1  VAL  43          3HG1      VAL  43 -12.200 -13.688  -4.561
  338   1HG2  VAL  43          1HG2      VAL  43 -11.940 -11.844  -6.113
  339   2HG2  VAL  43          2HG2      VAL  43 -11.098 -12.063  -7.647
  340   3HG2  VAL  43          3HG2      VAL  43 -10.193 -12.081  -6.133
  341    H    ASN  44           H        ASN  44  -9.087 -14.100  -9.434
  342    HA   ASN  44           HA       ASN  44 -11.135 -15.418 -11.036
  343   1HB   ASN  44          1HB       ASN  44  -8.725 -13.764 -11.733
  344   2HB   ASN  44          2HB       ASN  44  -9.559 -14.712 -12.960
  345   1HD2  ASN  44          1HD2      ASN  44 -11.127 -13.165 -10.241
  346   2HD2  ASN  44          2HD2      ASN  44 -11.980 -11.982 -11.157
  347    H    GLY  45           H        GLY  45  -7.659 -15.736 -10.398
  348   1HA   GLY  45          1HA       GLY  45  -6.711 -17.867  -9.921
  349   2HA   GLY  45          2HA       GLY  45  -7.996 -18.617 -10.853
  350    H    HIS  46           H        HIS  46  -5.218 -16.448 -11.248
  351    HA   HIS  46           HA       HIS  46  -3.931 -18.214 -13.025
  352   1HB   HIS  46          1HB       HIS  46  -5.537 -17.324 -14.650
  353   2HB   HIS  46          2HB       HIS  46  -4.996 -15.686 -14.313
  354    HD1  HIS  46           HD1      HIS  46  -3.864 -18.914 -15.921
  355    HD2  HIS  46           HD2      HIS  46  -2.693 -14.923 -15.663
  356    HE1  HIS  46           HE1      HIS  46  -2.047 -18.620 -17.640
  357    HE2  HIS  46           HE2      HIS  46  -1.309 -16.221 -17.431
  358    H    GLU  47           H        GLU  47  -1.812 -17.729 -13.194
  359    HA   GLU  47           HA       GLU  47  -0.978 -15.424 -11.548
  360   1HB   GLU  47          1HB       GLU  47   0.306 -18.159 -11.726
  361   2HB   GLU  47          2HB       GLU  47   0.839 -16.832 -10.698
  362   1HG   GLU  47          1HG       GLU  47  -1.148 -16.937  -9.396
  363   2HG   GLU  47          2HG       GLU  47  -1.897 -18.066 -10.520
  364    H    THR  48           H        THR  48   0.849 -14.276 -12.142
  365    HA   THR  48           HA       THR  48   2.277 -14.905 -14.567
  366    HB   THR  48           HB       THR  48   0.258 -14.048 -15.544
  367    HG1  THR  48           HG1      THR  48   1.821 -13.334 -16.807
  368   1HG2  THR  48          1HG2      THR  48   0.641 -11.583 -13.846
  369   2HG2  THR  48          2HG2      THR  48  -0.648 -12.772 -13.678
  370   3HG2  THR  48          3HG2      THR  48  -0.567 -11.761 -15.120
  371    H    THR  49           H        THR  49   3.554 -12.852 -15.224
  372    HA   THR  49           HA       THR  49   4.774 -11.779 -12.763
  373    HB   THR  49           HB       THR  49   6.020 -11.897 -15.521
  374    HG1  THR  49           HG1      THR  49   5.498 -13.986 -14.323
  375   1HG2  THR  49          1HG2      THR  49   7.210 -11.429 -12.778
  376   2HG2  THR  49          2HG2      THR  49   6.991 -10.211 -14.034
  377   3HG2  THR  49          3HG2      THR  49   8.121 -11.541 -14.286
  378    H    VAL  50           H        VAL  50   4.062  -9.782 -12.327
  379    HA   VAL  50           HA       VAL  50   3.245  -8.098 -14.594
  380    HB   VAL  50           HB       VAL  50   1.856  -6.836 -13.013
  381   1HG1  VAL  50          1HG1      VAL  50   0.156  -8.558 -12.647
  382   2HG1  VAL  50          2HG1      VAL  50   1.352  -9.806 -12.997
  383   3HG1  VAL  50          3HG1      VAL  50   0.869  -8.668 -14.257
  384   1HG2  VAL  50          1HG2      VAL  50   1.456  -7.707 -10.759
  385   2HG2  VAL  50          2HG2      VAL  50   3.130  -7.197 -10.977
  386   3HG2  VAL  50          3HG2      VAL  50   2.721  -8.913 -11.004
  387    H    TYR  51           H        TYR  51   3.721  -5.918 -14.637
  388    HA   TYR  51           HA       TYR  51   5.926  -5.047 -12.892
  389   1HB   TYR  51          1HB       TYR  51   5.290  -4.033 -15.673
  390   2HB   TYR  51          2HB       TYR  51   6.703  -3.638 -14.702
  391    HD1  TYR  51           HD1      TYR  51   8.488  -5.322 -14.376
  392    HD2  TYR  51           HD2      TYR  51   5.180  -6.054 -16.952
  393    HE1  TYR  51           HE1      TYR  51   9.715  -7.183 -15.417
  394    HE2  TYR  51           HE2      TYR  51   6.400  -7.912 -17.995
  395    HH   TYR  51           HH       TYR  51   8.863  -8.563 -18.304
  396    HA   PRO  52           HA       PRO  52   2.539  -2.184 -11.850
  397   1HB   PRO  52          1HB       PRO  52   3.170  -1.880  -9.272
  398   2HB   PRO  52          2HB       PRO  52   2.408  -3.367  -9.850
  399   1HG   PRO  52          1HG       PRO  52   5.276  -2.836  -9.197
  400   2HG   PRO  52          2HG       PRO  52   4.292  -4.269  -8.846
  401   1HD   PRO  52          1HD       PRO  52   6.061  -4.043 -10.964
  402   2HD   PRO  52          2HD       PRO  52   4.706  -5.188 -10.891
  403    H    GLY  53           H        GLY  53   2.583   0.056 -11.002
  404   1HA   GLY  53          1HA       GLY  53   4.753   1.596 -11.970
  405   2HA   GLY  53          2HA       GLY  53   3.441   2.189 -10.959
  406    H    SER  54           H        SER  54   6.030   3.129 -10.662
  407    HA   SER  54           HA       SER  54   7.466   1.701  -8.642
  408   1HB   SER  54          1HB       SER  54   7.807   4.587  -9.477
  409   2HB   SER  54          2HB       SER  54   9.020   3.524  -8.753
  410    HG   SER  54           HG       SER  54   9.243   2.469 -10.629
  411    H    ASP  55           H        ASP  55   4.697   2.450  -7.989
  412    HA   ASP  55           HA       ASP  55   5.232   3.692  -5.410
  413   1HB   ASP  55          1HB       ASP  55   4.328   5.350  -7.285
  414   2HB   ASP  55          2HB       ASP  55   2.786   4.620  -6.853
  415    H    ALA  56           H        ALA  56   4.999   1.184  -5.537
  416    HA   ALA  56           HA       ALA  56   2.302   0.180  -5.624
  417   1HB   ALA  56          1HB       ALA  56   4.160  -1.129  -6.530
  418   2HB   ALA  56          2HB       ALA  56   3.294  -1.999  -5.264
  419   3HB   ALA  56          3HB       ALA  56   4.855  -1.254  -4.914
  420    H    VAL  57           H        VAL  57   1.019  -0.348  -3.993
  421    HA   VAL  57           HA       VAL  57   2.026  -0.220  -1.224
  422    HB   VAL  57           HB       VAL  57  -0.740   0.699  -2.022
  423   1HG1  VAL  57          1HG1      VAL  57   0.902   1.169   0.458
  424   2HG1  VAL  57          2HG1      VAL  57  -0.468   0.070   0.305
  425   3HG1  VAL  57          3HG1      VAL  57  -0.711   1.811   0.159
  426   1HG2  VAL  57          1HG2      VAL  57   1.683   2.451  -1.630
  427   2HG2  VAL  57          2HG2      VAL  57   0.025   3.016  -1.838
  428   3HG2  VAL  57          3HG2      VAL  57   0.840   2.169  -3.154
  429    H    VAL  58           H        VAL  58   0.667  -1.541   0.271
  430    HA   VAL  58           HA       VAL  58  -0.301  -3.909  -1.103
  431    HB   VAL  58           HB       VAL  58  -0.170  -4.807   1.321
  432   1HG1  VAL  58          1HG1      VAL  58   2.307  -4.114  -0.244
  433   2HG1  VAL  58          2HG1      VAL  58   1.287  -5.531  -0.490
  434   3HG1  VAL  58          3HG1      VAL  58   2.202  -5.353   1.005
  435   1HG2  VAL  58          1HG2      VAL  58   0.133  -2.669   2.428
  436   2HG2  VAL  58          2HG2      VAL  58   1.621  -2.404   1.520
  437   3HG2  VAL  58          3HG2      VAL  58   1.527  -3.714   2.695
  438    H    VAL  59           H        VAL  59  -2.219  -4.925  -0.550
  439    HA   VAL  59           HA       VAL  59  -4.165  -3.442   1.067
  440    HB   VAL  59           HB       VAL  59  -5.701  -4.583  -0.900
  441   1HG1  VAL  59          1HG1      VAL  59  -4.650  -1.768  -0.750
  442   2HG1  VAL  59          2HG1      VAL  59  -6.066  -2.405   0.089
  443   3HG1  VAL  59          3HG1      VAL  59  -6.065  -2.278  -1.671
  444   1HG2  VAL  59          1HG2      VAL  59  -4.777  -3.821  -3.029
  445   2HG2  VAL  59          2HG2      VAL  59  -3.769  -5.060  -2.281
  446   3HG2  VAL  59          3HG2      VAL  59  -3.284  -3.365  -2.207
  447    H    THR  60           H        THR  60  -6.206  -4.881   1.296
  448    HA   THR  60           HA       THR  60  -5.296  -7.612   1.967
  449    HB   THR  60           HB       THR  60  -7.187  -7.212   3.833
  450    HG1  THR  60           HG1      THR  60  -6.081  -4.630   3.739
  451   1HG2  THR  60          1HG2      THR  60  -4.853  -7.792   4.270
  452   2HG2  THR  60          2HG2      THR  60  -5.405  -6.528   5.368
  453   3HG2  THR  60          3HG2      THR  60  -4.382  -6.117   3.991
  454    H    ALA  61           H        ALA  61  -7.768  -8.598   2.872
  455    HA   ALA  61           HA       ALA  61  -8.609  -9.776   0.520
  456   1HB   ALA  61          1HB       ALA  61  -8.750 -10.807   2.730
  457   2HB   ALA  61          2HB       ALA  61 -10.268 -10.906   1.839
  458   3HB   ALA  61          3HB       ALA  61 -10.085  -9.726   3.135
  459    H    THR  62           H        THR  62 -10.284  -7.128   2.290
  460    HA   THR  62           HA       THR  62 -12.633  -7.378   0.660
  461    HB   THR  62           HB       THR  62 -12.937  -4.939   1.526
  462    HG1  THR  62           HG1      THR  62 -11.191  -4.336   2.572
  463   1HG2  THR  62          1HG2      THR  62 -13.045  -7.328   3.348
  464   2HG2  THR  62          2HG2      THR  62 -14.290  -6.845   2.196
  465   3HG2  THR  62          3HG2      THR  62 -13.926  -5.818   3.581
  466    H    GLU  63           H        GLU  63  -9.883  -5.230   0.707
  467    HA   GLU  63           HA       GLU  63 -10.615  -3.617  -1.476
  468   1HB   GLU  63          1HB       GLU  63  -7.746  -4.182  -0.834
  469   2HB   GLU  63          2HB       GLU  63  -8.509  -2.664  -1.282
  470   1HG   GLU  63          1HG       GLU  63  -8.690  -4.055   1.379
  471   2HG   GLU  63          2HG       GLU  63  -7.802  -2.579   1.014
  472    H    HIS  64           H        HIS  64  -9.631  -6.827  -1.288
  473    HA   HIS  64           HA       HIS  64  -8.049  -6.977  -3.628
  474   1HB   HIS  64          1HB       HIS  64  -7.584  -9.062  -2.963
  475   2HB   HIS  64          2HB       HIS  64  -8.346  -8.564  -1.478
  476    HD1  HIS  64           HD1      HIS  64  -8.108 -11.532  -2.173
  477    HD2  HIS  64           HD2      HIS  64 -11.482  -9.261  -3.050
  478    HE1  HIS  64           HE1      HIS  64 -10.002 -13.166  -2.362
  479    HE2  HIS  64           HE2      HIS  64 -12.050 -11.767  -2.781
  480    H    ALA  65           H        ALA  65 -11.506  -7.126  -3.151
  481    HA   ALA  65           HA       ALA  65 -11.958  -8.908  -5.368
  482   1HB   ALA  65          1HB       ALA  65 -13.937  -7.303  -3.755
  483   2HB   ALA  65          2HB       ALA  65 -13.360  -8.921  -3.354
  484   3HB   ALA  65          3HB       ALA  65 -14.303  -8.661  -4.821
  485    H    GLU  66           H        GLU  66 -13.411  -5.771  -4.759
  486    HA   GLU  66           HA       GLU  66 -14.254  -5.365  -7.394
  487   1HB   GLU  66          1HB       GLU  66 -14.225  -2.861  -6.259
  488   2HB   GLU  66          2HB       GLU  66 -15.522  -4.036  -6.099
  489   1HG   GLU  66          1HG       GLU  66 -15.096  -3.363  -3.900
  490   2HG   GLU  66          2HG       GLU  66 -14.246  -4.901  -4.043
  491    H    ALA  67           H        ALA  67 -11.421  -4.227  -5.633
  492    HA   ALA  67           HA       ALA  67 -10.396  -2.628  -7.736
  493   1HB   ALA  67          1HB       ALA  67  -9.717  -2.339  -5.403
  494   2HB   ALA  67          2HB       ALA  67  -8.331  -2.586  -6.465
  495   3HB   ALA  67          3HB       ALA  67  -8.910  -3.906  -5.451
  496    H    GLU  68           H        GLU  68 -10.141  -6.094  -7.021
  497    HA   GLU  68           HA       GLU  68  -8.012  -6.709  -8.746
  498   1HB   GLU  68          1HB       GLU  68  -8.994  -8.450  -7.348
  499   2HB   GLU  68          2HB       GLU  68 -10.519  -8.325  -8.220
  500   1HG   GLU  68          1HG       GLU  68  -9.081  -8.896 -10.301
  501   2HG   GLU  68          2HG       GLU  68  -7.917  -9.482  -9.116
  502    H    LYS  69           H        LYS  69 -11.502  -6.707  -9.396
  503    HA   LYS  69           HA       LYS  69 -11.401  -7.294 -12.088
  504   1HB   LYS  69          1HB       LYS  69 -13.337  -5.530 -10.596
  505   2HB   LYS  69          2HB       LYS  69 -13.575  -6.035 -12.262
  506   1HG   LYS  69          1HG       LYS  69 -13.256  -7.959  -9.968
  507   2HG   LYS  69          2HG       LYS  69 -14.814  -7.380 -10.555
  508   1HD   LYS  69          1HD       LYS  69 -14.515  -9.442 -11.635
  509   2HD   LYS  69          2HD       LYS  69 -14.069  -8.245 -12.850
  510   1HE   LYS  69          1HE       LYS  69 -11.675  -8.587 -12.128
  511   2HE   LYS  69          2HE       LYS  69 -12.241  -9.960 -11.181
  512   1HZ   LYS  69          1HZ       LYS  69 -11.427 -10.675 -13.328
  513   2HZ   LYS  69          2HZ       LYS  69 -12.508  -9.642 -14.123
  514   3HZ   LYS  69          3HZ       LYS  69 -13.097 -10.956 -13.227
  515    H    ARG  70           H        ARG  70 -11.719  -3.965 -10.794
  516    HA   ARG  70           HA       ARG  70 -11.415  -2.811 -13.380
  517   1HB   ARG  70          1HB       ARG  70 -11.029  -1.510 -10.677
  518   2HB   ARG  70          2HB       ARG  70 -11.257  -0.667 -12.201
  519   1HG   ARG  70          1HG       ARG  70 -13.271  -2.479 -10.884
  520   2HG   ARG  70          2HG       ARG  70 -13.303  -0.715 -10.875
  521   1HD   ARG  70          1HD       ARG  70 -13.424  -2.443 -13.344
  522   2HD   ARG  70          2HD       ARG  70 -14.816  -1.692 -12.566
  523    HE   ARG  70           HE       ARG  70 -12.720   0.150 -13.315
  524   1HH1  ARG  70          1HH1      ARG  70 -15.679  -1.456 -14.309
  525   2HH1  ARG  70          2HH1      ARG  70 -16.025  -0.294 -15.552
  526   1HH2  ARG  70          1HH2      ARG  70 -13.207   1.690 -14.918
  527   2HH2  ARG  70          2HH2      ARG  70 -14.637   1.502 -15.885
  528    H    ALA  71           H        ALA  71  -9.179  -3.033 -10.636
  529    HA   ALA  71           HA       ALA  71  -7.237  -1.454 -12.008
  530   1HB   ALA  71          1HB       ALA  71  -7.003  -2.891  -9.382
  531   2HB   ALA  71          2HB       ALA  71  -7.602  -1.247  -9.609
  532   3HB   ALA  71          3HB       ALA  71  -5.925  -1.637  -9.996
  533    H    ALA  72           H        ALA  72  -7.698  -4.931 -11.576
  534    HA   ALA  72           HA       ALA  72  -5.024  -5.505 -12.505
  535   1HB   ALA  72          1HB       ALA  72  -5.709  -7.823 -12.731
  536   2HB   ALA  72          2HB       ALA  72  -7.390  -7.378 -12.446
  537   3HB   ALA  72          3HB       ALA  72  -6.197  -7.189 -11.160
  538    H    ALA  73           H        ALA  73  -8.216  -5.104 -13.930
  539    HA   ALA  73           HA       ALA  73  -7.686  -5.917 -16.532
  540   1HB   ALA  73          1HB       ALA  73  -9.426  -4.355 -17.229
  541   2HB   ALA  73          2HB       ALA  73  -9.333  -3.540 -15.666
  542   3HB   ALA  73          3HB       ALA  73  -9.897  -5.208 -15.758
  543    H    ARG  74           H        ARG  74  -6.984  -2.791 -14.957
  544    HA   ARG  74           HA       ARG  74  -5.610  -1.847 -17.318
  545   1HB   ARG  74          1HB       ARG  74  -6.714  -0.232 -15.889
  546   2HB   ARG  74          2HB       ARG  74  -5.698  -0.693 -14.529
  547   1HG   ARG  74          1HG       ARG  74  -3.980   0.564 -15.224
  548   2HG   ARG  74          2HG       ARG  74  -4.216   0.138 -16.918
  549   1HD   ARG  74          1HD       ARG  74  -4.580   2.518 -16.556
  550   2HD   ARG  74          2HD       ARG  74  -6.068   1.722 -17.061
  551    HE   ARG  74           HE       ARG  74  -6.203   1.702 -14.340
  552   1HH1  ARG  74          1HH1      ARG  74  -5.669   4.224 -16.724
  553   2HH1  ARG  74          2HH1      ARG  74  -6.496   5.445 -15.795
  554   1HH2  ARG  74          1HH2      ARG  74  -7.277   3.294 -13.128
  555   2HH2  ARG  74          2HH2      ARG  74  -7.403   4.916 -13.753
  556    H    ALA  75           H        ALA  75  -4.537  -3.087 -14.149
  557    HA   ALA  75           HA       ALA  75  -1.791  -2.638 -14.350
  558   1HB   ALA  75          1HB       ALA  75  -1.518  -4.432 -12.744
  559   2HB   ALA  75          2HB       ALA  75  -3.144  -5.022 -13.089
  560   3HB   ALA  75          3HB       ALA  75  -2.921  -3.448 -12.327
  561    H    GLY  76           H        GLY  76  -3.572  -5.586 -15.342
  562   1HA   GLY  76          1HA       GLY  76  -1.231  -6.865 -16.361
  563   2HA   GLY  76          2HA       GLY  76  -2.890  -7.376 -16.629
  564    H    HIS  77           H        HIS  77  -3.321  -4.495 -17.635
  565    HA   HIS  77           HA       HIS  77  -2.717  -5.095 -20.406
  566   1HB   HIS  77          1HB       HIS  77  -4.918  -4.137 -19.690
  567   2HB   HIS  77          2HB       HIS  77  -4.083  -2.659 -19.232
  568    HD1  HIS  77           HD1      HIS  77  -3.810  -0.937 -21.009
  569    HD2  HIS  77           HD2      HIS  77  -4.762  -4.681 -22.558
  570    HE1  HIS  77           HE1      HIS  77  -4.226  -0.574 -23.463
  571    HE2  HIS  77           HE2      HIS  77  -4.673  -2.868 -24.406
  572    H    ALA  78           H        ALA  78  -1.279  -3.467 -17.834
  573    HA   ALA  78           HA       ALA  78   0.212  -1.594 -19.498
  574   1HB   ALA  78          1HB       ALA  78   1.151  -0.787 -17.388
  575   2HB   ALA  78          2HB       ALA  78   0.325  -2.080 -16.519
  576   3HB   ALA  78          3HB       ALA  78  -0.611  -0.821 -17.326
  577    H    ALA  79           H        ALA  79   0.400  -4.747 -19.050
  578    HA   ALA  79           HA       ALA  79   3.098  -5.239 -18.377
  579   1HB   ALA  79          1HB       ALA  79   2.755  -7.425 -19.416
  580   2HB   ALA  79          2HB       ALA  79   1.241  -6.857 -20.121
  581   3HB   ALA  79          3HB       ALA  79   1.399  -6.997 -18.370
  582    H    THR  80           H        THR  80   4.851  -4.690 -19.476
  583    HA   THR  80           HA       THR  80   4.560  -3.836 -22.260
  584    HB   THR  80           HB       THR  80   7.005  -3.404 -20.557
  585    HG1  THR  80           HG1      THR  80   4.497  -2.409 -20.147
  586   1HG2  THR  80          1HG2      THR  80   7.245  -1.412 -21.971
  587   2HG2  THR  80          2HG2      THR  80   5.750  -1.826 -22.812
  588   3HG2  THR  80          3HG2      THR  80   7.159  -2.878 -22.948
  Start of MODEL   12
    1    H    MET   1           H        MET   1   7.202   2.208  -1.741
    2    HA   MET   1           HA       MET   1   5.724   0.572  -0.888
    3   1HB   MET   1          1HB       MET   1   6.519   0.293  -3.184
    4   2HB   MET   1          2HB       MET   1   7.914  -0.609  -2.611
    5   1HG   MET   1          1HG       MET   1   6.182  -2.051  -3.558
    6   2HG   MET   1          2HG       MET   1   6.497  -2.407  -1.862
    7   1HE   MET   1          1HE       MET   1   4.139  -3.840  -2.359
    8   2HE   MET   1          2HE       MET   1   3.861  -3.043  -3.909
    9   3HE   MET   1          3HE       MET   1   2.602  -3.034  -2.673
   10    H    HIS   2           H        HIS   2   5.303  -0.899   0.622
   11    HA   HIS   2           HA       HIS   2   7.435  -2.654   1.605
   12   1HB   HIS   2          1HB       HIS   2   5.656  -0.909   3.308
   13   2HB   HIS   2          2HB       HIS   2   6.359  -2.390   3.936
   14    HD1  HIS   2           HD1      HIS   2   6.912   0.999   4.188
   15    HD2  HIS   2           HD2      HIS   2   9.417  -2.182   3.235
   16    HE1  HIS   2           HE1      HIS   2   9.243   1.788   4.706
   17    HE2  HIS   2           HE2      HIS   2  10.723  -0.208   4.292
   18    H    ALA   3           H        ALA   3   6.686  -4.633   1.085
   19    HA   ALA   3           HA       ALA   3   3.844  -5.203   1.530
   20   1HB   ALA   3          1HB       ALA   3   3.617  -6.201  -0.678
   21   2HB   ALA   3          2HB       ALA   3   5.274  -5.738  -1.066
   22   3HB   ALA   3          3HB       ALA   3   4.053  -4.495  -0.797
   23    H    LYS   4           H        LYS   4   3.358  -7.530   1.194
   24    HA   LYS   4           HA       LYS   4   5.596  -9.305   1.817
   25   1HB   LYS   4          1HB       LYS   4   3.048  -9.052   3.431
   26   2HB   LYS   4          2HB       LYS   4   4.217 -10.351   3.616
   27   1HG   LYS   4          1HG       LYS   4   5.857  -8.883   4.468
   28   2HG   LYS   4          2HG       LYS   4   4.938  -7.458   3.979
   29   1HD   LYS   4          1HD       LYS   4   4.746  -7.838   6.382
   30   2HD   LYS   4          2HD       LYS   4   3.184  -8.034   5.583
   31   1HE   LYS   4          1HE       LYS   4   3.687 -10.517   5.526
   32   2HE   LYS   4          2HE       LYS   4   5.028 -10.176   6.622
   33   1HZ   LYS   4          1HZ       LYS   4   2.168  -9.560   7.141
   34   2HZ   LYS   4          2HZ       LYS   4   3.456  -9.252   8.205
   35   3HZ   LYS   4          3HZ       LYS   4   3.039 -10.851   7.817
   36    H    VAL   5           H        VAL   5   4.684 -11.632   1.907
   37    HA   VAL   5           HA       VAL   5   2.958 -12.020  -0.428
   38    HB   VAL   5           HB       VAL   5   4.915 -13.420  -0.423
   39   1HG1  VAL   5          1HG1      VAL   5   5.457 -14.978   1.405
   40   2HG1  VAL   5          2HG1      VAL   5   4.133 -14.302   2.356
   41   3HG1  VAL   5          3HG1      VAL   5   5.513 -13.293   1.921
   42   1HG2  VAL   5          1HG2      VAL   5   2.913 -14.555  -1.192
   43   2HG2  VAL   5          2HG2      VAL   5   2.550 -15.081   0.453
   44   3HG2  VAL   5          3HG2      VAL   5   3.982 -15.694  -0.376
   45    H    GLY   6           H        GLY   6   0.922 -12.923  -0.299
   46   1HA   GLY   6          1HA       GLY   6  -0.985 -13.782   0.841
   47   2HA   GLY   6          2HA       GLY   6  -0.172 -13.476   2.376
   48    H    ASP   7           H        ASP   7   0.089 -11.117   0.015
   49    HA   ASP   7           HA       ASP   7  -2.055  -9.323   1.143
   50   1HB   ASP   7          1HB       ASP   7   0.944  -8.866   1.121
   51   2HB   ASP   7          2HB       ASP   7  -0.174  -7.514   0.982
   52    H    TYR   8           H        TYR   8  -1.640  -7.212  -0.218
   53    HA   TYR   8           HA       TYR   8  -1.775  -8.139  -3.024
   54   1HB   TYR   8          1HB       TYR   8  -3.876  -6.562  -1.507
   55   2HB   TYR   8          2HB       TYR   8  -3.889  -6.802  -3.241
   56    HD1  TYR   8           HD1      TYR   8  -4.731  -8.813  -4.193
   57    HD2  TYR   8           HD2      TYR   8  -4.358  -8.456   0.028
   58    HE1  TYR   8           HE1      TYR   8  -6.175 -10.792  -3.914
   59    HE2  TYR   8           HE2      TYR   8  -5.796 -10.445   0.311
   60    HH   TYR   8           HH       TYR   8  -6.385 -12.620  -1.913
   61    H    LEU   9           H        LEU   9  -2.314  -6.133  -4.426
   62    HA   LEU   9           HA       LEU   9  -0.456  -4.011  -3.621
   63   1HB   LEU   9          1HB       LEU   9   0.679  -6.016  -4.722
   64   2HB   LEU   9          2HB       LEU   9  -0.190  -5.593  -6.178
   65    HG   LEU   9           HG       LEU   9   1.750  -3.712  -4.830
   66   1HD1  LEU   9          1HD1      LEU   9   2.935  -5.740  -5.436
   67   2HD1  LEU   9          2HD1      LEU   9   3.358  -4.439  -6.551
   68   3HD1  LEU   9          3HD1      LEU   9   2.228  -5.698  -7.051
   69   1HD2  LEU   9          1HD2      LEU   9   0.618  -3.813  -7.627
   70   2HD2  LEU   9          2HD2      LEU   9   1.821  -2.664  -7.046
   71   3HD2  LEU   9          3HD2      LEU   9   0.190  -2.646  -6.376
   72    H    VAL  10           H        VAL  10  -0.804  -2.115  -4.558
   73    HA   VAL  10           HA       VAL  10  -2.685  -1.848  -6.785
   74    HB   VAL  10           HB       VAL  10  -2.897  -0.452  -4.110
   75   1HG1  VAL  10          1HG1      VAL  10  -4.565   1.047  -5.079
   76   2HG1  VAL  10          2HG1      VAL  10  -4.246   0.382  -6.680
   77   3HG1  VAL  10          3HG1      VAL  10  -2.991   1.286  -5.833
   78   1HG2  VAL  10          1HG2      VAL  10  -5.227  -1.149  -4.263
   79   2HG2  VAL  10          2HG2      VAL  10  -4.131  -2.527  -4.376
   80   3HG2  VAL  10          3HG2      VAL  10  -4.902  -1.891  -5.829
   81    H    VAL  11           H        VAL  11  -2.345   0.051  -8.000
   82    HA   VAL  11           HA       VAL  11  -0.043   1.697  -7.240
   83    HB   VAL  11           HB       VAL  11   0.036  -0.283  -9.250
   84   1HG1  VAL  11          1HG1      VAL  11   0.180   2.480 -10.451
   85   2HG1  VAL  11          2HG1      VAL  11  -1.039   1.256 -10.807
   86   3HG1  VAL  11          3HG1      VAL  11   0.646   0.979 -11.251
   87   1HG2  VAL  11          1HG2      VAL  11   1.917   1.975  -8.614
   88   2HG2  VAL  11          2HG2      VAL  11   2.326   0.518  -9.523
   89   3HG2  VAL  11          3HG2      VAL  11   1.863   0.399  -7.825
   90    H    LYS  12           H        LYS  12  -0.071   3.800  -8.163
   91    HA   LYS  12           HA       LYS  12  -0.873   5.682  -9.145
   92   1HB   LYS  12          1HB       LYS  12  -1.285   4.075 -11.085
   93   2HB   LYS  12          2HB       LYS  12  -2.953   4.004 -10.539
   94   1HG   LYS  12          1HG       LYS  12  -2.816   5.588 -12.311
   95   2HG   LYS  12          2HG       LYS  12  -3.071   6.476 -10.806
   96   1HD   LYS  12          1HD       LYS  12  -0.764   7.091 -10.693
   97   2HD   LYS  12          2HD       LYS  12  -0.362   6.022 -12.039
   98   1HE   LYS  12          1HE       LYS  12  -1.826   7.404 -13.494
   99   2HE   LYS  12          2HE       LYS  12  -2.048   8.518 -12.143
  100   1HZ   LYS  12          1HZ       LYS  12   0.612   7.819 -13.265
  101   2HZ   LYS  12          2HZ       LYS  12   0.251   9.061 -12.171
  102   3HZ   LYS  12          3HZ       LYS  12  -0.292   9.159 -13.776
  103    H    GLY  13           H        GLY  13  -1.601   6.521  -7.186
  104   1HA   GLY  13          1HA       GLY  13  -4.520   6.646  -6.992
  105   2HA   GLY  13          2HA       GLY  13  -3.628   6.119  -5.572
  106    H    THR  14           H        THR  14  -2.017   8.417  -7.519
  107    HA   THR  14           HA       THR  14  -2.151  10.353  -5.394
  108    HB   THR  14           HB       THR  14  -0.665  11.657  -7.093
  109    HG1  THR  14           HG1      THR  14   0.398   9.733  -8.363
  110   1HG2  THR  14          1HG2      THR  14   0.244   9.040  -5.886
  111   2HG2  THR  14          2HG2      THR  14   0.191  10.599  -5.060
  112   3HG2  THR  14          3HG2      THR  14   1.303  10.350  -6.408
  113    H    THR  15           H        THR  15  -3.185  10.162  -8.770
  114    HA   THR  15           HA       THR  15  -5.059  12.358  -8.212
  115    HB   THR  15           HB       THR  15  -3.245  13.195  -9.657
  116    HG1  THR  15           HG1      THR  15  -4.671  14.327 -10.743
  117   1HG2  THR  15          1HG2      THR  15  -2.632  11.094 -10.755
  118   2HG2  THR  15          2HG2      THR  15  -2.976  12.358 -11.938
  119   3HG2  THR  15          3HG2      THR  15  -4.170  11.097 -11.621
  120    H    THR  16           H        THR  16  -4.536   9.199  -9.327
  121    HA   THR  16           HA       THR  16  -7.105   9.103 -10.719
  122    HB   THR  16           HB       THR  16  -5.069   6.881 -10.547
  123    HG1  THR  16           HG1      THR  16  -5.281   8.848 -12.618
  124   1HG2  THR  16          1HG2      THR  16  -7.314   6.268 -11.328
  125   2HG2  THR  16          2HG2      THR  16  -6.130   6.147 -12.631
  126   3HG2  THR  16          3HG2      THR  16  -7.229   7.525 -12.563
  127    H    GLU  17           H        GLU  17  -8.757   8.746  -9.338
  128    HA   GLU  17           HA       GLU  17  -8.422   7.235  -6.924
  129   1HB   GLU  17          1HB       GLU  17 -10.921   8.306  -8.238
  130   2HB   GLU  17          2HB       GLU  17 -10.864   7.569  -6.643
  131   1HG   GLU  17          1HG       GLU  17 -10.658   9.681  -5.944
  132   2HG   GLU  17          2HG       GLU  17  -8.963   9.463  -6.375
  133    H    ARG  18           H        ARG  18  -8.396   6.109  -9.900
  134    HA   ARG  18           HA       ARG  18 -10.276   3.964  -9.769
  135   1HB   ARG  18          1HB       ARG  18  -8.128   4.819 -11.580
  136   2HB   ARG  18          2HB       ARG  18  -8.294   3.075 -11.456
  137   1HG   ARG  18          1HG       ARG  18  -9.586   3.895 -13.309
  138   2HG   ARG  18          2HG       ARG  18 -10.667   3.276 -12.063
  139   1HD   ARG  18          1HD       ARG  18 -11.109   5.543 -11.299
  140   2HD   ARG  18          2HD       ARG  18  -9.982   6.179 -12.499
  141    HE   ARG  18           HE       ARG  18 -11.976   4.600 -13.752
  142   1HH1  ARG  18          1HH1      ARG  18 -11.526   7.715 -12.207
  143   2HH1  ARG  18          2HH1      ARG  18 -12.737   8.505 -13.171
  144   1HH2  ARG  18          1HH2      ARG  18 -13.575   5.643 -15.016
  145   2HH2  ARG  18          2HH2      ARG  18 -13.894   7.334 -14.755
  146    H    HIS  19           H        HIS  19  -6.972   4.480  -8.766
  147    HA   HIS  19           HA       HIS  19  -5.412   3.212  -7.723
  148   1HB   HIS  19          1HB       HIS  19  -7.809   1.754  -6.580
  149   2HB   HIS  19          2HB       HIS  19  -6.170   1.713  -5.942
  150    HD1  HIS  19           HD1      HIS  19  -5.297   3.953  -4.797
  151    HD2  HIS  19           HD2      HIS  19  -9.339   3.898  -5.786
  152    HE1  HIS  19           HE1      HIS  19  -6.326   5.879  -3.552
  153    HE2  HIS  19           HE2      HIS  19  -8.775   5.838  -4.164
  154    H    ASP  20           H        ASP  20  -4.812   2.454  -9.808
  155    HA   ASP  20           HA       ASP  20  -6.027   0.097 -10.905
  156   1HB   ASP  20          1HB       ASP  20  -3.521   1.552 -11.785
  157   2HB   ASP  20          2HB       ASP  20  -4.419   0.367 -12.726
  158    H    GLN  21           H        GLN  21  -4.125  -1.459 -11.901
  159    HA   GLN  21           HA       GLN  21  -2.829  -3.260 -11.387
  160   1HB   GLN  21          1HB       GLN  21  -1.139  -1.439 -11.236
  161   2HB   GLN  21          2HB       GLN  21  -1.471  -1.309  -9.514
  162   1HG   GLN  21          1HG       GLN  21   0.452  -2.591  -9.604
  163   2HG   GLN  21          2HG       GLN  21  -0.828  -3.785  -9.403
  164   1HE2  GLN  21          1HE2      GLN  21  -0.113  -2.108 -12.398
  165   2HE2  GLN  21          2HE2      GLN  21   0.450  -3.497 -13.259
  166    H    HIS  22           H        HIS  22  -4.057  -4.798 -10.338
  167    HA   HIS  22           HA       HIS  22  -4.200  -4.568  -7.421
  168   1HB   HIS  22          1HB       HIS  22  -6.355  -3.977  -9.103
  169   2HB   HIS  22          2HB       HIS  22  -6.689  -5.594  -8.494
  170    HD1  HIS  22           HD1      HIS  22  -6.766  -2.044  -7.554
  171    HD2  HIS  22           HD2      HIS  22  -6.903  -5.725  -5.624
  172    HE1  HIS  22           HE1      HIS  22  -7.697  -1.575  -5.268
  173    HE2  HIS  22           HE2      HIS  22  -8.021  -3.848  -4.234
  174    H    ALA  23           H        ALA  23  -3.109  -6.284  -6.856
  175    HA   ALA  23           HA       ALA  23  -3.790  -8.935  -7.953
  176   1HB   ALA  23          1HB       ALA  23  -0.979  -7.872  -7.771
  177   2HB   ALA  23          2HB       ALA  23  -1.903  -8.070  -9.260
  178   3HB   ALA  23          3HB       ALA  23  -1.468  -9.482  -8.299
  179    H    GLU  24           H        GLU  24  -2.367 -10.619  -6.750
  180    HA   GLU  24           HA       GLU  24  -1.864  -9.770  -3.972
  181   1HB   GLU  24          1HB       GLU  24  -3.997 -11.048  -3.954
  182   2HB   GLU  24          2HB       GLU  24  -3.164 -12.404  -4.713
  183   1HG   GLU  24          1HG       GLU  24  -1.553 -12.283  -2.723
  184   2HG   GLU  24          2HG       GLU  24  -2.775 -11.276  -1.960
  185    H    ILE  25           H        ILE  25  -0.098 -10.408  -3.204
  186    HA   ILE  25           HA       ILE  25   1.795 -11.566  -5.054
  187    HB   ILE  25           HB       ILE  25   2.510 -10.517  -2.337
  188   1HG1  ILE  25          1HG1      ILE  25   1.902  -8.779  -4.742
  189   2HG1  ILE  25          2HG1      ILE  25   0.892  -8.894  -3.304
  190   1HG2  ILE  25          1HG2      ILE  25   4.487  -9.726  -3.548
  191   2HG2  ILE  25          2HG2      ILE  25   3.808 -10.353  -5.051
  192   3HG2  ILE  25          3HG2      ILE  25   4.248 -11.461  -3.749
  193   1HD1  ILE  25          1HD1      ILE  25   2.251  -6.890  -3.257
  194   2HD1  ILE  25          2HD1      ILE  25   3.718  -7.859  -3.409
  195   3HD1  ILE  25          3HD1      ILE  25   2.722  -7.985  -1.959
  196    H    ILE  26           H        ILE  26   1.911 -13.712  -5.011
  197    HA   ILE  26           HA       ILE  26   2.113 -15.058  -2.408
  198    HB   ILE  26           HB       ILE  26   1.888 -17.199  -3.623
  199   1HG1  ILE  26          1HG1      ILE  26   2.689 -16.157  -5.867
  200   2HG1  ILE  26          2HG1      ILE  26   1.407 -17.359  -5.931
  201   1HG2  ILE  26          1HG2      ILE  26  -0.532 -16.966  -4.130
  202   2HG2  ILE  26          2HG2      ILE  26  -0.358 -15.212  -4.104
  203   3HG2  ILE  26          3HG2      ILE  26  -0.086 -16.145  -2.632
  204   1HD1  ILE  26          1HD1      ILE  26   0.963 -15.520  -7.441
  205   2HD1  ILE  26          2HD1      ILE  26   1.046 -14.377  -6.100
  206   3HD1  ILE  26          3HD1      ILE  26  -0.245 -15.576  -6.158
  207    H    GLU  27           H        GLU  27   3.881 -13.869  -5.004
  208    HA   GLU  27           HA       GLU  27   6.302 -14.994  -3.822
  209   1HB   GLU  27          1HB       GLU  27   5.723 -14.880  -6.789
  210   2HB   GLU  27          2HB       GLU  27   7.321 -15.156  -6.111
  211   1HG   GLU  27          1HG       GLU  27   6.288 -17.143  -4.907
  212   2HG   GLU  27          2HG       GLU  27   4.909 -16.926  -5.984
  213    H    VAL  28           H        VAL  28   8.065 -13.586  -3.875
  214    HA   VAL  28           HA       VAL  28   7.318 -10.798  -4.427
  215    HB   VAL  28           HB       VAL  28   8.396 -11.704  -1.753
  216   1HG1  VAL  28          1HG1      VAL  28   7.284  -9.054  -2.673
  217   2HG1  VAL  28          2HG1      VAL  28   8.982  -9.423  -2.373
  218   3HG1  VAL  28          3HG1      VAL  28   7.828  -9.430  -1.037
  219   1HG2  VAL  28          1HG2      VAL  28   6.126 -12.558  -2.033
  220   2HG2  VAL  28          2HG2      VAL  28   5.563 -10.937  -2.443
  221   3HG2  VAL  28          3HG2      VAL  28   6.180 -11.274  -0.826
  222    H    ARG  29           H        ARG  29   9.001 -10.294  -5.771
  223    HA   ARG  29           HA       ARG  29  11.603 -11.530  -5.396
  224   1HB   ARG  29          1HB       ARG  29  10.091 -10.672  -7.616
  225   2HB   ARG  29          2HB       ARG  29  11.512  -9.641  -7.565
  226   1HG   ARG  29          1HG       ARG  29  11.599 -12.651  -7.524
  227   2HG   ARG  29          2HG       ARG  29  11.763 -11.667  -8.977
  228   1HD   ARG  29          1HD       ARG  29  13.959 -12.173  -8.333
  229   2HD   ARG  29          2HD       ARG  29  13.696 -10.518  -7.792
  230    HE   ARG  29           HE       ARG  29  13.317 -12.722  -5.888
  231   1HH1  ARG  29          1HH1      ARG  29  15.138  -9.938  -6.973
  232   2HH1  ARG  29          2HH1      ARG  29  16.018  -9.762  -5.489
  233   1HH2  ARG  29          1HH2      ARG  29  14.506 -12.527  -3.929
  234   2HH2  ARG  29          2HH2      ARG  29  15.704 -11.269  -3.781
  235    H    SER  30           H        SER  30  10.819  -9.606  -3.428
  236    HA   SER  30           HA       SER  30  13.174  -7.971  -3.510
  237   1HB   SER  30          1HB       SER  30  11.476  -6.610  -4.782
  238   2HB   SER  30          2HB       SER  30  10.496  -6.571  -3.318
  239    HG   SER  30           HG       SER  30  13.144  -5.559  -3.615
  240    H    ALA  31           H        ALA  31  13.719  -7.149  -1.469
  241    HA   ALA  31           HA       ALA  31  12.347  -8.462   0.744
  242   1HB   ALA  31          1HB       ALA  31  14.792  -8.634   0.607
  243   2HB   ALA  31          2HB       ALA  31  14.278  -7.815   2.081
  244   3HB   ALA  31          3HB       ALA  31  14.920  -6.878   0.730
  245    H    ASP  32           H        ASP  32  12.390  -5.474  -0.817
  246    HA   ASP  32           HA       ASP  32  11.271  -4.131   1.553
  247   1HB   ASP  32          1HB       ASP  32  13.396  -3.112   0.898
  248   2HB   ASP  32          2HB       ASP  32  12.804  -2.899  -0.746
  249    H    GLY  33           H        GLY  33  11.295  -3.680  -1.987
  250   1HA   GLY  33          1HA       GLY  33   8.671  -4.179  -2.552
  251   2HA   GLY  33          2HA       GLY  33   8.669  -2.537  -1.925
  252    H    SER  34           H        SER  34  10.899  -4.323  -4.032
  253    HA   SER  34           HA       SER  34  10.504  -2.229  -6.063
  254   1HB   SER  34          1HB       SER  34  12.999  -3.861  -5.526
  255   2HB   SER  34          2HB       SER  34  12.822  -2.625  -6.771
  256    HG   SER  34           HG       SER  34  13.845  -1.946  -4.752
  257    HA   PRO  35           HA       PRO  35   9.127  -5.413  -8.836
  258   1HB   PRO  35          1HB       PRO  35  10.573  -3.963 -10.970
  259   2HB   PRO  35          2HB       PRO  35   8.853  -4.339 -10.835
  260   1HG   PRO  35          1HG       PRO  35   9.759  -1.847 -10.483
  261   2HG   PRO  35          2HG       PRO  35   8.415  -2.487  -9.519
  262   1HD   PRO  35          1HD       PRO  35  11.292  -2.139  -8.768
  263   2HD   PRO  35          2HD       PRO  35   9.831  -1.835  -7.806
  264    HA   PRO  36           HA       PRO  36   8.943  -6.566 -10.675
  265   1HB   PRO  36          1HB       PRO  36   9.011  -9.079 -11.522
  266   2HB   PRO  36          2HB       PRO  36   9.895  -7.812 -12.381
  267   1HG   PRO  36          1HG       PRO  36  10.915  -9.907 -10.520
  268   2HG   PRO  36          2HG       PRO  36  11.659  -9.248 -11.987
  269   1HD   PRO  36          1HD       PRO  36  12.241  -8.489  -9.349
  270   2HD   PRO  36          2HD       PRO  36  12.700  -7.605 -10.817
  271    H    TYR  37           H        TYR  37   7.283  -8.440 -10.453
  272    HA   TYR  37           HA       TYR  37   7.450  -9.783  -7.834
  273   1HB   TYR  37          1HB       TYR  37   5.110  -8.167  -8.866
  274   2HB   TYR  37          2HB       TYR  37   5.018  -9.265  -7.498
  275    HD1  TYR  37           HD1      TYR  37   6.124  -8.706  -5.381
  276    HD2  TYR  37           HD2      TYR  37   6.145  -6.005  -8.668
  277    HE1  TYR  37           HE1      TYR  37   6.780  -6.882  -3.870
  278    HE2  TYR  37           HE2      TYR  37   6.810  -4.173  -7.167
  279    HH   TYR  37           HH       TYR  37   6.757  -3.586  -4.857
  280    H    VAL  38           H        VAL  38   5.745 -11.515  -7.670
  281    HA   VAL  38           HA       VAL  38   4.760 -12.397 -10.286
  282    HB   VAL  38           HB       VAL  38   6.193 -14.239  -8.349
  283   1HG1  VAL  38          1HG1      VAL  38   4.671 -14.865 -10.889
  284   2HG1  VAL  38          2HG1      VAL  38   4.172 -15.283  -9.250
  285   3HG1  VAL  38          3HG1      VAL  38   5.611 -16.024  -9.949
  286   1HG2  VAL  38          1HG2      VAL  38   7.660 -14.697 -10.274
  287   2HG2  VAL  38          2HG2      VAL  38   7.718 -13.001  -9.791
  288   3HG2  VAL  38          3HG2      VAL  38   6.789 -13.482 -11.212
  289    H    VAL  39           H        VAL  39   2.734 -12.919 -10.172
  290    HA   VAL  39           HA       VAL  39   1.514 -12.673  -7.534
  291    HB   VAL  39           HB       VAL  39   2.188 -10.526  -9.162
  292   1HG1  VAL  39          1HG1      VAL  39  -0.763 -11.007  -9.437
  293   2HG1  VAL  39          2HG1      VAL  39   0.435 -10.983 -10.733
  294   3HG1  VAL  39          3HG1      VAL  39   0.072  -9.506  -9.841
  295   1HG2  VAL  39          1HG2      VAL  39   0.900  -9.182  -7.574
  296   2HG2  VAL  39          2HG2      VAL  39   1.898 -10.407  -6.791
  297   3HG2  VAL  39          3HG2      VAL  39   0.161 -10.658  -6.955
  298    H    ARG  40           H        ARG  40  -0.937 -12.657  -7.831
  299    HA   ARG  40           HA       ARG  40  -1.769 -13.929 -10.319
  300   1HB   ARG  40          1HB       ARG  40  -1.625 -15.873  -9.031
  301   2HB   ARG  40          2HB       ARG  40  -2.101 -15.049  -7.552
  302   1HG   ARG  40          1HG       ARG  40  -4.378 -14.972  -8.228
  303   2HG   ARG  40          2HG       ARG  40  -3.975 -15.506  -9.857
  304   1HD   ARG  40          1HD       ARG  40  -3.649 -17.695  -9.199
  305   2HD   ARG  40          2HD       ARG  40  -3.314 -17.247  -7.522
  306    HE   ARG  40           HE       ARG  40  -5.621 -17.022  -7.136
  307   1HH1  ARG  40          1HH1      ARG  40  -4.970 -18.135 -10.410
  308   2HH1  ARG  40          2HH1      ARG  40  -6.602 -18.678 -10.659
  309   1HH2  ARG  40          1HH2      ARG  40  -7.752 -17.726  -7.505
  310   2HH2  ARG  40          2HH2      ARG  40  -8.165 -18.449  -9.035
  311    H    TRP  41           H        TRP  41  -3.556 -13.052 -11.103
  312    HA   TRP  41           HA       TRP  41  -5.115 -11.187  -9.559
  313   1HB   TRP  41          1HB       TRP  41  -6.125 -12.423 -12.097
  314   2HB   TRP  41          2HB       TRP  41  -6.327 -10.781 -11.512
  315    HD1  TRP  41           HD1      TRP  41  -4.652 -12.600 -14.131
  316    HE1  TRP  41           HE1      TRP  41  -2.736 -11.243 -15.179
  317    HE3  TRP  41           HE3      TRP  41  -4.125  -9.031 -10.507
  318    HZ2  TRP  41           HZ2      TRP  41  -1.198  -8.970 -14.542
  319    HZ3  TRP  41           HZ3      TRP  41  -2.397  -7.305 -10.805
  320    HH2  TRP  41           HH2      TRP  41  -0.967  -7.276 -12.780
  321    H    LEU  42           H        LEU  42  -5.936 -12.321  -7.825
  322    HA   LEU  42           HA       LEU  42  -6.514 -15.076  -7.901
  323   1HB   LEU  42          1HB       LEU  42  -7.845 -13.255  -5.947
  324   2HB   LEU  42          2HB       LEU  42  -7.259 -14.887  -5.711
  325    HG   LEU  42           HG       LEU  42  -5.610 -12.378  -5.897
  326   1HD1  LEU  42          1HD1      LEU  42  -6.797 -12.705  -3.820
  327   2HD1  LEU  42          2HD1      LEU  42  -5.065 -12.948  -3.595
  328   3HD1  LEU  42          3HD1      LEU  42  -6.149 -14.338  -3.686
  329   1HD2  LEU  42          1HD2      LEU  42  -4.694 -15.232  -5.565
  330   2HD2  LEU  42          2HD2      LEU  42  -3.681 -13.795  -5.429
  331   3HD2  LEU  42          3HD2      LEU  42  -4.416 -14.212  -6.977
  332    H    VAL  43           H        VAL  43  -8.862 -12.519  -7.229
  333    HA   VAL  43           HA       VAL  43 -11.072 -14.161  -7.618
  334    HB   VAL  43           HB       VAL  43 -12.287 -11.887  -7.765
  335   1HG1  VAL  43          1HG1      VAL  43 -12.105 -11.634  -5.348
  336   2HG1  VAL  43          2HG1      VAL  43 -10.650 -12.629  -5.357
  337   3HG1  VAL  43          3HG1      VAL  43 -12.205 -13.337  -5.799
  338   1HG2  VAL  43          1HG2      VAL  43  -9.568 -10.995  -6.828
  339   2HG2  VAL  43          2HG2      VAL  43 -11.037 -10.018  -6.820
  340   3HG2  VAL  43          3HG2      VAL  43 -10.329 -10.534  -8.352
  341    H    ASN  44           H        ASN  44  -9.288 -12.099  -9.773
  342    HA   ASN  44           HA       ASN  44 -10.974 -12.288 -11.987
  343   1HB   ASN  44          1HB       ASN  44  -7.976 -12.021 -11.814
  344   2HB   ASN  44          2HB       ASN  44  -8.858 -11.956 -13.337
  345   1HD2  ASN  44          1HD2      ASN  44  -8.312 -10.371 -10.268
  346   2HD2  ASN  44          2HD2      ASN  44  -8.973  -8.844 -10.738
  347    H    GLY  45           H        GLY  45  -7.995 -14.216 -11.468
  348   1HA   GLY  45          1HA       GLY  45  -8.430 -16.684 -11.356
  349   2HA   GLY  45          2HA       GLY  45  -9.385 -16.462 -12.807
  350    H    HIS  46           H        HIS  46  -6.230 -14.896 -12.284
  351    HA   HIS  46           HA       HIS  46  -4.957 -16.923 -13.984
  352   1HB   HIS  46          1HB       HIS  46  -5.389 -14.110 -14.747
  353   2HB   HIS  46          2HB       HIS  46  -3.765 -14.732 -15.023
  354    HD1  HIS  46           HD1      HIS  46  -5.670 -13.964 -17.353
  355    HD2  HIS  46           HD2      HIS  46  -5.167 -17.817 -15.852
  356    HE1  HIS  46           HE1      HIS  46  -6.332 -15.520 -19.220
  357    HE2  HIS  46           HE2      HIS  46  -5.861 -17.835 -18.349
  358    H    GLU  47           H        GLU  47  -2.518 -16.377 -14.232
  359    HA   GLU  47           HA       GLU  47  -1.397 -15.336 -11.711
  360   1HB   GLU  47          1HB       GLU  47  -0.502 -17.951 -12.949
  361   2HB   GLU  47          2HB       GLU  47   0.085 -17.236 -11.459
  362   1HG   GLU  47          1HG       GLU  47  -1.286 -18.950 -10.750
  363   2HG   GLU  47          2HG       GLU  47  -2.313 -17.525 -10.611
  364    H    THR  48           H        THR  48   0.429 -14.165 -12.032
  365    HA   THR  48           HA       THR  48   1.624 -14.179 -14.697
  366    HB   THR  48           HB       THR  48  -0.282 -12.614 -14.685
  367    HG1  THR  48           HG1      THR  48   0.804 -11.187 -15.919
  368   1HG2  THR  48          1HG2      THR  48   1.410 -11.054 -12.752
  369   2HG2  THR  48          2HG2      THR  48  -0.130 -11.829 -12.388
  370   3HG2  THR  48          3HG2      THR  48  -0.070 -10.477 -13.519
  371    H    THR  49           H        THR  49   3.213 -12.278 -14.805
  372    HA   THR  49           HA       THR  49   4.717 -11.833 -12.328
  373    HB   THR  49           HB       THR  49   5.999 -12.651 -14.959
  374    HG1  THR  49           HG1      THR  49   5.255 -14.079 -12.685
  375   1HG2  THR  49          1HG2      THR  49   7.227 -12.090 -12.259
  376   2HG2  THR  49          2HG2      THR  49   7.345 -11.056 -13.684
  377   3HG2  THR  49          3HG2      THR  49   8.092 -12.653 -13.687
  378    H    VAL  50           H        VAL  50   4.827  -9.639 -12.155
  379    HA   VAL  50           HA       VAL  50   4.541  -8.058 -14.613
  380    HB   VAL  50           HB       VAL  50   2.658  -6.771 -13.481
  381   1HG1  VAL  50          1HG1      VAL  50   0.952  -8.354 -14.308
  382   2HG1  VAL  50          2HG1      VAL  50   2.201  -9.592 -14.443
  383   3HG1  VAL  50          3HG1      VAL  50   2.287  -8.137 -15.438
  384   1HG2  VAL  50          1HG2      VAL  50   2.481  -9.325 -11.881
  385   2HG2  VAL  50          2HG2      VAL  50   1.288  -8.025 -11.891
  386   3HG2  VAL  50          3HG2      VAL  50   2.903  -7.735 -11.245
  387    H    TYR  51           H        TYR  51   4.118  -5.684 -13.918
  388    HA   TYR  51           HA       TYR  51   5.853  -4.854 -11.710
  389   1HB   TYR  51          1HB       TYR  51   5.999  -3.526 -14.422
  390   2HB   TYR  51          2HB       TYR  51   7.102  -3.348 -13.067
  391    HD1  TYR  51           HD1      TYR  51   6.165  -5.408 -15.938
  392    HD2  TYR  51           HD2      TYR  51   8.849  -5.011 -12.662
  393    HE1  TYR  51           HE1      TYR  51   7.643  -7.087 -16.958
  394    HE2  TYR  51           HE2      TYR  51  10.335  -6.693 -13.672
  395    HH   TYR  51           HH       TYR  51  10.217  -8.546 -15.270
  396    HA   PRO  52           HA       PRO  52   2.083  -2.486 -11.141
  397   1HB   PRO  52          1HB       PRO  52   3.728  -0.964  -9.206
  398   2HB   PRO  52          2HB       PRO  52   2.244  -1.883  -8.945
  399   1HG   PRO  52          1HG       PRO  52   4.605  -2.772  -8.059
  400   2HG   PRO  52          2HG       PRO  52   3.372  -3.884  -8.682
  401   1HD   PRO  52          1HD       PRO  52   5.843  -2.848 -10.016
  402   2HD   PRO  52          2HD       PRO  52   5.147  -4.483 -10.046
  403    H    GLY  53           H        GLY  53   5.107  -0.529 -10.898
  404   1HA   GLY  53          1HA       GLY  53   5.649   0.899 -12.818
  405   2HA   GLY  53          2HA       GLY  53   3.932   1.230 -12.964
  406    H    SER  54           H        SER  54   3.264   1.802 -10.348
  407    HA   SER  54           HA       SER  54   4.517   4.409 -10.067
  408   1HB   SER  54          1HB       SER  54   2.066   3.316  -8.706
  409   2HB   SER  54          2HB       SER  54   2.621   4.990  -8.669
  410    HG   SER  54           HG       SER  54   2.222   3.796 -11.162
  411    H    ASP  55           H        ASP  55   4.171   5.074  -7.513
  412    HA   ASP  55           HA       ASP  55   6.430   4.052  -6.243
  413   1HB   ASP  55          1HB       ASP  55   5.310   6.236  -5.748
  414   2HB   ASP  55          2HB       ASP  55   4.049   5.350  -4.900
  415    H    ALA  56           H        ALA  56   3.340   2.719  -6.584
  416    HA   ALA  56           HA       ALA  56   2.515   0.678  -6.024
  417   1HB   ALA  56          1HB       ALA  56   3.991  -1.080  -5.245
  418   2HB   ALA  56          2HB       ALA  56   5.235   0.107  -4.852
  419   3HB   ALA  56          3HB       ALA  56   4.755  -0.147  -6.529
  420    H    VAL  57           H        VAL  57   1.071   0.104  -4.492
  421    HA   VAL  57           HA       VAL  57   1.740   0.577  -1.663
  422    HB   VAL  57           HB       VAL  57  -0.560   1.350  -1.195
  423   1HG1  VAL  57          1HG1      VAL  57   1.221   2.985  -1.435
  424   2HG1  VAL  57          2HG1      VAL  57  -0.300   3.626  -2.054
  425   3HG1  VAL  57          3HG1      VAL  57   0.938   3.059  -3.174
  426   1HG2  VAL  57          1HG2      VAL  57  -1.697   0.399  -3.128
  427   2HG2  VAL  57          2HG2      VAL  57  -0.833   1.507  -4.194
  428   3HG2  VAL  57          3HG2      VAL  57  -1.986   2.135  -3.017
  429    H    VAL  58           H        VAL  58  -0.017  -0.489  -0.224
  430    HA   VAL  58           HA       VAL  58  -0.409  -3.211  -1.310
  431    HB   VAL  58           HB       VAL  58   0.295  -2.442   1.526
  432   1HG1  VAL  58          1HG1      VAL  58   0.604  -4.843   1.887
  433   2HG1  VAL  58          2HG1      VAL  58   0.044  -5.163   0.246
  434   3HG1  VAL  58          3HG1      VAL  58  -1.059  -4.467   1.434
  435   1HG2  VAL  58          1HG2      VAL  58   2.149  -2.088  -0.005
  436   2HG2  VAL  58          2HG2      VAL  58   1.965  -3.728  -0.624
  437   3HG2  VAL  58          3HG2      VAL  58   2.461  -3.469   1.048
  438    H    VAL  59           H        VAL  59  -2.353  -4.176  -1.059
  439    HA   VAL  59           HA       VAL  59  -4.318  -2.983   0.745
  440    HB   VAL  59           HB       VAL  59  -5.902  -4.103  -0.992
  441   1HG1  VAL  59          1HG1      VAL  59  -4.527  -1.482  -1.530
  442   2HG1  VAL  59          2HG1      VAL  59  -5.891  -1.724  -0.438
  443   3HG1  VAL  59          3HG1      VAL  59  -6.098  -1.961  -2.173
  444   1HG2  VAL  59          1HG2      VAL  59  -5.095  -3.892  -3.293
  445   2HG2  VAL  59          2HG2      VAL  59  -4.206  -5.107  -2.373
  446   3HG2  VAL  59          3HG2      VAL  59  -3.487  -3.523  -2.668
  447    H    THR  60           H        THR  60  -6.162  -4.660   1.073
  448    HA   THR  60           HA       THR  60  -4.899  -7.275   1.748
  449    HB   THR  60           HB       THR  60  -5.370  -5.725   3.690
  450    HG1  THR  60           HG1      THR  60  -5.306  -8.046   3.931
  451   1HG2  THR  60          1HG2      THR  60  -7.431  -4.702   2.900
  452   2HG2  THR  60          2HG2      THR  60  -7.679  -5.477   4.465
  453   3HG2  THR  60          3HG2      THR  60  -8.249  -6.260   2.991
  454    H    ALA  61           H        ALA  61  -7.229  -8.452   2.764
  455    HA   ALA  61           HA       ALA  61  -8.067  -9.784   0.470
  456   1HB   ALA  61          1HB       ALA  61  -7.993 -10.771   2.703
  457   2HB   ALA  61          2HB       ALA  61  -9.551 -11.021   1.913
  458   3HB   ALA  61          3HB       ALA  61  -9.388  -9.797   3.171
  459    H    THR  62           H        THR  62  -9.882  -7.298   2.334
  460    HA   THR  62           HA       THR  62 -12.195  -7.730   0.663
  461    HB   THR  62           HB       THR  62 -12.922  -5.567   1.886
  462    HG1  THR  62           HG1      THR  62 -11.760  -5.705   4.072
  463   1HG2  THR  62          1HG2      THR  62 -13.891  -7.776   2.273
  464   2HG2  THR  62          2HG2      THR  62 -13.690  -6.912   3.798
  465   3HG2  THR  62          3HG2      THR  62 -12.553  -8.183   3.347
  466    H    GLU  63           H        GLU  63  -9.594  -5.408   0.990
  467    HA   GLU  63           HA       GLU  63 -10.526  -3.559  -0.944
  468   1HB   GLU  63          1HB       GLU  63  -7.666  -4.216  -0.204
  469   2HB   GLU  63          2HB       GLU  63  -8.237  -2.738  -0.969
  470   1HG   GLU  63          1HG       GLU  63  -9.563  -2.245   1.053
  471   2HG   GLU  63          2HG       GLU  63  -8.886  -3.681   1.817
  472    H    HIS  64           H        HIS  64  -9.424  -6.705  -1.118
  473    HA   HIS  64           HA       HIS  64  -8.146  -6.624  -3.659
  474   1HB   HIS  64          1HB       HIS  64  -7.252  -8.446  -2.789
  475   2HB   HIS  64          2HB       HIS  64  -8.413  -8.427  -1.478
  476    HD1  HIS  64           HD1      HIS  64 -10.041 -10.305  -1.386
  477    HD2  HIS  64           HD2      HIS  64  -8.057 -10.119  -5.029
  478    HE1  HIS  64           HE1      HIS  64 -10.568 -12.466  -2.548
  479    HE2  HIS  64           HE2      HIS  64  -9.157 -12.423  -4.632
  480    H    ALA  65           H        ALA  65 -11.383  -7.900  -2.640
  481    HA   ALA  65           HA       ALA  65 -11.667  -9.555  -4.840
  482   1HB   ALA  65          1HB       ALA  65 -14.025  -9.641  -4.297
  483   2HB   ALA  65          2HB       ALA  65 -13.871  -8.186  -3.316
  484   3HB   ALA  65          3HB       ALA  65 -13.051  -9.669  -2.828
  485    H    GLU  66           H        GLU  66 -13.328  -6.463  -4.440
  486    HA   GLU  66           HA       GLU  66 -14.462  -6.615  -7.054
  487   1HB   GLU  66          1HB       GLU  66 -14.951  -4.057  -6.192
  488   2HB   GLU  66          2HB       GLU  66 -15.946  -5.458  -5.829
  489   1HG   GLU  66          1HG       GLU  66 -15.642  -4.526  -3.727
  490   2HG   GLU  66          2HG       GLU  66 -14.372  -5.745  -3.772
  491    H    ALA  67           H        ALA  67 -12.135  -4.401  -5.574
  492    HA   ALA  67           HA       ALA  67 -11.676  -2.941  -7.960
  493   1HB   ALA  67          1HB       ALA  67 -11.346  -1.990  -5.735
  494   2HB   ALA  67          2HB       ALA  67  -9.888  -1.864  -6.720
  495   3HB   ALA  67          3HB       ALA  67 -10.001  -3.097  -5.463
  496    H    GLU  68           H        GLU  68 -10.431  -5.957  -6.802
  497    HA   GLU  68           HA       GLU  68  -8.035  -5.889  -8.369
  498   1HB   GLU  68          1HB       GLU  68  -8.399  -7.510  -6.452
  499   2HB   GLU  68          2HB       GLU  68  -9.487  -8.396  -7.514
  500   1HG   GLU  68          1HG       GLU  68  -7.465  -8.384  -9.146
  501   2HG   GLU  68          2HG       GLU  68  -6.531  -8.057  -7.692
  502    H    LYS  69           H        LYS  69 -11.296  -7.270  -8.808
  503    HA   LYS  69           HA       LYS  69 -10.913  -8.345 -11.328
  504   1HB   LYS  69          1HB       LYS  69 -13.321  -6.823 -10.309
  505   2HB   LYS  69          2HB       LYS  69 -13.312  -7.816 -11.761
  506   1HG   LYS  69          1HG       LYS  69 -12.758  -9.784 -10.406
  507   2HG   LYS  69          2HG       LYS  69 -12.791  -8.783  -8.954
  508   1HD   LYS  69          1HD       LYS  69 -15.149  -8.276  -9.360
  509   2HD   LYS  69          2HD       LYS  69 -15.115  -9.271 -10.818
  510   1HE   LYS  69          1HE       LYS  69 -14.596 -10.241  -8.008
  511   2HE   LYS  69          2HE       LYS  69 -16.093 -10.466  -8.908
  512   1HZ   LYS  69          1HZ       LYS  69 -14.938 -11.815 -10.504
  513   2HZ   LYS  69          2HZ       LYS  69 -14.633 -12.427  -8.950
  514   3HZ   LYS  69          3HZ       LYS  69 -13.452 -11.518  -9.751
  515    H    ARG  70           H        ARG  70 -11.934  -4.976 -10.620
  516    HA   ARG  70           HA       ARG  70 -11.719  -4.138 -13.334
  517   1HB   ARG  70          1HB       ARG  70 -11.630  -2.514 -10.790
  518   2HB   ARG  70          2HB       ARG  70 -11.739  -1.819 -12.399
  519   1HG   ARG  70          1HG       ARG  70 -13.873  -3.020 -12.732
  520   2HG   ARG  70          2HG       ARG  70 -13.770  -3.599 -11.068
  521   1HD   ARG  70          1HD       ARG  70 -13.743  -1.270 -10.279
  522   2HD   ARG  70          2HD       ARG  70 -13.896  -0.715 -11.944
  523    HE   ARG  70           HE       ARG  70 -16.004  -2.492 -11.365
  524   1HH1  ARG  70          1HH1      ARG  70 -14.921   0.768 -10.639
  525   2HH1  ARG  70          2HH1      ARG  70 -16.520   1.347 -10.273
  526   1HH2  ARG  70          1HH2      ARG  70 -18.093  -1.731 -10.881
  527   2HH2  ARG  70          2HH2      ARG  70 -18.321  -0.083 -10.386
  528    H    ALA  71           H        ALA  71  -9.505  -3.467 -10.612
  529    HA   ALA  71           HA       ALA  71  -7.750  -1.980 -12.291
  530   1HB   ALA  71          1HB       ALA  71  -8.114  -1.414  -9.944
  531   2HB   ALA  71          2HB       ALA  71  -6.406  -1.641 -10.325
  532   3HB   ALA  71          3HB       ALA  71  -7.297  -2.901  -9.469
  533    H    ALA  72           H        ALA  72  -7.900  -5.346 -11.508
  534    HA   ALA  72           HA       ALA  72  -5.128  -5.837 -12.163
  535   1HB   ALA  72          1HB       ALA  72  -7.415  -7.798 -12.039
  536   2HB   ALA  72          2HB       ALA  72  -6.320  -7.409 -10.713
  537   3HB   ALA  72          3HB       ALA  72  -5.703  -8.201 -12.164
  538    H    ALA  73           H        ALA  73  -8.288  -6.104 -13.809
  539    HA   ALA  73           HA       ALA  73  -7.404  -6.945 -16.301
  540   1HB   ALA  73          1HB       ALA  73  -9.474  -4.825 -15.721
  541   2HB   ALA  73          2HB       ALA  73  -9.760  -6.566 -15.783
  542   3HB   ALA  73          3HB       ALA  73  -9.290  -5.695 -17.244
  543    H    ARG  74           H        ARG  74  -7.193  -3.763 -14.808
  544    HA   ARG  74           HA       ARG  74  -5.927  -2.557 -17.106
  545   1HB   ARG  74          1HB       ARG  74  -6.436  -1.644 -14.293
  546   2HB   ARG  74          2HB       ARG  74  -5.442  -0.697 -15.388
  547   1HG   ARG  74          1HG       ARG  74  -7.280  -0.457 -16.929
  548   2HG   ARG  74          2HG       ARG  74  -8.282  -1.529 -15.947
  549   1HD   ARG  74          1HD       ARG  74  -8.477   0.036 -14.228
  550   2HD   ARG  74          2HD       ARG  74  -7.091   0.965 -14.792
  551    HE   ARG  74           HE       ARG  74  -9.549   0.868 -16.400
  552   1HH1  ARG  74          1HH1      ARG  74  -7.229   2.655 -14.467
  553   2HH1  ARG  74          2HH1      ARG  74  -7.787   4.214 -15.026
  554   1HH2  ARG  74          1HH2      ARG  74 -10.300   2.909 -17.094
  555   2HH2  ARG  74          2HH2      ARG  74  -9.542   4.356 -16.495
  556    H    ALA  75           H        ALA  75  -4.762  -3.789 -13.996
  557    HA   ALA  75           HA       ALA  75  -2.147  -2.957 -13.836
  558   1HB   ALA  75          1HB       ALA  75  -3.321  -4.340 -12.172
  559   2HB   ALA  75          2HB       ALA  75  -1.709  -4.947 -12.549
  560   3HB   ALA  75          3HB       ALA  75  -3.131  -5.743 -13.224
  561    H    GLY  76           H        GLY  76  -3.274  -5.877 -15.551
  562   1HA   GLY  76          1HA       GLY  76  -0.591  -6.011 -16.785
  563   2HA   GLY  76          2HA       GLY  76  -1.641  -7.398 -16.553
  564    H    HIS  77           H        HIS  77  -2.829  -4.321 -17.677
  565    HA   HIS  77           HA       HIS  77  -3.750  -5.506 -20.143
  566   1HB   HIS  77          1HB       HIS  77  -5.051  -3.786 -18.817
  567   2HB   HIS  77          2HB       HIS  77  -3.865  -2.593 -19.329
  568    HD1  HIS  77           HD1      HIS  77  -7.114  -3.275 -20.075
  569    HD2  HIS  77           HD2      HIS  77  -3.732  -3.084 -22.496
  570    HE1  HIS  77           HE1      HIS  77  -7.963  -2.837 -22.403
  571    HE2  HIS  77           HE2      HIS  77  -5.892  -2.543 -23.813
  572    H    ALA  78           H        ALA  78  -1.648  -2.745 -19.321
  573    HA   ALA  78           HA       ALA  78  -0.197  -3.234 -21.834
  574   1HB   ALA  78          1HB       ALA  78   0.152  -0.831 -22.064
  575   2HB   ALA  78          2HB       ALA  78  -0.798  -0.545 -20.606
  576   3HB   ALA  78          3HB       ALA  78  -1.569  -1.220 -22.041
  577    H    ALA  79           H        ALA  79   1.411  -4.412 -20.852
  578    HA   ALA  79           HA       ALA  79   3.141  -2.894 -19.009
  579   1HB   ALA  79          1HB       ALA  79   3.811  -5.002 -17.988
  580   2HB   ALA  79          2HB       ALA  79   2.746  -5.885 -19.081
  581   3HB   ALA  79          3HB       ALA  79   2.063  -4.790 -17.880
  582    H    THR  80           H        THR  80   5.311  -2.888 -19.445
  583    HA   THR  80           HA       THR  80   7.205  -2.929 -20.682
  584    HB   THR  80           HB       THR  80   6.215  -5.566 -21.786
  585    HG1  THR  80           HG1      THR  80   6.611  -6.420 -19.880
  586   1HG2  THR  80          1HG2      THR  80   8.606  -6.093 -21.926
  587   2HG2  THR  80          2HG2      THR  80   8.998  -4.489 -21.301
  588   3HG2  THR  80          3HG2      THR  80   8.217  -4.657 -22.874
  Start of MODEL   13
    1    H    MET   1           H        MET   1   7.517   2.444   2.793
    2    HA   MET   1           HA       MET   1   5.943   1.544   1.220
    3   1HB   MET   1          1HB       MET   1   6.695   2.895  -0.709
    4   2HB   MET   1          2HB       MET   1   8.183   1.967  -0.775
    5   1HG   MET   1          1HG       MET   1   5.509   0.648  -1.048
    6   2HG   MET   1          2HG       MET   1   6.312   1.399  -2.424
    7   1HE   MET   1          1HE       MET   1   5.396  -1.711  -2.204
    8   2HE   MET   1          2HE       MET   1   6.773  -2.479  -2.997
    9   3HE   MET   1          3HE       MET   1   6.099  -0.982  -3.647
   10    H    HIS   2           H        HIS   2   5.855  -0.526   1.730
   11    HA   HIS   2           HA       HIS   2   8.175  -2.240   1.294
   12   1HB   HIS   2          1HB       HIS   2   6.697  -2.095   3.936
   13   2HB   HIS   2          2HB       HIS   2   7.761  -3.417   3.481
   14    HD1  HIS   2           HD1      HIS   2  10.246  -2.013   2.492
   15    HD2  HIS   2           HD2      HIS   2   8.045  -0.668   5.759
   16    HE1  HIS   2           HE1      HIS   2  11.844  -0.673   3.883
   17    HE2  HIS   2           HE2      HIS   2  10.553  -0.051   5.951
   18    H    ALA   3           H        ALA   3   7.577  -4.129   0.390
   19    HA   ALA   3           HA       ALA   3   4.701  -4.648   0.119
   20   1HB   ALA   3          1HB       ALA   3   5.323  -6.090  -1.750
   21   2HB   ALA   3          2HB       ALA   3   7.031  -5.808  -1.411
   22   3HB   ALA   3          3HB       ALA   3   6.006  -4.476  -1.945
   23    H    LYS   4           H        LYS   4   3.899  -6.840   0.333
   24    HA   LYS   4           HA       LYS   4   5.521  -8.566   2.065
   25   1HB   LYS   4          1HB       LYS   4   2.688  -7.668   2.617
   26   2HB   LYS   4          2HB       LYS   4   3.499  -8.966   3.479
   27   1HG   LYS   4          1HG       LYS   4   5.171  -7.382   4.296
   28   2HG   LYS   4          2HG       LYS   4   4.351  -6.078   3.433
   29   1HD   LYS   4          1HD       LYS   4   3.729  -6.107   5.798
   30   2HD   LYS   4          2HD       LYS   4   2.339  -6.453   4.767
   31   1HE   LYS   4          1HE       LYS   4   2.645  -8.855   5.191
   32   2HE   LYS   4          2HE       LYS   4   4.009  -8.488   6.246
   33   1HZ   LYS   4          1HZ       LYS   4   1.190  -7.647   6.675
   34   2HZ   LYS   4          2HZ       LYS   4   2.497  -7.236   7.676
   35   3HZ   LYS   4          3HZ       LYS   4   2.019  -8.859   7.532
   36    H    VAL   5           H        VAL   5   4.626 -10.746   2.284
   37    HA   VAL   5           HA       VAL   5   3.299 -11.620  -0.191
   38    HB   VAL   5           HB       VAL   5   4.956 -13.095   1.873
   39   1HG1  VAL   5          1HG1      VAL   5   3.433 -14.306  -0.435
   40   2HG1  VAL   5          2HG1      VAL   5   3.071 -14.534   1.277
   41   3HG1  VAL   5          3HG1      VAL   5   4.579 -15.156   0.603
   42   1HG2  VAL   5          1HG2      VAL   5   6.219 -11.901   0.188
   43   2HG2  VAL   5          2HG2      VAL   5   5.309 -12.709  -1.088
   44   3HG2  VAL   5          3HG2      VAL   5   6.376 -13.642  -0.037
   45    H    GLY   6           H        GLY   6   1.341 -12.616  -0.156
   46   1HA   GLY   6          1HA       GLY   6  -0.520 -13.697   0.848
   47   2HA   GLY   6          2HA       GLY   6   0.107 -13.251   2.433
   48    H    ASP   7           H        ASP   7   0.466 -10.710   0.404
   49    HA   ASP   7           HA       ASP   7  -2.142  -9.461   1.250
   50   1HB   ASP   7          1HB       ASP   7   0.661  -8.301   1.191
   51   2HB   ASP   7          2HB       ASP   7  -0.775  -7.288   1.185
   52    H    TYR   8           H        TYR   8  -2.499  -7.444  -0.183
   53    HA   TYR   8           HA       TYR   8  -2.136  -8.427  -2.921
   54   1HB   TYR   8          1HB       TYR   8  -4.342  -6.819  -1.647
   55   2HB   TYR   8          2HB       TYR   8  -4.188  -6.997  -3.393
   56    HD1  TYR   8           HD1      TYR   8  -4.626  -9.125  -4.467
   57    HD2  TYR   8           HD2      TYR   8  -5.021  -8.718  -0.253
   58    HE1  TYR   8           HE1      TYR   8  -5.843 -11.266  -4.386
   59    HE2  TYR   8           HE2      TYR   8  -6.238 -10.860  -0.169
   60    HH   TYR   8           HH       TYR   8  -6.179 -13.090  -2.543
   61    H    LEU   9           H        LEU   9  -1.669  -7.032  -4.578
   62    HA   LEU   9           HA       LEU   9  -0.193  -4.635  -3.790
   63   1HB   LEU   9          1HB       LEU   9   0.948  -6.423  -5.097
   64   2HB   LEU   9          2HB       LEU   9  -0.197  -6.174  -6.396
   65    HG   LEU   9           HG       LEU   9   1.545  -3.906  -5.471
   66   1HD1  LEU   9          1HD1      LEU   9   3.048  -5.784  -5.881
   67   2HD1  LEU   9          2HD1      LEU   9   3.193  -4.575  -7.158
   68   3HD1  LEU   9          3HD1      LEU   9   2.288  -6.060  -7.449
   69   1HD2  LEU   9          1HD2      LEU   9   0.326  -4.635  -8.138
   70   2HD2  LEU   9          2HD2      LEU   9   1.280  -3.192  -7.797
   71   3HD2  LEU   9          3HD2      LEU   9  -0.289  -3.415  -7.021
   72    H    VAL  10           H        VAL  10  -0.770  -2.680  -4.401
   73    HA   VAL  10           HA       VAL  10  -2.669  -2.254  -6.586
   74    HB   VAL  10           HB       VAL  10  -3.020  -1.332  -3.746
   75   1HG1  VAL  10          1HG1      VAL  10  -4.551   0.430  -4.486
   76   2HG1  VAL  10          2HG1      VAL  10  -4.104   0.114  -6.162
   77   3HG1  VAL  10          3HG1      VAL  10  -2.903   0.740  -5.032
   78   1HG2  VAL  10          1HG2      VAL  10  -5.360  -1.841  -4.211
   79   2HG2  VAL  10          2HG2      VAL  10  -4.316  -3.223  -4.546
   80   3HG2  VAL  10          3HG2      VAL  10  -4.940  -2.246  -5.875
   81    H    VAL  11           H        VAL  11  -2.126  -0.506  -7.830
   82    HA   VAL  11           HA       VAL  11  -0.071   1.314  -6.753
   83    HB   VAL  11           HB       VAL  11  -0.763   0.761  -9.648
   84   1HG1  VAL  11          1HG1      VAL  11  -0.121   3.088  -9.318
   85   2HG1  VAL  11          2HG1      VAL  11   1.144   2.209 -10.178
   86   3HG1  VAL  11          3HG1      VAL  11   1.336   2.579  -8.464
   87   1HG2  VAL  11          1HG2      VAL  11   1.695   0.082  -8.035
   88   2HG2  VAL  11          2HG2      VAL  11   1.489  -0.199  -9.763
   89   3HG2  VAL  11          3HG2      VAL  11   0.475  -1.058  -8.604
   90    H    LYS  12           H        LYS  12  -1.146   2.961  -5.836
   91    HA   LYS  12           HA       LYS  12  -3.577   3.948  -7.126
   92   1HB   LYS  12          1HB       LYS  12  -4.018   5.137  -5.048
   93   2HB   LYS  12          2HB       LYS  12  -3.699   3.439  -4.726
   94   1HG   LYS  12          1HG       LYS  12  -1.483   3.945  -3.944
   95   2HG   LYS  12          2HG       LYS  12  -1.663   5.638  -4.408
   96   1HD   LYS  12          1HD       LYS  12  -3.319   4.203  -2.328
   97   2HD   LYS  12          2HD       LYS  12  -1.978   5.301  -1.992
   98   1HE   LYS  12          1HE       LYS  12  -3.178   7.130  -3.042
   99   2HE   LYS  12          2HE       LYS  12  -4.499   6.046  -3.475
  100   1HZ   LYS  12          1HZ       LYS  12  -4.857   5.658  -1.086
  101   2HZ   LYS  12          2HZ       LYS  12  -5.083   7.278  -1.526
  102   3HZ   LYS  12          3HZ       LYS  12  -3.661   6.809  -0.728
  103    H    GLY  13           H        GLY  13  -0.280   4.733  -6.757
  104   1HA   GLY  13          1HA       GLY  13   0.808   6.466  -7.912
  105   2HA   GLY  13          2HA       GLY  13  -0.740   7.276  -8.101
  106    H    THR  14           H        THR  14  -1.404   8.755  -6.578
  107    HA   THR  14           HA       THR  14   0.485   9.211  -4.386
  108    HB   THR  14           HB       THR  14   1.207  10.803  -5.944
  109    HG1  THR  14           HG1      THR  14  -0.599  12.470  -4.584
  110   1HG2  THR  14          1HG2      THR  14  -1.675  11.574  -6.423
  111   2HG2  THR  14          2HG2      THR  14  -0.640  10.675  -7.533
  112   3HG2  THR  14          3HG2      THR  14  -0.266  12.354  -7.145
  113    H    THR  15           H        THR  15  -2.590  10.710  -5.523
  114    HA   THR  15           HA       THR  15  -3.641  10.393  -2.816
  115    HB   THR  15           HB       THR  15  -4.286  12.942  -3.045
  116    HG1  THR  15           HG1      THR  15  -3.063  14.059  -4.416
  117   1HG2  THR  15          1HG2      THR  15  -2.276  13.543  -1.766
  118   2HG2  THR  15          2HG2      THR  15  -1.518  12.025  -2.245
  119   3HG2  THR  15          3HG2      THR  15  -2.950  12.008  -1.216
  120    H    THR  16           H        THR  16  -4.420  12.276  -5.755
  121    HA   THR  16           HA       THR  16  -7.228  11.918  -5.200
  122    HB   THR  16           HB       THR  16  -7.469  13.436  -7.227
  123    HG1  THR  16           HG1      THR  16  -5.658  14.267  -8.114
  124   1HG2  THR  16          1HG2      THR  16  -7.567  14.258  -4.920
  125   2HG2  THR  16          2HG2      THR  16  -6.764  15.419  -5.975
  126   3HG2  THR  16          3HG2      THR  16  -5.810  14.404  -4.895
  127    H    GLU  17           H        GLU  17  -5.090  10.012  -6.814
  128    HA   GLU  17           HA       GLU  17  -6.883   9.328  -9.005
  129   1HB   GLU  17          1HB       GLU  17  -4.150   8.313  -8.227
  130   2HB   GLU  17          2HB       GLU  17  -5.089   7.630  -9.547
  131   1HG   GLU  17          1HG       GLU  17  -4.126  10.474  -9.348
  132   2HG   GLU  17          2HG       GLU  17  -3.435   9.207 -10.363
  133    H    ARG  18           H        ARG  18  -7.158   6.894  -9.367
  134    HA   ARG  18           HA       ARG  18  -8.572   5.830  -7.103
  135   1HB   ARG  18          1HB       ARG  18  -9.342   4.163  -8.605
  136   2HB   ARG  18          2HB       ARG  18  -9.226   5.633  -9.565
  137   1HG   ARG  18          1HG       ARG  18  -6.951   4.829 -10.296
  138   2HG   ARG  18          2HG       ARG  18  -7.349   3.286  -9.544
  139   1HD   ARG  18          1HD       ARG  18  -7.903   3.017 -11.802
  140   2HD   ARG  18          2HD       ARG  18  -9.442   3.312 -10.991
  141    HE   ARG  18           HE       ARG  18  -9.109   5.705 -11.748
  142   1HH1  ARG  18          1HH1      ARG  18  -7.722   2.984 -13.475
  143   2HH1  ARG  18          2HH1      ARG  18  -7.794   3.784 -15.022
  144   1HH2  ARG  18          1HH2      ARG  18  -9.177   6.764 -13.772
  145   2HH2  ARG  18          2HH2      ARG  18  -8.615   5.926 -15.196
  146    H    HIS  19           H        HIS  19  -8.254   3.340  -6.700
  147    HA   HIS  19           HA       HIS  19  -5.376   2.812  -6.519
  148   1HB   HIS  19          1HB       HIS  19  -6.057   0.907  -4.981
  149   2HB   HIS  19          2HB       HIS  19  -6.291   2.533  -4.368
  150    HD1  HIS  19           HD1      HIS  19  -8.509   0.054  -6.253
  151    HD2  HIS  19           HD2      HIS  19  -8.616   2.665  -3.029
  152    HE1  HIS  19           HE1      HIS  19 -10.788  -0.226  -5.233
  153    HE2  HIS  19           HE2      HIS  19 -10.734   1.181  -3.152
  154    H    ASP  20           H        ASP  20  -4.835   2.130  -8.495
  155    HA   ASP  20           HA       ASP  20  -6.479   0.085  -9.817
  156   1HB   ASP  20          1HB       ASP  20  -5.571   2.407 -10.831
  157   2HB   ASP  20          2HB       ASP  20  -4.194   1.382 -11.222
  158    H    GLN  21           H        GLN  21  -4.623  -1.074 -11.499
  159    HA   GLN  21           HA       GLN  21  -3.402  -3.012 -11.506
  160   1HB   GLN  21          1HB       GLN  21  -1.586  -1.116 -10.030
  161   2HB   GLN  21          2HB       GLN  21  -1.073  -2.725 -10.504
  162   1HG   GLN  21          1HG       GLN  21  -0.268  -1.421 -12.212
  163   2HG   GLN  21          2HG       GLN  21  -1.792  -2.005 -12.874
  164   1HE2  GLN  21          1HE2      GLN  21  -0.058   0.722 -11.645
  165   2HE2  GLN  21          2HE2      GLN  21  -1.185   1.928 -12.152
  166    H    HIS  22           H        HIS  22  -4.494  -4.609 -10.333
  167    HA   HIS  22           HA       HIS  22  -3.640  -4.863  -7.538
  168   1HB   HIS  22          1HB       HIS  22  -5.898  -3.745  -7.728
  169   2HB   HIS  22          2HB       HIS  22  -6.510  -5.263  -8.370
  170    HD1  HIS  22           HD1      HIS  22  -6.742  -3.566  -5.418
  171    HD2  HIS  22           HD2      HIS  22  -5.429  -7.405  -6.267
  172    HE1  HIS  22           HE1      HIS  22  -6.940  -4.838  -3.266
  173    HE2  HIS  22           HE2      HIS  22  -6.290  -7.195  -3.852
  174    H    ALA  23           H        ALA  23  -3.207  -6.781  -6.823
  175    HA   ALA  23           HA       ALA  23  -4.494  -9.256  -7.602
  176   1HB   ALA  23          1HB       ALA  23  -2.573 -10.396  -8.549
  177   2HB   ALA  23          2HB       ALA  23  -1.638  -8.902  -8.512
  178   3HB   ALA  23          3HB       ALA  23  -3.043  -9.036  -9.569
  179    H    GLU  24           H        GLU  24  -3.079 -11.107  -6.612
  180    HA   GLU  24           HA       GLU  24  -2.273 -10.125  -3.965
  181   1HB   GLU  24          1HB       GLU  24  -3.917 -11.964  -4.057
  182   2HB   GLU  24          2HB       GLU  24  -2.737 -12.963  -4.895
  183   1HG   GLU  24          1HG       GLU  24  -1.292 -12.948  -2.959
  184   2HG   GLU  24          2HG       GLU  24  -2.387 -11.853  -2.118
  185    H    ILE  25           H        ILE  25  -0.260 -10.270  -3.184
  186    HA   ILE  25           HA       ILE  25   1.800 -11.224  -5.029
  187    HB   ILE  25           HB       ILE  25   2.537  -9.931  -2.453
  188   1HG1  ILE  25          1HG1      ILE  25   1.528  -8.328  -4.816
  189   2HG1  ILE  25          2HG1      ILE  25   0.631  -8.560  -3.318
  190   1HG2  ILE  25          1HG2      ILE  25   4.286  -8.960  -3.863
  191   2HG2  ILE  25          2HG2      ILE  25   3.547  -9.695  -5.286
  192   3HG2  ILE  25          3HG2      ILE  25   4.229 -10.715  -4.018
  193   1HD1  ILE  25          1HD1      ILE  25   1.749  -6.398  -3.373
  194   2HD1  ILE  25          2HD1      ILE  25   3.307  -7.203  -3.566
  195   3HD1  ILE  25          3HD1      ILE  25   2.383  -7.417  -2.079
  196    H    ILE  26           H        ILE  26   2.115 -13.321  -4.788
  197    HA   ILE  26           HA       ILE  26   2.394 -14.405  -2.067
  198    HB   ILE  26           HB       ILE  26   2.105 -16.628  -2.945
  199   1HG1  ILE  26          1HG1      ILE  26   3.201 -16.212  -5.187
  200   2HG1  ILE  26          2HG1      ILE  26   1.718 -17.153  -5.268
  201   1HG2  ILE  26          1HG2      ILE  26  -0.000 -14.739  -4.039
  202   2HG2  ILE  26          2HG2      ILE  26   0.074 -15.389  -2.402
  203   3HG2  ILE  26          3HG2      ILE  26  -0.224 -16.466  -3.765
  204   1HD1  ILE  26          1HD1      ILE  26   0.506 -15.176  -6.009
  205   2HD1  ILE  26          2HD1      ILE  26   1.853 -15.560  -7.080
  206   3HD1  ILE  26          3HD1      ILE  26   1.994 -14.233  -5.926
  207    H    GLU  27           H        GLU  27   4.029 -13.728  -5.025
  208    HA   GLU  27           HA       GLU  27   6.479 -14.920  -3.914
  209   1HB   GLU  27          1HB       GLU  27   5.808 -14.329  -6.803
  210   2HB   GLU  27          2HB       GLU  27   7.329 -14.989  -6.226
  211   1HG   GLU  27          1HG       GLU  27   4.710 -16.371  -5.774
  212   2HG   GLU  27          2HG       GLU  27   5.662 -16.601  -7.238
  213    H    VAL  28           H        VAL  28   7.268 -13.264  -2.778
  214    HA   VAL  28           HA       VAL  28   7.744 -10.729  -4.162
  215    HB   VAL  28           HB       VAL  28   7.774 -11.372  -1.209
  216   1HG1  VAL  28          1HG1      VAL  28   9.550  -9.786  -1.725
  217   2HG1  VAL  28          2HG1      VAL  28   8.235  -9.003  -0.848
  218   3HG1  VAL  28          3HG1      VAL  28   8.398  -8.768  -2.588
  219   1HG2  VAL  28          1HG2      VAL  28   5.550 -11.102  -2.171
  220   2HG2  VAL  28          2HG2      VAL  28   6.026  -9.547  -2.856
  221   3HG2  VAL  28          3HG2      VAL  28   5.943  -9.753  -1.106
  222    H    ARG  29           H        ARG  29   9.826 -10.281  -4.774
  223    HA   ARG  29           HA       ARG  29  11.679 -12.425  -4.669
  224   1HB   ARG  29          1HB       ARG  29  12.096  -9.606  -5.656
  225   2HB   ARG  29          2HB       ARG  29  13.168 -10.966  -5.962
  226   1HG   ARG  29          1HG       ARG  29  11.146 -12.100  -7.029
  227   2HG   ARG  29          2HG       ARG  29  10.392 -10.506  -7.001
  228   1HD   ARG  29          1HD       ARG  29  12.987 -11.231  -8.354
  229   2HD   ARG  29          2HD       ARG  29  11.444 -10.932  -9.153
  230    HE   ARG  29           HE       ARG  29  11.643  -8.609  -8.213
  231   1HH1  ARG  29          1HH1      ARG  29  14.467 -10.595  -8.814
  232   2HH1  ARG  29          2HH1      ARG  29  15.530  -9.248  -9.087
  233   1HH2  ARG  29          1HH2      ARG  29  13.026  -6.826  -8.602
  234   2HH2  ARG  29          2HH2      ARG  29  14.709  -7.093  -8.954
  235    H    SER  30           H        SER  30  11.526  -9.325  -3.035
  236    HA   SER  30           HA       SER  30  13.308 -10.396  -1.009
  237   1HB   SER  30          1HB       SER  30  14.637  -8.287  -0.935
  238   2HB   SER  30          2HB       SER  30  14.863  -9.189  -2.433
  239    HG   SER  30           HG       SER  30  14.380  -6.742  -2.400
  240    H    ALA  31           H        ALA  31  12.965  -9.510   1.036
  241    HA   ALA  31           HA       ALA  31  10.292  -8.627   1.439
  242   1HB   ALA  31          1HB       ALA  31  10.805  -8.745   3.806
  243   2HB   ALA  31          2HB       ALA  31  12.525  -8.885   3.444
  244   3HB   ALA  31          3HB       ALA  31  11.417 -10.171   2.970
  245    H    ASP  32           H        ASP  32  10.546  -6.648   0.141
  246    HA   ASP  32           HA       ASP  32  10.559  -4.377   1.828
  247   1HB   ASP  32          1HB       ASP  32  12.966  -4.437   1.656
  248   2HB   ASP  32          2HB       ASP  32  12.883  -4.643  -0.091
  249    H    GLY  33           H        GLY  33  11.236  -5.215  -1.563
  250   1HA   GLY  33          1HA       GLY  33   8.972  -4.848  -2.854
  251   2HA   GLY  33          2HA       GLY  33   9.315  -3.180  -2.410
  252    H    SER  34           H        SER  34  10.269  -5.887  -4.374
  253    HA   SER  34           HA       SER  34  11.927  -4.074  -5.971
  254   1HB   SER  34          1HB       SER  34  13.449  -6.073  -6.374
  255   2HB   SER  34          2HB       SER  34  13.519  -5.365  -4.760
  256    HG   SER  34           HG       SER  34  13.034  -7.273  -4.050
  257    HA   PRO  35           HA       PRO  35   8.897  -5.850  -8.917
  258   1HB   PRO  35          1HB       PRO  35   9.947  -3.576 -10.496
  259   2HB   PRO  35          2HB       PRO  35   8.274  -4.016 -10.138
  260   1HG   PRO  35          1HG       PRO  35   9.431  -1.907  -8.971
  261   2HG   PRO  35          2HG       PRO  35   8.290  -2.939  -8.090
  262   1HD   PRO  35          1HD       PRO  35  11.281  -2.876  -7.960
  263   2HD   PRO  35          2HD       PRO  35  10.099  -3.066  -6.648
  264    HA   PRO  36           HA       PRO  36   8.214  -6.317 -10.982
  265   1HB   PRO  36          1HB       PRO  36   7.981  -8.676 -12.241
  266   2HB   PRO  36          2HB       PRO  36   8.552  -7.228 -13.082
  267   1HG   PRO  36          1HG       PRO  36  10.124  -9.513 -11.958
  268   2HG   PRO  36          2HG       PRO  36  10.327  -8.667 -13.503
  269   1HD   PRO  36          1HD       PRO  36  11.851  -8.166 -11.282
  270   2HD   PRO  36          2HD       PRO  36  11.535  -6.968 -12.551
  271    H    TYR  37           H        TYR  37   6.487  -7.843 -10.349
  272    HA   TYR  37           HA       TYR  37   7.305  -9.533  -8.062
  273   1HB   TYR  37          1HB       TYR  37   4.712  -8.044  -8.539
  274   2HB   TYR  37          2HB       TYR  37   4.999  -9.147  -7.200
  275    HD1  TYR  37           HD1      TYR  37   6.490  -8.514  -5.364
  276    HD2  TYR  37           HD2      TYR  37   5.671  -5.823  -8.560
  277    HE1  TYR  37           HE1      TYR  37   7.370  -6.654  -4.017
  278    HE2  TYR  37           HE2      TYR  37   6.551  -3.957  -7.218
  279    HH   TYR  37           HH       TYR  37   6.907  -3.405  -4.854
  280    H    VAL  38           H        VAL  38   6.149 -11.558  -7.813
  281    HA   VAL  38           HA       VAL  38   4.886 -12.422 -10.325
  282    HB   VAL  38           HB       VAL  38   5.718 -14.123  -7.961
  283   1HG1  VAL  38          1HG1      VAL  38   4.666 -14.905 -10.684
  284   2HG1  VAL  38          2HG1      VAL  38   3.799 -15.049  -9.155
  285   3HG1  VAL  38          3HG1      VAL  38   5.241 -16.021  -9.445
  286   1HG2  VAL  38          1HG2      VAL  38   7.488 -14.949  -9.435
  287   2HG2  VAL  38          2HG2      VAL  38   7.635 -13.210  -9.183
  288   3HG2  VAL  38          3HG2      VAL  38   6.970 -13.829 -10.695
  289    H    VAL  39           H        VAL  39   2.867 -11.977 -10.391
  290    HA   VAL  39           HA       VAL  39   1.485 -11.514  -7.858
  291    HB   VAL  39           HB       VAL  39   2.052  -9.812  -9.969
  292   1HG1  VAL  39          1HG1      VAL  39  -0.110  -9.115 -10.858
  293   2HG1  VAL  39          2HG1      VAL  39  -0.879 -10.484 -10.055
  294   3HG1  VAL  39          3HG1      VAL  39   0.299 -10.762 -11.337
  295   1HG2  VAL  39          1HG2      VAL  39   0.017  -9.525  -7.770
  296   2HG2  VAL  39          2HG2      VAL  39   0.696  -8.200  -8.715
  297   3HG2  VAL  39          3HG2      VAL  39   1.739  -9.163  -7.670
  298    H    ARG  40           H        ARG  40  -0.868 -11.751  -7.921
  299    HA   ARG  40           HA       ARG  40  -1.624 -14.118  -9.499
  300   1HB   ARG  40          1HB       ARG  40  -0.683 -14.502  -7.146
  301   2HB   ARG  40          2HB       ARG  40  -2.136 -13.729  -6.554
  302   1HG   ARG  40          1HG       ARG  40  -3.493 -15.501  -7.510
  303   2HG   ARG  40          2HG       ARG  40  -2.036 -16.275  -8.157
  304   1HD   ARG  40          1HD       ARG  40  -1.137 -16.398  -5.851
  305   2HD   ARG  40          2HD       ARG  40  -2.656 -15.741  -5.253
  306    HE   ARG  40           HE       ARG  40  -2.962 -18.138  -6.812
  307   1HH1  ARG  40          1HH1      ARG  40  -2.488 -16.768  -3.616
  308   2HH1  ARG  40          2HH1      ARG  40  -2.919 -18.237  -2.786
  309   1HH2  ARG  40          1HH2      ARG  40  -3.533 -20.070  -5.717
  310   2HH2  ARG  40          2HH2      ARG  40  -3.529 -20.097  -3.979
  311    H    TRP  41           H        TRP  41  -3.210 -13.060 -10.762
  312    HA   TRP  41           HA       TRP  41  -5.219 -11.428  -9.446
  313   1HB   TRP  41          1HB       TRP  41  -5.944 -12.400 -12.111
  314   2HB   TRP  41          2HB       TRP  41  -5.878 -10.756 -11.500
  315    HD1  TRP  41           HD1      TRP  41  -3.872 -13.315 -13.441
  316    HE1  TRP  41           HE1      TRP  41  -1.881 -12.148 -14.562
  317    HE3  TRP  41           HE3      TRP  41  -4.223  -8.753 -11.163
  318    HZ2  TRP  41           HZ2      TRP  41  -0.615  -9.620 -14.487
  319    HZ3  TRP  41           HZ3      TRP  41  -2.582  -7.016 -11.744
  320    HH2  TRP  41           HH2      TRP  41  -0.815  -7.442 -13.372
  321    H    LEU  42           H        LEU  42  -5.770 -13.056  -7.922
  322    HA   LEU  42           HA       LEU  42  -6.619 -15.652  -8.932
  323   1HB   LEU  42          1HB       LEU  42  -6.816 -16.176  -6.480
  324   2HB   LEU  42          2HB       LEU  42  -5.214 -15.753  -7.058
  325    HG   LEU  42           HG       LEU  42  -5.942 -13.337  -6.263
  326   1HD1  LEU  42          1HD1      LEU  42  -7.253 -13.441  -4.210
  327   2HD1  LEU  42          2HD1      LEU  42  -7.560 -15.156  -4.494
  328   3HD1  LEU  42          3HD1      LEU  42  -8.193 -13.948  -5.612
  329   1HD2  LEU  42          1HD2      LEU  42  -4.009 -14.562  -5.501
  330   2HD2  LEU  42          2HD2      LEU  42  -5.024 -15.526  -4.429
  331   3HD2  LEU  42          3HD2      LEU  42  -4.839 -13.795  -4.150
  332    H    VAL  43           H        VAL  43  -8.067 -12.741  -7.766
  333    HA   VAL  43           HA       VAL  43 -10.627 -14.027  -7.278
  334    HB   VAL  43           HB       VAL  43  -9.581 -11.906  -6.118
  335   1HG1  VAL  43          1HG1      VAL  43  -9.341 -10.536  -8.072
  336   2HG1  VAL  43          2HG1      VAL  43 -10.496  -9.810  -6.955
  337   3HG1  VAL  43          3HG1      VAL  43 -11.071 -10.646  -8.397
  338   1HG2  VAL  43          1HG2      VAL  43 -11.816 -11.167  -5.466
  339   2HG2  VAL  43          2HG2      VAL  43 -11.639 -12.922  -5.432
  340   3HG2  VAL  43          3HG2      VAL  43 -12.503 -12.148  -6.761
  341    H    ASN  44           H        ASN  44  -8.857 -13.008  -9.860
  342    HA   ASN  44           HA       ASN  44 -11.184 -12.656 -11.608
  343   1HB   ASN  44          1HB       ASN  44  -8.214 -12.353 -12.141
  344   2HB   ASN  44          2HB       ASN  44  -9.462 -12.180 -13.373
  345   1HD2  ASN  44          1HD2      ASN  44  -7.917 -10.738 -10.635
  346   2HD2  ASN  44          2HD2      ASN  44  -8.655  -9.183 -10.785
  347    H    GLY  45           H        GLY  45  -8.095 -14.444 -11.654
  348   1HA   GLY  45          1HA       GLY  45  -8.566 -16.971 -11.566
  349   2HA   GLY  45          2HA       GLY  45  -9.487 -16.648 -13.026
  350    H    HIS  46           H        HIS  46  -6.341 -15.314 -12.029
  351    HA   HIS  46           HA       HIS  46  -4.895 -16.979 -13.888
  352   1HB   HIS  46          1HB       HIS  46  -5.509 -14.122 -14.529
  353   2HB   HIS  46          2HB       HIS  46  -3.929 -14.761 -14.962
  354    HD1  HIS  46           HD1      HIS  46  -7.227 -14.357 -16.295
  355    HD2  HIS  46           HD2      HIS  46  -4.248 -17.247 -16.608
  356    HE1  HIS  46           HE1      HIS  46  -7.763 -15.667 -18.373
  357    HE2  HIS  46           HE2      HIS  46  -6.012 -17.477 -18.485
  358    H    GLU  47           H        GLU  47  -2.543 -16.460 -13.882
  359    HA   GLU  47           HA       GLU  47  -1.592 -14.787 -11.699
  360   1HB   GLU  47          1HB       GLU  47  -2.022 -16.949 -10.605
  361   2HB   GLU  47          2HB       GLU  47  -1.039 -17.765 -11.808
  362   1HG   GLU  47          1HG       GLU  47   0.211 -15.605 -10.191
  363   2HG   GLU  47          2HG       GLU  47  -0.099 -17.161  -9.425
  364    H    THR  48           H        THR  48   0.379 -13.901 -12.169
  365    HA   THR  48           HA       THR  48   2.223 -15.035 -14.012
  366    HB   THR  48           HB       THR  48   0.512 -14.370 -15.624
  367    HG1  THR  48           HG1      THR  48   2.260 -14.129 -16.765
  368   1HG2  THR  48          1HG2      THR  48  -0.516 -12.506 -14.434
  369   2HG2  THR  48          2HG2      THR  48   0.022 -11.986 -16.031
  370   3HG2  THR  48          3HG2      THR  48   0.968 -11.567 -14.603
  371    H    THR  49           H        THR  49   3.726 -13.188 -14.806
  372    HA   THR  49           HA       THR  49   4.509 -11.724 -12.379
  373    HB   THR  49           HB       THR  49   6.156 -12.252 -14.863
  374    HG1  THR  49           HG1      THR  49   5.344 -14.002 -13.089
  375   1HG2  THR  49          1HG2      THR  49   6.940 -10.369 -13.498
  376   2HG2  THR  49          2HG2      THR  49   8.058 -11.730 -13.409
  377   3HG2  THR  49          3HG2      THR  49   6.954 -11.408 -12.072
  378    H    VAL  50           H        VAL  50   4.284  -9.562 -12.303
  379    HA   VAL  50           HA       VAL  50   3.806  -8.162 -14.846
  380    HB   VAL  50           HB       VAL  50   1.670  -8.759 -13.629
  381   1HG1  VAL  50          1HG1      VAL  50   2.646  -6.676 -11.684
  382   2HG1  VAL  50          2HG1      VAL  50   2.421  -8.394 -11.352
  383   3HG1  VAL  50          3HG1      VAL  50   1.027  -7.377 -11.719
  384   1HG2  VAL  50          1HG2      VAL  50   0.631  -6.577 -14.011
  385   2HG2  VAL  50          2HG2      VAL  50   1.740  -7.007 -15.314
  386   3HG2  VAL  50          3HG2      VAL  50   2.229  -5.832 -14.092
  387    H    TYR  51           H        TYR  51   4.185  -5.927 -14.837
  388    HA   TYR  51           HA       TYR  51   5.930  -4.948 -12.685
  389   1HB   TYR  51          1HB       TYR  51   5.592  -3.831 -15.482
  390   2HB   TYR  51          2HB       TYR  51   6.806  -3.361 -14.300
  391    HD1  TYR  51           HD1      TYR  51   5.780  -5.953 -16.693
  392    HD2  TYR  51           HD2      TYR  51   8.776  -4.714 -13.941
  393    HE1  TYR  51           HE1      TYR  51   7.318  -7.629 -17.625
  394    HE2  TYR  51           HE2      TYR  51  10.323  -6.385 -14.868
  395    HH   TYR  51           HH       TYR  51   9.867  -7.928 -17.766
  396    HA   PRO  52           HA       PRO  52   2.035  -2.728 -11.814
  397   1HB   PRO  52          1HB       PRO  52   2.785  -1.916  -9.327
  398   2HB   PRO  52          2HB       PRO  52   2.144  -3.526  -9.666
  399   1HG   PRO  52          1HG       PRO  52   4.989  -2.651  -9.338
  400   2HG   PRO  52          2HG       PRO  52   4.179  -4.090  -8.690
  401   1HD   PRO  52          1HD       PRO  52   5.756  -4.194 -10.874
  402   2HD   PRO  52          2HD       PRO  52   4.323  -5.228 -10.694
  403    H    GLY  53           H        GLY  53   5.332  -1.563 -11.476
  404   1HA   GLY  53          1HA       GLY  53   5.944   0.531 -12.537
  405   2HA   GLY  53          2HA       GLY  53   4.375   1.162 -12.054
  406    H    SER  54           H        SER  54   4.669   2.686 -10.588
  407    HA   SER  54           HA       SER  54   6.534   2.158  -8.374
  408   1HB   SER  54          1HB       SER  54   5.964   4.850  -9.645
  409   2HB   SER  54          2HB       SER  54   7.094   4.531  -8.329
  410    HG   SER  54           HG       SER  54   8.159   3.057  -9.880
  411    H    ASP  55           H        ASP  55   6.004   3.451  -6.407
  412    HA   ASP  55           HA       ASP  55   4.604   3.917  -4.699
  413   1HB   ASP  55          1HB       ASP  55   3.114   5.121  -7.005
  414   2HB   ASP  55          2HB       ASP  55   2.402   5.119  -5.393
  415    H    ALA  56           H        ALA  56   4.597   1.382  -5.149
  416    HA   ALA  56           HA       ALA  56   1.871   0.411  -5.462
  417   1HB   ALA  56          1HB       ALA  56   4.419  -1.147  -5.026
  418   2HB   ALA  56          2HB       ALA  56   3.678  -0.807  -6.588
  419   3HB   ALA  56          3HB       ALA  56   2.837  -1.822  -5.418
  420    H    VAL  57           H        VAL  57   0.579   0.286  -3.809
  421    HA   VAL  57           HA       VAL  57   1.666   0.244  -1.089
  422    HB   VAL  57           HB       VAL  57  -0.547   0.927  -0.340
  423   1HG1  VAL  57          1HG1      VAL  57  -0.650   3.146  -1.369
  424   2HG1  VAL  57          2HG1      VAL  57   0.422   2.593  -2.656
  425   3HG1  VAL  57          3HG1      VAL  57   1.008   2.673  -0.995
  426   1HG2  VAL  57          1HG2      VAL  57  -2.321   1.468  -1.958
  427   2HG2  VAL  57          2HG2      VAL  57  -1.918  -0.249  -1.952
  428   3HG2  VAL  57          3HG2      VAL  57  -1.329   0.790  -3.249
  429    H    VAL  58           H        VAL  58   0.196  -1.006   0.490
  430    HA   VAL  58           HA       VAL  58  -0.203  -3.673  -0.695
  431    HB   VAL  58           HB       VAL  58   0.665  -2.992   2.120
  432   1HG1  VAL  58          1HG1      VAL  58   0.395  -5.654   0.734
  433   2HG1  VAL  58          2HG1      VAL  58  -0.626  -5.048   2.039
  434   3HG1  VAL  58          3HG1      VAL  58   1.077  -5.398   2.340
  435   1HG2  VAL  58          1HG2      VAL  58   2.829  -3.929   1.460
  436   2HG2  VAL  58          2HG2      VAL  58   2.413  -2.520   0.485
  437   3HG2  VAL  58          3HG2      VAL  58   2.235  -4.142  -0.187
  438    H    VAL  59           H        VAL  59  -2.246  -4.259  -0.787
  439    HA   VAL  59           HA       VAL  59  -4.156  -3.251   1.198
  440    HB   VAL  59           HB       VAL  59  -5.769  -4.167  -0.643
  441   1HG1  VAL  59          1HG1      VAL  59  -5.811  -1.951  -1.695
  442   2HG1  VAL  59          2HG1      VAL  59  -4.255  -1.586  -0.948
  443   3HG1  VAL  59          3HG1      VAL  59  -5.680  -1.848   0.061
  444   1HG2  VAL  59          1HG2      VAL  59  -4.897  -3.847  -2.903
  445   2HG2  VAL  59          2HG2      VAL  59  -4.073  -5.151  -2.051
  446   3HG2  VAL  59          3HG2      VAL  59  -3.290  -3.582  -2.228
  447    H    THR  60           H        THR  60  -6.115  -4.827   1.214
  448    HA   THR  60           HA       THR  60  -5.091  -7.556   1.770
  449    HB   THR  60           HB       THR  60  -6.880  -7.420   3.678
  450    HG1  THR  60           HG1      THR  60  -6.345  -4.646   3.324
  451   1HG2  THR  60          1HG2      THR  60  -5.237  -6.485   5.226
  452   2HG2  THR  60          2HG2      THR  60  -4.332  -5.827   3.864
  453   3HG2  THR  60          3HG2      THR  60  -4.471  -7.572   4.069
  454    H    ALA  61           H        ALA  61  -7.487  -8.687   2.582
  455    HA   ALA  61           HA       ALA  61  -8.580  -9.637   0.276
  456   1HB   ALA  61          1HB       ALA  61  -9.928  -9.551   2.961
  457   2HB   ALA  61          2HB       ALA  61  -8.711 -10.724   2.459
  458   3HB   ALA  61          3HB       ALA  61 -10.274 -10.671   1.644
  459    H    THR  62           H        THR  62 -10.043  -6.992   2.254
  460    HA   THR  62           HA       THR  62 -12.483  -7.000   0.802
  461    HB   THR  62           HB       THR  62 -12.407  -4.473   1.658
  462    HG1  THR  62           HG1      THR  62 -11.127  -4.332   3.522
  463   1HG2  THR  62          1HG2      THR  62 -12.856  -6.893   3.404
  464   2HG2  THR  62          2HG2      THR  62 -14.040  -6.153   2.325
  465   3HG2  THR  62          3HG2      THR  62 -13.455  -5.266   3.735
  466    H    GLU  63           H        GLU  63  -9.679  -4.864   0.617
  467    HA   GLU  63           HA       GLU  63 -10.498  -3.392  -1.633
  468   1HB   GLU  63          1HB       GLU  63  -7.723  -4.059  -0.637
  469   2HB   GLU  63          2HB       GLU  63  -8.093  -2.818  -1.825
  470   1HG   GLU  63          1HG       GLU  63  -9.213  -2.824   0.960
  471   2HG   GLU  63          2HG       GLU  63  -7.710  -2.013   0.515
  472    H    HIS  64           H        HIS  64  -9.480  -6.586  -1.297
  473    HA   HIS  64           HA       HIS  64  -8.135  -6.834  -3.795
  474   1HB   HIS  64          1HB       HIS  64  -7.308  -8.610  -2.769
  475   2HB   HIS  64          2HB       HIS  64  -8.427  -8.376  -1.440
  476    HD1  HIS  64           HD1      HIS  64  -8.056 -10.314  -4.672
  477    HD2  HIS  64           HD2      HIS  64 -10.345 -10.324  -1.192
  478    HE1  HIS  64           HE1      HIS  64  -9.271 -12.510  -4.648
  479    HE2  HIS  64           HE2      HIS  64 -10.412 -12.599  -2.411
  480    H    ALA  65           H        ALA  65 -11.469  -7.272  -2.783
  481    HA   ALA  65           HA       ALA  65 -12.177  -9.076  -4.852
  482   1HB   ALA  65          1HB       ALA  65 -14.481  -8.529  -4.280
  483   2HB   ALA  65          2HB       ALA  65 -13.936  -7.129  -3.359
  484   3HB   ALA  65          3HB       ALA  65 -13.516  -8.755  -2.821
  485    H    GLU  66           H        GLU  66 -13.365  -5.777  -4.563
  486    HA   GLU  66           HA       GLU  66 -14.223  -5.649  -7.233
  487   1HB   GLU  66          1HB       GLU  66 -14.258  -3.062  -6.464
  488   2HB   GLU  66          2HB       GLU  66 -15.483  -4.232  -5.999
  489   1HG   GLU  66          1HG       GLU  66 -14.971  -3.195  -3.985
  490   2HG   GLU  66          2HG       GLU  66 -13.982  -4.653  -3.928
  491    H    ALA  67           H        ALA  67 -11.456  -4.181  -5.580
  492    HA   ALA  67           HA       ALA  67 -10.549  -2.743  -7.823
  493   1HB   ALA  67          1HB       ALA  67  -8.521  -2.361  -6.572
  494   2HB   ALA  67          2HB       ALA  67  -8.956  -3.637  -5.436
  495   3HB   ALA  67          3HB       ALA  67  -9.931  -2.170  -5.531
  496    H    GLU  68           H        GLU  68  -9.755  -6.049  -6.693
  497    HA   GLU  68           HA       GLU  68  -7.490  -6.264  -8.399
  498   1HB   GLU  68          1HB       GLU  68  -7.990  -7.762  -6.451
  499   2HB   GLU  68          2HB       GLU  68  -9.203  -8.542  -7.451
  500   1HG   GLU  68          1HG       GLU  68  -7.484  -9.240  -9.019
  501   2HG   GLU  68          2HG       GLU  68  -6.258  -8.423  -8.044
  502    H    LYS  69           H        LYS  69 -10.925  -7.115  -8.811
  503    HA   LYS  69           HA       LYS  69 -10.642  -8.316 -11.328
  504   1HB   LYS  69          1HB       LYS  69 -12.925  -6.660 -10.249
  505   2HB   LYS  69          2HB       LYS  69 -13.009  -7.604 -11.731
  506   1HG   LYS  69          1HG       LYS  69 -12.564  -9.642 -10.440
  507   2HG   LYS  69          2HG       LYS  69 -12.520  -8.681  -8.962
  508   1HD   LYS  69          1HD       LYS  69 -14.841  -7.988  -9.360
  509   2HD   LYS  69          2HD       LYS  69 -14.880  -8.986 -10.815
  510   1HE   LYS  69          1HE       LYS  69 -14.379 -10.000  -8.019
  511   2HE   LYS  69          2HE       LYS  69 -15.923 -10.083  -8.862
  512   1HZ   LYS  69          1HZ       LYS  69 -14.929 -11.509 -10.521
  513   2HZ   LYS  69          2HZ       LYS  69 -14.683 -12.168  -8.977
  514   3HZ   LYS  69          3HZ       LYS  69 -13.413 -11.388  -9.774
  515    H    ARG  70           H        ARG  70 -11.564  -4.910 -10.706
  516    HA   ARG  70           HA       ARG  70 -11.486  -4.193 -13.446
  517   1HB   ARG  70          1HB       ARG  70 -12.550  -3.004 -11.352
  518   2HB   ARG  70          2HB       ARG  70 -11.004  -2.175 -11.281
  519   1HG   ARG  70          1HG       ARG  70 -12.829  -2.193 -13.680
  520   2HG   ARG  70          2HG       ARG  70 -12.760  -0.909 -12.474
  521   1HD   ARG  70          1HD       ARG  70 -10.456  -0.450 -13.052
  522   2HD   ARG  70          2HD       ARG  70 -10.441  -1.803 -14.181
  523    HE   ARG  70           HE       ARG  70 -12.166   0.569 -14.542
  524   1HH1  ARG  70          1HH1      ARG  70 -10.009  -1.892 -15.800
  525   2HH1  ARG  70          2HH1      ARG  70 -10.094  -1.321 -17.440
  526   1HH2  ARG  70          1HH2      ARG  70 -12.242   1.365 -16.687
  527   2HH2  ARG  70          2HH2      ARG  70 -11.334   0.557 -17.939
  528    H    ALA  71           H        ALA  71  -9.080  -3.974 -10.882
  529    HA   ALA  71           HA       ALA  71  -7.310  -2.367 -12.481
  530   1HB   ALA  71          1HB       ALA  71  -7.533  -1.994 -10.079
  531   2HB   ALA  71          2HB       ALA  71  -5.869  -2.344 -10.546
  532   3HB   ALA  71          3HB       ALA  71  -6.850  -3.590  -9.774
  533    H    ALA  72           H        ALA  72  -7.683  -5.799 -11.942
  534    HA   ALA  72           HA       ALA  72  -5.022  -6.414 -12.838
  535   1HB   ALA  72          1HB       ALA  72  -5.810  -8.693 -13.203
  536   2HB   ALA  72          2HB       ALA  72  -7.475  -8.174 -12.943
  537   3HB   ALA  72          3HB       ALA  72  -6.313  -8.107 -11.617
  538    H    ALA  73           H        ALA  73  -8.203  -6.049 -14.321
  539    HA   ALA  73           HA       ALA  73  -7.487  -6.612 -16.970
  540   1HB   ALA  73          1HB       ALA  73  -9.801  -6.293 -16.249
  541   2HB   ALA  73          2HB       ALA  73  -9.409  -5.253 -17.619
  542   3HB   ALA  73          3HB       ALA  73  -9.487  -4.576 -15.993
  543    H    ARG  74           H        ARG  74  -7.122  -3.633 -15.091
  544    HA   ARG  74           HA       ARG  74  -6.136  -2.165 -17.371
  545   1HB   ARG  74          1HB       ARG  74  -7.357  -1.433 -15.063
  546   2HB   ARG  74          2HB       ARG  74  -5.683  -1.061 -14.677
  547   1HG   ARG  74          1HG       ARG  74  -7.038  -0.076 -17.170
  548   2HG   ARG  74          2HG       ARG  74  -7.063   0.812 -15.648
  549   1HD   ARG  74          1HD       ARG  74  -4.543  -0.043 -17.061
  550   2HD   ARG  74          2HD       ARG  74  -5.294   1.538 -17.261
  551    HE   ARG  74           HE       ARG  74  -4.623   0.704 -14.547
  552   1HH1  ARG  74          1HH1      ARG  74  -3.789   2.633 -17.361
  553   2HH1  ARG  74          2HH1      ARG  74  -2.719   3.680 -16.480
  554   1HH2  ARG  74          1HH2      ARG  74  -3.242   2.085 -13.399
  555   2HH2  ARG  74          2HH2      ARG  74  -2.416   3.382 -14.220
  556    H    ALA  75           H        ALA  75  -4.679  -3.722 -14.530
  557    HA   ALA  75           HA       ALA  75  -2.087  -2.685 -14.672
  558   1HB   ALA  75          1HB       ALA  75  -2.937  -4.042 -12.809
  559   2HB   ALA  75          2HB       ALA  75  -1.385  -4.625 -13.412
  560   3HB   ALA  75          3HB       ALA  75  -2.872  -5.472 -13.837
  561    H    GLY  76           H        GLY  76  -3.303  -5.714 -16.129
  562   1HA   GLY  76          1HA       GLY  76  -0.806  -5.932 -17.641
  563   2HA   GLY  76          2HA       GLY  76  -2.044  -7.172 -17.501
  564    H    HIS  77           H        HIS  77  -2.811  -3.857 -18.267
  565    HA   HIS  77           HA       HIS  77  -4.156  -4.728 -20.659
  566   1HB   HIS  77          1HB       HIS  77  -5.064  -2.982 -19.103
  567   2HB   HIS  77          2HB       HIS  77  -3.777  -1.907 -19.635
  568    HD1  HIS  77           HD1      HIS  77  -4.479  -0.339 -21.403
  569    HD2  HIS  77           HD2      HIS  77  -6.666  -3.878 -21.505
  570    HE1  HIS  77           HE1      HIS  77  -6.178  -0.038 -23.235
  571    HE2  HIS  77           HE2      HIS  77  -7.410  -2.237 -23.359
  572    H    ALA  78           H        ALA  78  -2.572  -5.406 -22.069
  573    HA   ALA  78           HA       ALA  78  -1.155  -5.226 -23.834
  574   1HB   ALA  78          1HB       ALA  78  -1.626  -2.255 -23.602
  575   2HB   ALA  78          2HB       ALA  78  -2.622  -3.383 -24.523
  576   3HB   ALA  78          3HB       ALA  78  -0.945  -3.102 -24.992
  577    H    ALA  79           H        ALA  79  -0.263  -4.941 -20.973
  578    HA   ALA  79           HA       ALA  79   2.067  -3.264 -21.038
  579   1HB   ALA  79          1HB       ALA  79   1.251  -5.351 -19.020
  580   2HB   ALA  79          2HB       ALA  79   0.822  -3.640 -18.962
  581   3HB   ALA  79          3HB       ALA  79   2.509  -4.134 -18.807
  582    H    THR  80           H        THR  80   1.363  -6.505 -21.924
  583    HA   THR  80           HA       THR  80   4.185  -7.259 -21.855
  584    HB   THR  80           HB       THR  80   3.315  -9.530 -22.522
  585    HG1  THR  80           HG1      THR  80   1.273  -8.651 -23.342
  586   1HG2  THR  80          1HG2      THR  80   3.842  -8.987 -20.194
  587   2HG2  THR  80          2HG2      THR  80   2.457 -10.074 -20.294
  588   3HG2  THR  80          3HG2      THR  80   2.209  -8.358 -19.965
  Start of MODEL   14
    1    H    MET   1           H        MET   1   8.967   1.943  -0.407
    2    HA   MET   1           HA       MET   1   7.438   0.299   0.567
    3   1HB   MET   1          1HB       MET   1   7.384   0.920  -1.842
    4   2HB   MET   1          2HB       MET   1   8.475  -0.416  -2.185
    5   1HG   MET   1          1HG       MET   1   6.760  -1.962  -1.241
    6   2HG   MET   1          2HG       MET   1   5.667  -0.586  -1.121
    7   1HE   MET   1          1HE       MET   1   3.851  -1.844  -2.521
    8   2HE   MET   1          2HE       MET   1   4.905  -3.252  -2.660
    9   3HE   MET   1          3HE       MET   1   4.143  -2.574  -4.100
   10    H    HIS   2           H        HIS   2   6.961  -1.854   0.995
   11    HA   HIS   2           HA       HIS   2   9.019  -3.869   0.452
   12   1HB   HIS   2          1HB       HIS   2   7.722  -3.337   3.130
   13   2HB   HIS   2          2HB       HIS   2   8.349  -4.927   2.714
   14    HD1  HIS   2           HD1      HIS   2  10.838  -5.295   2.946
   15    HD2  HIS   2           HD2      HIS   2   9.728  -1.299   3.318
   16    HE1  HIS   2           HE1      HIS   2  12.906  -4.081   3.720
   17    HE2  HIS   2           HE2      HIS   2  12.181  -1.681   4.047
   18    H    ALA   3           H        ALA   3   8.017  -6.102   0.606
   19    HA   ALA   3           HA       ALA   3   5.136  -6.040   0.119
   20   1HB   ALA   3          1HB       ALA   3   6.191  -5.834  -2.080
   21   2HB   ALA   3          2HB       ALA   3   5.363  -7.381  -1.905
   22   3HB   ALA   3          3HB       ALA   3   7.119  -7.302  -1.770
   23    H    LYS   4           H        LYS   4   4.094  -8.006   0.448
   24    HA   LYS   4           HA       LYS   4   5.695 -10.198   1.536
   25   1HB   LYS   4          1HB       LYS   4   4.866  -8.679   3.387
   26   2HB   LYS   4          2HB       LYS   4   3.231  -9.121   2.920
   27   1HG   LYS   4          1HG       LYS   4   3.880 -10.437   4.805
   28   2HG   LYS   4          2HG       LYS   4   3.790 -11.492   3.391
   29   1HD   LYS   4          1HD       LYS   4   6.224 -11.356   3.141
   30   2HD   LYS   4          2HD       LYS   4   6.308 -10.304   4.555
   31   1HE   LYS   4          1HE       LYS   4   5.396 -12.089   5.948
   32   2HE   LYS   4          2HE       LYS   4   5.287 -13.142   4.536
   33   1HZ   LYS   4          1HZ       LYS   4   7.260 -13.685   5.727
   34   2HZ   LYS   4          2HZ       LYS   4   7.757 -12.066   5.785
   35   3HZ   LYS   4          3HZ       LYS   4   7.734 -12.893   4.304
   36    H    VAL   5           H        VAL   5   4.721 -12.216   1.304
   37    HA   VAL   5           HA       VAL   5   2.663 -12.397  -0.712
   38    HB   VAL   5           HB       VAL   5   4.477 -14.016  -0.769
   39   1HG1  VAL   5          1HG1      VAL   5   4.833 -15.658   1.012
   40   2HG1  VAL   5          2HG1      VAL   5   3.590 -14.867   1.982
   41   3HG1  VAL   5          3HG1      VAL   5   5.079 -14.009   1.588
   42   1HG2  VAL   5          1HG2      VAL   5   2.296 -14.817  -1.519
   43   2HG2  VAL   5          2HG2      VAL   5   1.935 -15.374   0.116
   44   3HG2  VAL   5          3HG2      VAL   5   3.243 -16.121  -0.803
   45    H    GLY   6           H        GLY   6   0.580 -13.360  -0.361
   46   1HA   GLY   6          1HA       GLY   6  -1.296 -13.900   0.967
   47   2HA   GLY   6          2HA       GLY   6  -0.335 -13.578   2.410
   48    H    ASP   7           H        ASP   7  -0.153 -11.412  -0.157
   49    HA   ASP   7           HA       ASP   7  -2.045  -9.432   1.032
   50   1HB   ASP   7          1HB       ASP   7   0.941  -9.167   0.646
   51   2HB   ASP   7          2HB       ASP   7  -0.087  -7.762   0.413
   52    H    TYR   8           H        TYR   8  -1.745  -7.447  -0.504
   53    HA   TYR   8           HA       TYR   8  -2.017  -8.379  -3.287
   54   1HB   TYR   8          1HB       TYR   8  -4.052  -6.807  -1.681
   55   2HB   TYR   8          2HB       TYR   8  -4.110  -6.988  -3.425
   56    HD1  TYR   8           HD1      TYR   8  -4.455  -8.813  -0.208
   57    HD2  TYR   8           HD2      TYR   8  -4.997  -8.931  -4.426
   58    HE1  TYR   8           HE1      TYR   8  -5.841 -10.844   0.018
   59    HE2  TYR   8           HE2      TYR   8  -6.370 -10.957  -4.202
   60    HH   TYR   8           HH       TYR   8  -6.578 -12.831  -2.564
   61    H    LEU   9           H        LEU   9  -2.467  -6.320  -4.661
   62    HA   LEU   9           HA       LEU   9  -0.665  -4.193  -3.728
   63   1HB   LEU   9          1HB       LEU   9   0.629  -5.964  -4.887
   64   2HB   LEU   9          2HB       LEU   9  -0.354  -5.724  -6.315
   65    HG   LEU   9           HG       LEU   9   1.272  -3.459  -5.193
   66   1HD1  LEU   9          1HD1      LEU   9   3.097  -4.112  -6.662
   67   2HD1  LEU   9          2HD1      LEU   9   2.230  -5.582  -7.102
   68   3HD1  LEU   9          3HD1      LEU   9   2.789  -5.351  -5.446
   69   1HD2  LEU   9          1HD2      LEU   9  -0.381  -2.955  -6.931
   70   2HD2  LEU   9          2HD2      LEU   9   0.350  -4.173  -7.978
   71   3HD2  LEU   9          3HD2      LEU   9   1.265  -2.735  -7.526
   72    H    VAL  10           H        VAL  10  -1.129  -2.225  -4.429
   73    HA   VAL  10           HA       VAL  10  -2.858  -1.813  -6.765
   74    HB   VAL  10           HB       VAL  10  -3.307  -0.543  -4.043
   75   1HG1  VAL  10          1HG1      VAL  10  -3.643   1.111  -5.795
   76   2HG1  VAL  10          2HG1      VAL  10  -5.183   0.648  -5.071
   77   3HG1  VAL  10          3HG1      VAL  10  -4.721   0.005  -6.648
   78   1HG2  VAL  10          1HG2      VAL  10  -5.517  -1.572  -4.171
   79   2HG2  VAL  10          2HG2      VAL  10  -4.232  -2.779  -4.216
   80   3HG2  VAL  10          3HG2      VAL  10  -5.073  -2.329  -5.699
   81    H    VAL  11           H        VAL  11  -2.577   0.387  -7.661
   82    HA   VAL  11           HA       VAL  11  -0.555   2.057  -6.337
   83    HB   VAL  11           HB       VAL  11   0.473   2.709  -8.433
   84   1HG1  VAL  11          1HG1      VAL  11   1.659   0.653  -9.012
   85   2HG1  VAL  11          2HG1      VAL  11   0.442  -0.289  -8.150
   86   3HG1  VAL  11          3HG1      VAL  11   1.475   0.833  -7.266
   87   1HG2  VAL  11          1HG2      VAL  11  -0.030   1.596 -10.546
   88   2HG2  VAL  11          2HG2      VAL  11  -1.443   2.434  -9.904
   89   3HG2  VAL  11          3HG2      VAL  11  -1.317   0.681  -9.761
   90    H    LYS  12           H        LYS  12  -0.718   4.356  -7.172
   91    HA   LYS  12           HA       LYS  12  -3.420   4.945  -8.164
   92   1HB   LYS  12          1HB       LYS  12  -2.135   6.431  -5.868
   93   2HB   LYS  12          2HB       LYS  12  -3.729   6.717  -6.544
   94   1HG   LYS  12          1HG       LYS  12  -4.471   5.444  -4.878
   95   2HG   LYS  12          2HG       LYS  12  -3.867   4.079  -5.821
   96   1HD   LYS  12          1HD       LYS  12  -3.041   3.941  -3.545
   97   2HD   LYS  12          2HD       LYS  12  -1.700   4.266  -4.649
   98   1HE   LYS  12          1HE       LYS  12  -1.875   6.670  -4.088
   99   2HE   LYS  12          2HE       LYS  12  -3.142   6.282  -2.924
  100   1HZ   LYS  12          1HZ       LYS  12  -1.037   6.500  -1.815
  101   2HZ   LYS  12          2HZ       LYS  12  -0.320   5.355  -2.840
  102   3HZ   LYS  12          3HZ       LYS  12  -1.531   4.880  -1.746
  103    H    GLY  13           H        GLY  13  -3.650   7.046  -9.105
  104   1HA   GLY  13          1HA       GLY  13  -1.176   8.108 -10.216
  105   2HA   GLY  13          2HA       GLY  13  -2.811   8.561 -10.691
  106    H    THR  14           H        THR  14  -0.848  10.490 -10.217
  107    HA   THR  14           HA       THR  14  -0.959  11.411  -7.506
  108    HB   THR  14           HB       THR  14  -0.050  12.974  -9.927
  109    HG1  THR  14           HG1      THR  14   0.986  10.713  -8.792
  110   1HG2  THR  14          1HG2      THR  14   0.741  13.104  -7.011
  111   2HG2  THR  14          2HG2      THR  14  -0.259  14.279  -7.865
  112   3HG2  THR  14          3HG2      THR  14   1.436  14.075  -8.307
  113    H    THR  15           H        THR  15  -3.013  11.673 -10.201
  114    HA   THR  15           HA       THR  15  -4.321  14.116  -9.422
  115    HB   THR  15           HB       THR  15  -6.074  13.342 -11.073
  116    HG1  THR  15           HG1      THR  15  -5.838  11.440 -12.056
  117   1HG2  THR  15          1HG2      THR  15  -4.669  13.723 -13.038
  118   2HG2  THR  15          2HG2      THR  15  -3.223  13.435 -12.070
  119   3HG2  THR  15          3HG2      THR  15  -4.245  14.834 -11.735
  120    H    THR  16           H        THR  16  -4.081  11.434  -7.791
  121    HA   THR  16           HA       THR  16  -5.197  10.503  -6.074
  122    HB   THR  16           HB       THR  16  -7.458  12.425  -6.655
  123    HG1  THR  16           HG1      THR  16  -4.987  12.800  -5.639
  124   1HG2  THR  16          1HG2      THR  16  -8.113  11.977  -4.334
  125   2HG2  THR  16          2HG2      THR  16  -6.799  10.812  -4.183
  126   3HG2  THR  16          3HG2      THR  16  -8.134  10.496  -5.291
  127    H    GLU  17           H        GLU  17  -5.168   8.653  -7.321
  128    HA   GLU  17           HA       GLU  17  -7.746   7.822  -8.455
  129   1HB   GLU  17          1HB       GLU  17  -5.501   7.496  -9.692
  130   2HB   GLU  17          2HB       GLU  17  -5.157   6.263  -8.489
  131   1HG   GLU  17          1HG       GLU  17  -5.987   5.073 -10.289
  132   2HG   GLU  17          2HG       GLU  17  -7.373   5.212  -9.209
  133    H    ARG  18           H        ARG  18  -8.585   5.687  -7.682
  134    HA   ARG  18           HA       ARG  18  -8.109   5.509  -4.815
  135   1HB   ARG  18          1HB       ARG  18 -10.300   4.510  -6.594
  136   2HB   ARG  18          2HB       ARG  18 -10.109   3.878  -4.962
  137   1HG   ARG  18          1HG       ARG  18 -10.304   6.146  -4.066
  138   2HG   ARG  18          2HG       ARG  18 -10.517   6.771  -5.703
  139   1HD   ARG  18          1HD       ARG  18 -12.322   4.702  -4.469
  140   2HD   ARG  18          2HD       ARG  18 -12.627   6.435  -4.372
  141    HE   ARG  18           HE       ARG  18 -12.512   6.286  -6.938
  142   1HH1  ARG  18          1HH1      ARG  18 -13.740   3.750  -4.851
  143   2HH1  ARG  18          2HH1      ARG  18 -14.929   3.206  -5.998
  144   1HH2  ARG  18          1HH2      ARG  18 -14.037   5.547  -8.458
  145   2HH2  ARG  18          2HH2      ARG  18 -15.098   4.232  -8.052
  146    H    HIS  19           H        HIS  19  -8.712   2.981  -7.286
  147    HA   HIS  19           HA       HIS  19  -6.394   1.538  -6.250
  148   1HB   HIS  19          1HB       HIS  19  -9.188   0.394  -6.251
  149   2HB   HIS  19          2HB       HIS  19  -7.743  -0.603  -6.164
  150    HD1  HIS  19           HD1      HIS  19  -6.107   0.902  -4.067
  151    HD2  HIS  19           HD2      HIS  19 -10.202   0.269  -3.771
  152    HE1  HIS  19           HE1      HIS  19  -6.631   1.016  -1.616
  153    HE2  HIS  19           HE2      HIS  19  -9.070   0.395  -1.449
  154    H    ASP  20           H        ASP  20  -5.386   1.843  -8.215
  155    HA   ASP  20           HA       ASP  20  -6.552   0.267 -10.417
  156   1HB   ASP  20          1HB       ASP  20  -4.988   2.832 -10.482
  157   2HB   ASP  20          2HB       ASP  20  -4.963   1.740 -11.864
  158    H    GLN  21           H        GLN  21  -4.966  -0.894 -11.744
  159    HA   GLN  21           HA       GLN  21  -3.460  -2.599 -11.800
  160   1HB   GLN  21          1HB       GLN  21  -1.850  -0.488 -10.381
  161   2HB   GLN  21          2HB       GLN  21  -1.177  -2.071 -10.727
  162   1HG   GLN  21          1HG       GLN  21  -0.491  -0.477 -12.403
  163   2HG   GLN  21          2HG       GLN  21  -1.543  -1.694 -13.120
  164   1HE2  GLN  21          1HE2      GLN  21  -1.218   1.643 -12.218
  165   2HE2  GLN  21          2HE2      GLN  21  -2.613   2.213 -13.065
  166    H    HIS  22           H        HIS  22  -4.360  -4.268 -10.631
  167    HA   HIS  22           HA       HIS  22  -3.591  -4.409  -7.815
  168   1HB   HIS  22          1HB       HIS  22  -5.804  -3.499  -7.692
  169   2HB   HIS  22          2HB       HIS  22  -6.422  -4.726  -8.792
  170    HD1  HIS  22           HD1      HIS  22  -5.002  -4.406  -5.303
  171    HD2  HIS  22           HD2      HIS  22  -7.249  -7.034  -7.601
  172    HE1  HIS  22           HE1      HIS  22  -5.800  -6.181  -3.710
  173    HE2  HIS  22           HE2      HIS  22  -6.981  -7.853  -5.173
  174    H    ALA  23           H        ALA  23  -2.913  -6.203  -7.201
  175    HA   ALA  23           HA       ALA  23  -3.514  -8.710  -8.570
  176   1HB   ALA  23          1HB       ALA  23  -1.182  -9.262  -8.731
  177   2HB   ALA  23          2HB       ALA  23  -0.743  -7.691  -8.062
  178   3HB   ALA  23          3HB       ALA  23  -1.538  -7.790  -9.634
  179    H    GLU  24           H        GLU  24  -2.132 -10.441  -7.357
  180    HA   GLU  24           HA       GLU  24  -2.380 -10.051  -4.435
  181   1HB   GLU  24          1HB       GLU  24  -4.406 -11.205  -5.126
  182   2HB   GLU  24          2HB       GLU  24  -3.482 -12.326  -6.111
  183   1HG   GLU  24          1HG       GLU  24  -2.421 -13.174  -4.013
  184   2HG   GLU  24          2HG       GLU  24  -3.537 -12.158  -3.103
  185    H    ILE  25           H        ILE  25  -0.529 -10.458  -3.598
  186    HA   ILE  25           HA       ILE  25   1.547 -11.547  -5.267
  187    HB   ILE  25           HB       ILE  25   1.894 -10.574  -2.440
  188   1HG1  ILE  25          1HG1      ILE  25   1.856  -8.866  -4.943
  189   2HG1  ILE  25          2HG1      ILE  25   0.582  -8.894  -3.725
  190   1HG2  ILE  25          1HG2      ILE  25   3.680 -10.602  -4.868
  191   2HG2  ILE  25          2HG2      ILE  25   3.807 -11.650  -3.454
  192   3HG2  ILE  25          3HG2      ILE  25   4.107  -9.917  -3.300
  193   1HD1  ILE  25          1HD1      ILE  25   3.431  -8.031  -3.276
  194   2HD1  ILE  25          2HD1      ILE  25   2.146  -8.045  -2.067
  195   3HD1  ILE  25          3HD1      ILE  25   2.035  -6.968  -3.459
  196    H    ILE  26           H        ILE  26   1.496 -13.682  -5.375
  197    HA   ILE  26           HA       ILE  26   1.516 -15.179  -2.853
  198    HB   ILE  26           HB       ILE  26   1.188 -17.195  -4.454
  199   1HG1  ILE  26          1HG1      ILE  26  -0.378 -16.357  -6.382
  200   2HG1  ILE  26          2HG1      ILE  26   0.535 -14.862  -6.223
  201   1HG2  ILE  26          1HG2      ILE  26  -0.440 -16.457  -2.819
  202   2HG2  ILE  26          2HG2      ILE  26  -1.242 -16.923  -4.319
  203   3HG2  ILE  26          3HG2      ILE  26  -1.023 -15.217  -3.928
  204   1HD1  ILE  26          1HD1      ILE  26   1.422 -16.261  -7.993
  205   2HD1  ILE  26          2HD1      ILE  26   1.675 -17.577  -6.845
  206   3HD1  ILE  26          3HD1      ILE  26   2.597 -16.082  -6.691
  207    H    GLU  27           H        GLU  27   3.475 -13.968  -5.245
  208    HA   GLU  27           HA       GLU  27   5.688 -15.571  -4.210
  209   1HB   GLU  27          1HB       GLU  27   4.748 -16.099  -6.684
  210   2HB   GLU  27          2HB       GLU  27   5.863 -14.795  -7.067
  211   1HG   GLU  27          1HG       GLU  27   6.979 -16.905  -7.317
  212   2HG   GLU  27          2HG       GLU  27   7.664 -16.043  -5.939
  213    H    VAL  28           H        VAL  28   7.566 -14.384  -3.889
  214    HA   VAL  28           HA       VAL  28   7.346 -11.508  -4.417
  215    HB   VAL  28           HB       VAL  28   7.959 -12.628  -1.683
  216   1HG1  VAL  28          1HG1      VAL  28   7.612  -9.777  -2.622
  217   2HG1  VAL  28          2HG1      VAL  28   9.139 -10.543  -2.186
  218   3HG1  VAL  28          3HG1      VAL  28   7.898 -10.289  -0.959
  219   1HG2  VAL  28          1HG2      VAL  28   5.596 -12.899  -2.207
  220   2HG2  VAL  28          2HG2      VAL  28   5.491 -11.195  -2.646
  221   3HG2  VAL  28          3HG2      VAL  28   5.830 -11.656  -0.977
  222    H    ARG  29           H        ARG  29   9.148 -11.449  -5.709
  223    HA   ARG  29           HA       ARG  29  11.663 -12.464  -4.580
  224   1HB   ARG  29          1HB       ARG  29  10.947 -13.160  -6.932
  225   2HB   ARG  29          2HB       ARG  29  11.229 -11.489  -7.406
  226   1HG   ARG  29          1HG       ARG  29  13.537 -12.267  -6.047
  227   2HG   ARG  29          2HG       ARG  29  13.104 -13.641  -7.065
  228   1HD   ARG  29          1HD       ARG  29  14.546 -12.225  -8.332
  229   2HD   ARG  29          2HD       ARG  29  12.919 -12.060  -8.988
  230    HE   ARG  29           HE       ARG  29  12.767  -9.927  -7.807
  231   1HH1  ARG  29          1HH1      ARG  29  15.960 -11.330  -8.127
  232   2HH1  ARG  29          2HH1      ARG  29  16.773  -9.793  -8.059
  233   1HH2  ARG  29          1HH2      ARG  29  13.837  -7.912  -7.702
  234   2HH2  ARG  29          2HH2      ARG  29  15.570  -7.860  -7.844
  235    H    SER  30           H        SER  30  11.889 -10.729  -3.118
  236    HA   SER  30           HA       SER  30  12.910  -8.305  -4.332
  237   1HB   SER  30          1HB       SER  30  10.568  -8.231  -2.417
  238   2HB   SER  30          2HB       SER  30  11.432  -6.826  -3.040
  239    HG   SER  30           HG       SER  30  10.706  -8.296  -5.118
  240    H    ALA  31           H        ALA  31  14.863  -8.351  -3.412
  241    HA   ALA  31           HA       ALA  31  15.083  -8.570  -0.506
  242   1HB   ALA  31          1HB       ALA  31  16.811  -9.640  -1.884
  243   2HB   ALA  31          2HB       ALA  31  17.498  -8.354  -0.889
  244   3HB   ALA  31          3HB       ALA  31  17.203  -8.078  -2.604
  245    H    ASP  32           H        ASP  32  14.626  -6.329  -2.969
  246    HA   ASP  32           HA       ASP  32  15.669  -4.034  -1.525
  247   1HB   ASP  32          1HB       ASP  32  14.150  -4.152  -4.147
  248   2HB   ASP  32          2HB       ASP  32  14.997  -2.752  -3.502
  249    H    GLY  33           H        GLY  33  12.566  -5.398  -2.533
  250   1HA   GLY  33          1HA       GLY  33  10.485  -4.944  -1.481
  251   2HA   GLY  33          2HA       GLY  33  11.187  -3.479  -0.800
  252    H    SER  34           H        SER  34  11.288  -4.625  -4.122
  253    HA   SER  34           HA       SER  34   9.456  -2.594  -5.042
  254   1HB   SER  34          1HB       SER  34  12.389  -2.542  -5.818
  255   2HB   SER  34          2HB       SER  34  11.126  -1.565  -6.567
  256    HG   SER  34           HG       SER  34  11.054  -1.307  -3.882
  257    HA   PRO  35           HA       PRO  35   8.607  -5.389  -8.376
  258   1HB   PRO  35          1HB       PRO  35   9.117  -3.861 -10.647
  259   2HB   PRO  35          2HB       PRO  35   7.603  -3.864  -9.735
  260   1HG   PRO  35          1HG       PRO  35   9.894  -1.948  -9.602
  261   2HG   PRO  35          2HG       PRO  35   8.151  -1.626  -9.530
  262   1HD   PRO  35          1HD       PRO  35   9.636  -1.604  -7.317
  263   2HD   PRO  35          2HD       PRO  35   7.995  -2.285  -7.308
  264    HA   PRO  36           HA       PRO  36   8.454  -6.210 -10.508
  265   1HB   PRO  36          1HB       PRO  36   8.872  -8.646 -11.533
  266   2HB   PRO  36          2HB       PRO  36   9.414  -7.187 -12.374
  267   1HG   PRO  36          1HG       PRO  36  10.981  -9.126 -10.725
  268   2HG   PRO  36          2HG       PRO  36  11.426  -8.323 -12.244
  269   1HD   PRO  36          1HD       PRO  36  12.236  -7.505  -9.727
  270   2HD   PRO  36          2HD       PRO  36  12.187  -6.463 -11.162
  271    H    TYR  37           H        TYR  37   7.034  -8.215 -10.253
  272    HA   TYR  37           HA       TYR  37   7.545  -9.713  -7.764
  273   1HB   TYR  37          1HB       TYR  37   4.972  -8.245  -8.392
  274   2HB   TYR  37          2HB       TYR  37   5.231  -9.319  -7.024
  275    HD1  TYR  37           HD1      TYR  37   7.030  -8.636  -5.318
  276    HD2  TYR  37           HD2      TYR  37   5.410  -5.963  -8.204
  277    HE1  TYR  37           HE1      TYR  37   7.768  -6.725  -3.960
  278    HE2  TYR  37           HE2      TYR  37   6.146  -4.045  -6.857
  279    HH   TYR  37           HH       TYR  37   6.717  -3.550  -4.508
  280    H    VAL  38           H        VAL  38   5.726 -11.431  -7.549
  281    HA   VAL  38           HA       VAL  38   4.819 -12.274 -10.221
  282    HB   VAL  38           HB       VAL  38   6.197 -14.140  -8.260
  283   1HG1  VAL  38          1HG1      VAL  38   4.904 -14.703 -10.934
  284   2HG1  VAL  38          2HG1      VAL  38   4.279 -15.194  -9.359
  285   3HG1  VAL  38          3HG1      VAL  38   5.794 -15.869  -9.957
  286   1HG2  VAL  38          1HG2      VAL  38   7.770 -12.775  -9.555
  287   2HG2  VAL  38          2HG2      VAL  38   6.990 -13.298 -11.048
  288   3HG2  VAL  38          3HG2      VAL  38   7.836 -14.470 -10.037
  289    H    VAL  39           H        VAL  39   2.811 -13.062 -10.161
  290    HA   VAL  39           HA       VAL  39   1.545 -12.508  -7.602
  291    HB   VAL  39           HB       VAL  39   2.223 -10.569  -9.475
  292   1HG1  VAL  39          1HG1      VAL  39   0.449 -11.209 -10.982
  293   2HG1  VAL  39          2HG1      VAL  39   0.095  -9.634 -10.274
  294   3HG1  VAL  39          3HG1      VAL  39  -0.742 -11.072  -9.689
  295   1HG2  VAL  39          1HG2      VAL  39   1.951 -10.215  -7.122
  296   2HG2  VAL  39          2HG2      VAL  39   0.208 -10.456  -7.252
  297   3HG2  VAL  39          3HG2      VAL  39   0.966  -9.062  -8.022
  298    H    ARG  40           H        ARG  40  -0.897 -12.296  -8.096
  299    HA   ARG  40           HA       ARG  40  -1.703 -14.398  -9.950
  300   1HB   ARG  40          1HB       ARG  40  -1.253 -15.367  -7.705
  301   2HB   ARG  40          2HB       ARG  40  -2.384 -14.226  -7.002
  302   1HG   ARG  40          1HG       ARG  40  -4.210 -15.263  -8.224
  303   2HG   ARG  40          2HG       ARG  40  -3.075 -16.387  -8.979
  304   1HD   ARG  40          1HD       ARG  40  -2.451 -17.218  -6.755
  305   2HD   ARG  40          2HD       ARG  40  -3.631 -16.132  -6.027
  306    HE   ARG  40           HE       ARG  40  -4.354 -18.317  -7.871
  307   1HH1  ARG  40          1HH1      ARG  40  -4.922 -16.358  -5.014
  308   2HH1  ARG  40          2HH1      ARG  40  -6.334 -17.260  -4.531
  309   1HH2  ARG  40          1HH2      ARG  40  -6.200 -19.496  -7.238
  310   2HH2  ARG  40          2HH2      ARG  40  -7.068 -19.050  -5.795
  311    H    TRP  41           H        TRP  41  -3.293 -13.546 -11.143
  312    HA   TRP  41           HA       TRP  41  -4.942 -11.402 -10.310
  313   1HB   TRP  41          1HB       TRP  41  -5.432 -13.556 -12.393
  314   2HB   TRP  41          2HB       TRP  41  -6.430 -12.121 -12.178
  315    HD1  TRP  41           HD1      TRP  41  -4.252 -13.126 -14.643
  316    HE1  TRP  41           HE1      TRP  41  -2.804 -11.243 -15.625
  317    HE3  TRP  41           HE3      TRP  41  -4.672  -9.699 -10.868
  318    HZ2  TRP  41           HZ2      TRP  41  -1.914  -8.678 -14.892
  319    HZ3  TRP  41           HZ3      TRP  41  -3.477  -7.564 -11.086
  320    HH2  TRP  41           HH2      TRP  41  -2.129  -7.063 -13.051
  321    H    LEU  42           H        LEU  42  -6.222 -11.532  -8.641
  322    HA   LEU  42           HA       LEU  42  -5.836 -13.779  -7.046
  323   1HB   LEU  42          1HB       LEU  42  -7.755 -12.281  -5.762
  324   2HB   LEU  42          2HB       LEU  42  -6.016 -12.099  -5.619
  325    HG   LEU  42           HG       LEU  42  -7.154 -10.679  -7.928
  326   1HD1  LEU  42          1HD1      LEU  42  -8.099  -8.873  -6.575
  327   2HD1  LEU  42          2HD1      LEU  42  -7.876  -9.852  -5.125
  328   3HD1  LEU  42          3HD1      LEU  42  -9.002 -10.376  -6.379
  329   1HD2  LEU  42          1HD2      LEU  42  -4.869 -10.415  -7.243
  330   2HD2  LEU  42          2HD2      LEU  42  -5.391  -9.856  -5.655
  331   3HD2  LEU  42          3HD2      LEU  42  -5.752  -8.897  -7.091
  332    H    VAL  43           H        VAL  43  -9.052 -12.419  -7.147
  333    HA   VAL  43           HA       VAL  43 -10.214 -14.890  -6.552
  334    HB   VAL  43           HB       VAL  43 -12.359 -13.437  -7.434
  335   1HG1  VAL  43          1HG1      VAL  43 -12.662 -12.906  -5.076
  336   2HG1  VAL  43          2HG1      VAL  43 -10.959 -13.248  -4.770
  337   3HG1  VAL  43          3HG1      VAL  43 -12.044 -14.547  -5.261
  338   1HG2  VAL  43          1HG2      VAL  43 -11.995 -11.143  -6.685
  339   2HG2  VAL  43          2HG2      VAL  43 -10.909 -11.533  -8.019
  340   3HG2  VAL  43          3HG2      VAL  43 -10.300 -11.504  -6.365
  341    H    ASN  44           H        ASN  44  -9.541 -13.386  -9.591
  342    HA   ASN  44           HA       ASN  44 -11.110 -15.021 -11.250
  343   1HB   ASN  44          1HB       ASN  44  -8.519 -13.571 -11.695
  344   2HB   ASN  44          2HB       ASN  44  -9.264 -14.543 -12.965
  345   1HD2  ASN  44          1HD2      ASN  44  -9.688 -11.797 -10.849
  346   2HD2  ASN  44          2HD2      ASN  44 -10.957 -11.042 -11.762
  347    H    GLY  45           H        GLY  45  -7.664 -15.482 -10.362
  348   1HA   GLY  45          1HA       GLY  45  -6.948 -17.642  -9.563
  349   2HA   GLY  45          2HA       GLY  45  -8.164 -18.381 -10.588
  350    H    HIS  46           H        HIS  46  -5.572 -16.008 -11.262
  351    HA   HIS  46           HA       HIS  46  -4.179 -18.044 -12.854
  352   1HB   HIS  46          1HB       HIS  46  -5.402 -15.579 -13.920
  353   2HB   HIS  46          2HB       HIS  46  -3.732 -15.857 -14.407
  354    HD1  HIS  46           HD1      HIS  46  -7.176 -17.379 -14.692
  355    HD2  HIS  46           HD2      HIS  46  -3.343 -17.922 -16.217
  356    HE1  HIS  46           HE1      HIS  46  -7.420 -19.025 -16.577
  357    HE2  HIS  46           HE2      HIS  46  -5.066 -19.482 -17.348
  358    H    GLU  47           H        GLU  47  -1.935 -17.126 -13.522
  359    HA   GLU  47           HA       GLU  47  -0.909 -15.398 -11.379
  360   1HB   GLU  47          1HB       GLU  47   0.235 -18.108 -12.082
  361   2HB   GLU  47          2HB       GLU  47   1.008 -16.942 -11.023
  362   1HG   GLU  47          1HG       GLU  47   0.036 -18.356  -9.510
  363   2HG   GLU  47          2HG       GLU  47  -1.212 -17.124  -9.665
  364    H    THR  48           H        THR  48   0.733 -14.129 -11.909
  365    HA   THR  48           HA       THR  48   1.941 -14.296 -14.566
  366    HB   THR  48           HB       THR  48  -0.069 -12.983 -14.874
  367    HG1  THR  48           HG1      THR  48   0.942 -11.581 -16.119
  368   1HG2  THR  48          1HG2      THR  48  -0.383 -12.116 -12.629
  369   2HG2  THR  48          2HG2      THR  48  -0.356 -10.798 -13.800
  370   3HG2  THR  48          3HG2      THR  48   1.063 -11.120 -12.802
  371    H    THR  49           H        THR  49   3.355 -12.222 -14.783
  372    HA   THR  49           HA       THR  49   4.752 -11.613 -12.267
  373    HB   THR  49           HB       THR  49   6.173 -12.399 -14.829
  374    HG1  THR  49           HG1      THR  49   5.211 -13.895 -12.774
  375   1HG2  THR  49          1HG2      THR  49   7.256 -11.772 -12.075
  376   2HG2  THR  49          2HG2      THR  49   7.393 -10.743 -13.500
  377   3HG2  THR  49          3HG2      THR  49   8.210 -12.306 -13.460
  378    H    VAL  50           H        VAL  50   4.876  -9.436 -12.109
  379    HA   VAL  50           HA       VAL  50   4.494  -7.871 -14.571
  380    HB   VAL  50           HB       VAL  50   2.590  -6.643 -13.504
  381   1HG1  VAL  50          1HG1      VAL  50   2.137  -9.569 -14.088
  382   2HG1  VAL  50          2HG1      VAL  50   2.228  -8.274 -15.281
  383   3HG1  VAL  50          3HG1      VAL  50   0.908  -8.306 -14.112
  384   1HG2  VAL  50          1HG2      VAL  50   2.605  -8.999 -11.616
  385   2HG2  VAL  50          2HG2      VAL  50   1.328  -7.789 -11.735
  386   3HG2  VAL  50          3HG2      VAL  50   2.940  -7.319 -11.196
  387    H    TYR  51           H        TYR  51   4.043  -5.504 -13.886
  388    HA   TYR  51           HA       TYR  51   5.733  -4.614 -11.664
  389   1HB   TYR  51          1HB       TYR  51   5.851  -3.174 -14.301
  390   2HB   TYR  51          2HB       TYR  51   7.004  -3.138 -12.977
  391    HD1  TYR  51           HD1      TYR  51   5.885  -4.957 -15.952
  392    HD2  TYR  51           HD2      TYR  51   8.761  -4.814 -12.821
  393    HE1  TYR  51           HE1      TYR  51   7.299  -6.542 -17.189
  394    HE2  TYR  51           HE2      TYR  51  10.182  -6.403 -14.049
  395    HH   TYR  51           HH       TYR  51   9.672  -7.165 -17.323
  396    HA   PRO  52           HA       PRO  52   1.793  -2.486 -11.264
  397   1HB   PRO  52          1HB       PRO  52   2.507  -0.977  -9.085
  398   2HB   PRO  52          2HB       PRO  52   1.975  -2.659  -9.000
  399   1HG   PRO  52          1HG       PRO  52   4.749  -1.540  -8.933
  400   2HG   PRO  52          2HG       PRO  52   4.054  -2.872  -7.993
  401   1HD   PRO  52          1HD       PRO  52   5.649  -3.287 -10.126
  402   2HD   PRO  52          2HD       PRO  52   4.320  -4.387  -9.708
  403    H    GLY  53           H        GLY  53   4.478  -0.294 -10.370
  404   1HA   GLY  53          1HA       GLY  53   4.925   1.383 -12.273
  405   2HA   GLY  53          2HA       GLY  53   3.216   1.740 -12.072
  406    H    SER  54           H        SER  54   3.489   3.845 -11.432
  407    HA   SER  54           HA       SER  54   5.289   4.533  -9.287
  408   1HB   SER  54          1HB       SER  54   3.197   6.224 -10.679
  409   2HB   SER  54          2HB       SER  54   4.503   6.818  -9.653
  410    HG   SER  54           HG       SER  54   5.949   5.762 -11.215
  411    H    ASP  55           H        ASP  55   4.682   5.514  -7.329
  412    HA   ASP  55           HA       ASP  55   3.784   5.220  -5.272
  413   1HB   ASP  55          1HB       ASP  55   2.237   6.929  -6.493
  414   2HB   ASP  55          2HB       ASP  55   1.057   5.619  -6.448
  415    H    ALA  56           H        ALA  56   4.409   2.939  -5.717
  416    HA   ALA  56           HA       ALA  56   2.272   1.053  -6.076
  417   1HB   ALA  56          1HB       ALA  56   5.150   0.570  -5.282
  418   2HB   ALA  56          2HB       ALA  56   4.519   0.557  -6.928
  419   3HB   ALA  56          3HB       ALA  56   3.985  -0.662  -5.769
  420    H    VAL  57           H        VAL  57   1.189  -0.043  -4.552
  421    HA   VAL  57           HA       VAL  57   1.883   0.300  -1.710
  422    HB   VAL  57           HB       VAL  57  -0.971   0.597  -2.580
  423   1HG1  VAL  57          1HG1      VAL  57  -0.558   0.264  -0.230
  424   2HG1  VAL  57          2HG1      VAL  57  -1.135   1.910  -0.499
  425   3HG1  VAL  57          3HG1      VAL  57   0.579   1.613  -0.204
  426   1HG2  VAL  57          1HG2      VAL  57  -0.778   3.031  -2.620
  427   2HG2  VAL  57          2HG2      VAL  57   0.196   2.288  -3.890
  428   3HG2  VAL  57          3HG2      VAL  57   0.971   2.898  -2.428
  429    H    VAL  58           H        VAL  58   0.107  -1.017  -0.483
  430    HA   VAL  58           HA       VAL  58  -0.400  -3.536  -1.855
  431    HB   VAL  58           HB       VAL  58   0.239  -4.402   0.566
  432   1HG1  VAL  58          1HG1      VAL  58   1.206  -5.229  -1.515
  433   2HG1  VAL  58          2HG1      VAL  58   2.460  -5.003  -0.296
  434   3HG1  VAL  58          3HG1      VAL  58   2.259  -3.817  -1.587
  435   1HG2  VAL  58          1HG2      VAL  58   2.234  -3.272   1.426
  436   2HG2  VAL  58          2HG2      VAL  58   0.803  -2.244   1.486
  437   3HG2  VAL  58          3HG2      VAL  58   2.008  -2.005   0.221
  438    H    VAL  59           H        VAL  59  -2.055  -4.804  -0.835
  439    HA   VAL  59           HA       VAL  59  -3.864  -3.329   0.924
  440    HB   VAL  59           HB       VAL  59  -5.574  -4.503  -0.801
  441   1HG1  VAL  59          1HG1      VAL  59  -5.992  -2.269  -1.707
  442   2HG1  VAL  59          2HG1      VAL  59  -4.458  -1.724  -1.025
  443   3HG1  VAL  59          3HG1      VAL  59  -5.767  -2.240   0.042
  444   1HG2  VAL  59          1HG2      VAL  59  -4.898  -3.945  -3.077
  445   2HG2  VAL  59          2HG2      VAL  59  -3.848  -5.161  -2.350
  446   3HG2  VAL  59          3HG2      VAL  59  -3.305  -3.488  -2.477
  447    H    THR  60           H        THR  60  -5.870  -4.815   1.186
  448    HA   THR  60           HA       THR  60  -4.884  -7.504   1.930
  449    HB   THR  60           HB       THR  60  -6.637  -7.244   3.798
  450    HG1  THR  60           HG1      THR  60  -7.744  -5.463   3.862
  451   1HG2  THR  60          1HG2      THR  60  -4.305  -5.327   3.808
  452   2HG2  THR  60          2HG2      THR  60  -4.214  -7.047   4.191
  453   3HG2  THR  60          3HG2      THR  60  -5.139  -5.962   5.228
  454    H    ALA  61           H        ALA  61  -7.305  -8.548   2.785
  455    HA   ALA  61           HA       ALA  61  -8.345  -9.637   0.487
  456   1HB   ALA  61          1HB       ALA  61 -10.011 -10.651   1.898
  457   2HB   ALA  61          2HB       ALA  61  -9.684  -9.476   3.172
  458   3HB   ALA  61          3HB       ALA  61  -8.445 -10.645   2.712
  459    H    THR  62           H        THR  62  -9.848  -6.969   2.425
  460    HA   THR  62           HA       THR  62 -12.296  -7.060   1.077
  461    HB   THR  62           HB       THR  62 -12.250  -4.510   1.623
  462    HG1  THR  62           HG1      THR  62 -10.567  -3.861   2.698
  463   1HG2  THR  62          1HG2      THR  62 -13.717  -6.109   2.672
  464   2HG2  THR  62          2HG2      THR  62 -13.039  -5.028   3.890
  465   3HG2  THR  62          3HG2      THR  62 -12.404  -6.663   3.710
  466    H    GLU  63           H        GLU  63  -9.613  -4.811   0.575
  467    HA   GLU  63           HA       GLU  63 -10.692  -3.467  -1.620
  468   1HB   GLU  63          1HB       GLU  63  -7.747  -3.923  -1.116
  469   2HB   GLU  63          2HB       GLU  63  -8.486  -2.580  -1.976
  470   1HG   GLU  63          1HG       GLU  63  -8.668  -3.158   0.968
  471   2HG   GLU  63          2HG       GLU  63  -7.782  -1.847   0.194
  472    H    HIS  64           H        HIS  64  -9.328  -6.578  -1.395
  473    HA   HIS  64           HA       HIS  64  -8.160  -6.899  -3.887
  474   1HB   HIS  64          1HB       HIS  64  -7.663  -8.905  -3.090
  475   2HB   HIS  64          2HB       HIS  64  -8.498  -8.430  -1.632
  476    HD1  HIS  64           HD1      HIS  64 -11.186  -9.172  -1.646
  477    HD2  HIS  64           HD2      HIS  64  -8.559 -11.267  -4.080
  478    HE1  HIS  64           HE1      HIS  64 -12.316 -11.355  -2.132
  479    HE2  HIS  64           HE2      HIS  64 -10.590 -12.697  -3.366
  480    H    ALA  65           H        ALA  65 -11.539  -7.362  -2.953
  481    HA   ALA  65           HA       ALA  65 -12.440  -8.670  -5.254
  482   1HB   ALA  65          1HB       ALA  65 -13.690  -8.496  -3.156
  483   2HB   ALA  65          2HB       ALA  65 -14.658  -7.988  -4.539
  484   3HB   ALA  65          3HB       ALA  65 -13.957  -6.778  -3.464
  485    H    GLU  66           H        GLU  66 -13.117  -5.305  -4.473
  486    HA   GLU  66           HA       GLU  66 -14.139  -4.577  -6.951
  487   1HB   GLU  66          1HB       GLU  66 -13.442  -2.196  -6.029
  488   2HB   GLU  66          2HB       GLU  66 -14.750  -3.116  -5.295
  489   1HG   GLU  66          1HG       GLU  66 -13.708  -3.032  -3.334
  490   2HG   GLU  66          2HG       GLU  66 -12.343  -3.910  -4.021
  491    H    ALA  67           H        ALA  67 -10.960  -3.790  -5.598
  492    HA   ALA  67           HA       ALA  67  -9.822  -2.667  -7.861
  493   1HB   ALA  67          1HB       ALA  67  -7.680  -3.065  -6.807
  494   2HB   ALA  67          2HB       ALA  67  -8.418  -4.221  -5.696
  495   3HB   ALA  67          3HB       ALA  67  -8.860  -2.516  -5.617
  496    H    GLU  68           H        GLU  68 -10.290  -6.070  -7.068
  497    HA   GLU  68           HA       GLU  68  -8.478  -7.207  -8.871
  498   1HB   GLU  68          1HB       GLU  68  -9.666  -8.687  -7.402
  499   2HB   GLU  68          2HB       GLU  68 -11.223  -8.135  -8.003
  500   1HG   GLU  68          1HG       GLU  68 -10.952 -10.208  -8.993
  501   2HG   GLU  68          2HG       GLU  68 -10.479  -9.076 -10.256
  502    H    LYS  69           H        LYS  69 -11.931  -6.494  -9.337
  503    HA   LYS  69           HA       LYS  69 -11.933  -7.100 -12.077
  504   1HB   LYS  69          1HB       LYS  69 -13.657  -5.137 -10.566
  505   2HB   LYS  69          2HB       LYS  69 -13.956  -5.630 -12.226
  506   1HG   LYS  69          1HG       LYS  69 -14.140  -7.976 -11.432
  507   2HG   LYS  69          2HG       LYS  69 -14.007  -7.375  -9.777
  508   1HD   LYS  69          1HD       LYS  69 -16.011  -6.024 -10.095
  509   2HD   LYS  69          2HD       LYS  69 -16.137  -6.584 -11.765
  510   1HE   LYS  69          1HE       LYS  69 -16.423  -8.877 -10.971
  511   2HE   LYS  69          2HE       LYS  69 -16.283  -8.321  -9.302
  512   1HZ   LYS  69          1HZ       LYS  69 -18.268  -6.982  -9.623
  513   2HZ   LYS  69          2HZ       LYS  69 -18.586  -8.616  -9.940
  514   3HZ   LYS  69          3HZ       LYS  69 -18.409  -7.527 -11.221
  515    H    ARG  70           H        ARG  70 -12.089  -3.773 -10.789
  516    HA   ARG  70           HA       ARG  70 -11.533  -2.604 -13.284
  517   1HB   ARG  70          1HB       ARG  70 -11.013  -0.525 -11.928
  518   2HB   ARG  70          2HB       ARG  70 -12.603  -1.235 -11.708
  519   1HG   ARG  70          1HG       ARG  70 -11.875  -2.250  -9.614
  520   2HG   ARG  70          2HG       ARG  70 -10.263  -1.565  -9.838
  521   1HD   ARG  70          1HD       ARG  70 -11.160   0.677  -9.723
  522   2HD   ARG  70          2HD       ARG  70 -12.804   0.050  -9.633
  523    HE   ARG  70           HE       ARG  70 -11.398  -1.043  -7.497
  524   1HH1  ARG  70          1HH1      ARG  70 -12.302   2.152  -8.601
  525   2HH1  ARG  70          2HH1      ARG  70 -12.474   2.790  -6.995
  526   1HH2  ARG  70          1HH2      ARG  70 -11.592  -0.209  -5.387
  527   2HH2  ARG  70          2HH2      ARG  70 -12.081   1.454  -5.163
  528    H    ALA  71           H        ALA  71  -9.355  -2.694 -10.493
  529    HA   ALA  71           HA       ALA  71  -7.217  -1.516 -11.802
  530   1HB   ALA  71          1HB       ALA  71  -7.116  -3.274  -9.377
  531   2HB   ALA  71          2HB       ALA  71  -7.506  -1.552  -9.388
  532   3HB   ALA  71          3HB       ALA  71  -5.904  -2.100  -9.885
  533    H    ALA  72           H        ALA  72  -7.755  -5.066 -11.225
  534    HA   ALA  72           HA       ALA  72  -5.289  -5.841 -12.332
  535   1HB   ALA  72          1HB       ALA  72  -7.829  -7.447 -12.504
  536   2HB   ALA  72          2HB       ALA  72  -6.741  -7.408 -11.116
  537   3HB   ALA  72          3HB       ALA  72  -6.177  -8.046 -12.661
  538    H    ALA  73           H        ALA  73  -8.452  -5.381 -13.914
  539    HA   ALA  73           HA       ALA  73  -7.690  -6.118 -16.500
  540   1HB   ALA  73          1HB       ALA  73 -10.010  -5.689 -15.823
  541   2HB   ALA  73          2HB       ALA  73  -9.570  -4.800 -17.283
  542   3HB   ALA  73          3HB       ALA  73  -9.655  -3.963 -15.733
  543    H    ARG  74           H        ARG  74  -7.052  -3.195 -14.715
  544    HA   ARG  74           HA       ARG  74  -6.155  -1.718 -17.034
  545   1HB   ARG  74          1HB       ARG  74  -7.185  -0.747 -14.906
  546   2HB   ARG  74          2HB       ARG  74  -5.627  -1.036 -14.146
  547   1HG   ARG  74          1HG       ARG  74  -5.587   1.206 -14.788
  548   2HG   ARG  74          2HG       ARG  74  -4.627   0.369 -16.009
  549   1HD   ARG  74          1HD       ARG  74  -6.118   1.999 -17.036
  550   2HD   ARG  74          2HD       ARG  74  -6.552   0.359 -17.518
  551    HE   ARG  74           HE       ARG  74  -8.505   0.514 -16.234
  552   1HH1  ARG  74          1HH1      ARG  74  -6.600   3.448 -16.077
  553   2HH1  ARG  74          2HH1      ARG  74  -7.879   4.391 -15.366
  554   1HH2  ARG  74          1HH2      ARG  74 -10.188   1.735 -15.317
  555   2HH2  ARG  74          2HH2      ARG  74  -9.925   3.412 -14.937
  556    H    ALA  75           H        ALA  75  -4.608  -3.209 -14.213
  557    HA   ALA  75           HA       ALA  75  -1.957  -2.459 -14.605
  558   1HB   ALA  75          1HB       ALA  75  -2.809  -3.512 -12.564
  559   2HB   ALA  75          2HB       ALA  75  -1.378  -4.338 -13.179
  560   3HB   ALA  75          3HB       ALA  75  -2.977  -5.043 -13.424
  561    H    GLY  76           H        GLY  76  -3.332  -5.661 -15.394
  562   1HA   GLY  76          1HA       GLY  76  -1.030  -5.978 -17.224
  563   2HA   GLY  76          2HA       GLY  76  -1.752  -7.307 -16.330
  564    H    HIS  77           H        HIS  77  -2.865  -4.719 -18.499
  565    HA   HIS  77           HA       HIS  77  -4.782  -6.507 -19.715
  566   1HB   HIS  77          1HB       HIS  77  -5.531  -4.588 -20.989
  567   2HB   HIS  77          2HB       HIS  77  -5.355  -4.137 -19.301
  568    HD1  HIS  77           HD1      HIS  77  -3.541  -2.364 -18.725
  569    HD2  HIS  77           HD2      HIS  77  -3.794  -3.312 -22.773
  570    HE1  HIS  77           HE1      HIS  77  -2.192  -0.609 -19.924
  571    HE2  HIS  77           HE2      HIS  77  -2.518  -1.095 -22.378
  572    H    ALA  78           H        ALA  78  -1.607  -5.313 -20.373
  573    HA   ALA  78           HA       ALA  78  -1.517  -6.973 -22.773
  574   1HB   ALA  78          1HB       ALA  78  -1.963  -4.696 -23.566
  575   2HB   ALA  78          2HB       ALA  78  -0.366  -5.259 -24.058
  576   3HB   ALA  78          3HB       ALA  78  -0.528  -4.126 -22.716
  577    H    ALA  79           H        ALA  79  -0.130  -8.452 -22.040
  578    HA   ALA  79           HA       ALA  79   2.570  -7.531 -21.404
  579   1HB   ALA  79          1HB       ALA  79   1.094  -9.541 -19.704
  580   2HB   ALA  79          2HB       ALA  79   1.503  -7.892 -19.230
  581   3HB   ALA  79          3HB       ALA  79   2.784  -9.067 -19.523
  582    H    THR  80           H        THR  80   2.949  -8.222 -23.556
  583    HA   THR  80           HA       THR  80   3.624 -11.021 -23.739
  584    HB   THR  80           HB       THR  80   2.422 -10.763 -26.186
  585    HG1  THR  80           HG1      THR  80   0.195 -10.085 -24.851
  586   1HG2  THR  80          1HG2      THR  80   0.716 -12.300 -25.326
  587   2HG2  THR  80          2HG2      THR  80   1.189 -11.899 -23.674
  588   3HG2  THR  80          3HG2      THR  80   2.323 -12.728 -24.739
  Start of MODEL   15
    1    H    MET   1           H        MET   1  10.107   1.125   1.799
    2    HA   MET   1           HA       MET   1   7.708   1.141   1.608
    3   1HB   MET   1          1HB       MET   1   6.685   0.324  -0.488
    4   2HB   MET   1          2HB       MET   1   7.511   1.858  -0.713
    5   1HG   MET   1          1HG       MET   1   9.353   0.786  -1.788
    6   2HG   MET   1          2HG       MET   1   8.712  -0.809  -1.404
    7   1HE   MET   1          1HE       MET   1   5.606  -1.095  -3.704
    8   2HE   MET   1          2HE       MET   1   5.698  -0.669  -1.994
    9   3HE   MET   1          3HE       MET   1   6.715  -1.956  -2.638
   10    H    HIS   2           H        HIS   2   6.444  -0.983   1.424
   11    HA   HIS   2           HA       HIS   2   8.221  -3.319   1.544
   12   1HB   HIS   2          1HB       HIS   2   6.329  -2.447   3.735
   13   2HB   HIS   2          2HB       HIS   2   6.945  -4.090   3.605
   14    HD1  HIS   2           HD1      HIS   2   7.504  -1.361   5.604
   15    HD2  HIS   2           HD2      HIS   2  10.072  -3.684   3.296
   16    HE1  HIS   2           HE1      HIS   2   9.798  -1.036   6.596
   17    HE2  HIS   2           HE2      HIS   2  11.350  -2.360   5.113
   18    H    ALA   3           H        ALA   3   7.407  -4.876   0.325
   19    HA   ALA   3           HA       ALA   3   4.510  -5.308   0.293
   20   1HB   ALA   3          1HB       ALA   3   4.518  -5.657  -2.127
   21   2HB   ALA   3          2HB       ALA   3   6.220  -5.207  -2.193
   22   3HB   ALA   3          3HB       ALA   3   5.010  -4.012  -1.724
   23    H    LYS   4           H        LYS   4   4.101  -7.384   0.787
   24    HA   LYS   4           HA       LYS   4   6.098  -9.414   0.123
   25   1HB   LYS   4          1HB       LYS   4   5.136  -8.777   2.905
   26   2HB   LYS   4          2HB       LYS   4   5.879 -10.316   2.481
   27   1HG   LYS   4          1HG       LYS   4   7.910  -9.187   1.803
   28   2HG   LYS   4          2HG       LYS   4   7.169  -7.618   2.121
   29   1HD   LYS   4          1HD       LYS   4   7.010  -8.133   4.481
   30   2HD   LYS   4          2HD       LYS   4   7.636  -9.760   4.193
   31   1HE   LYS   4          1HE       LYS   4   9.754  -8.858   3.463
   32   2HE   LYS   4          2HE       LYS   4   9.135  -7.213   3.594
   33   1HZ   LYS   4          1HZ       LYS   4   9.425  -9.098   5.869
   34   2HZ   LYS   4          2HZ       LYS   4   8.944  -7.476   5.960
   35   3HZ   LYS   4          3HZ       LYS   4  10.523  -7.865   5.486
   36    H    VAL   5           H        VAL   5   5.269 -11.599   1.041
   37    HA   VAL   5           HA       VAL   5   2.990 -12.181  -0.554
   38    HB   VAL   5           HB       VAL   5   4.876 -13.735  -0.368
   39   1HG1  VAL   5          1HG1      VAL   5   5.521 -13.344   1.924
   40   2HG1  VAL   5          2HG1      VAL   5   5.226 -15.063   1.670
   41   3HG1  VAL   5          3HG1      VAL   5   4.024 -14.077   2.501
   42   1HG2  VAL   5          1HG2      VAL   5   2.704 -14.664  -0.971
   43   2HG2  VAL   5          2HG2      VAL   5   2.339 -14.942   0.732
   44   3HG2  VAL   5          3HG2      VAL   5   3.655 -15.825  -0.046
   45    H    GLY   6           H        GLY   6   1.043 -13.329   0.181
   46   1HA   GLY   6          1HA       GLY   6  -0.720 -13.743   1.651
   47   2HA   GLY   6          2HA       GLY   6   0.284 -13.160   2.977
   48    H    ASP   7           H        ASP   7   0.250 -11.221   0.272
   49    HA   ASP   7           HA       ASP   7  -1.745  -9.285   1.350
   50   1HB   ASP   7          1HB       ASP   7   1.218  -9.005   1.351
   51   2HB   ASP   7          2HB       ASP   7   0.352  -7.662   0.613
   52    H    TYR   8           H        TYR   8  -1.456  -7.342  -0.234
   53    HA   TYR   8           HA       TYR   8  -1.510  -8.412  -2.968
   54   1HB   TYR   8          1HB       TYR   8  -3.696  -6.767  -1.676
   55   2HB   TYR   8          2HB       TYR   8  -3.645  -7.266  -3.359
   56    HD1  TYR   8           HD1      TYR   8  -5.044  -7.959  -0.254
   57    HD2  TYR   8           HD2      TYR   8  -3.465  -9.928  -3.665
   58    HE1  TYR   8           HE1      TYR   8  -6.398  -9.945   0.266
   59    HE2  TYR   8           HE2      TYR   8  -4.817 -11.923  -3.149
   60    HH   TYR   8           HH       TYR   8  -5.855 -12.918  -0.949
   61    H    LEU   9           H        LEU   9  -2.084  -6.424  -4.406
   62    HA   LEU   9           HA       LEU   9  -0.210  -4.310  -3.628
   63   1HB   LEU   9          1HB       LEU   9   1.178  -5.954  -4.647
   64   2HB   LEU   9          2HB       LEU   9   0.024  -6.242  -5.928
   65    HG   LEU   9           HG       LEU   9   1.262  -3.532  -5.756
   66   1HD1  LEU   9          1HD1      LEU   9   3.157  -5.033  -5.449
   67   2HD1  LEU   9          2HD1      LEU   9   3.184  -4.308  -7.057
   68   3HD1  LEU   9          3HD1      LEU   9   2.647  -5.975  -6.850
   69   1HD2  LEU   9          1HD2      LEU   9   1.102  -3.689  -8.188
   70   2HD2  LEU   9          2HD2      LEU   9  -0.458  -4.033  -7.440
   71   3HD2  LEU   9          3HD2      LEU   9   0.535  -5.354  -8.055
   72    H    VAL  10           H        VAL  10  -0.188  -2.524  -5.020
   73    HA   VAL  10           HA       VAL  10  -2.695  -2.032  -6.459
   74    HB   VAL  10           HB       VAL  10  -1.596  -0.244  -4.281
   75   1HG1  VAL  10          1HG1      VAL  10  -4.187  -0.160  -5.800
   76   2HG1  VAL  10          2HG1      VAL  10  -2.817   0.932  -5.997
   77   3HG1  VAL  10          3HG1      VAL  10  -3.725   0.922  -4.487
   78   1HG2  VAL  10          1HG2      VAL  10  -2.425  -2.263  -3.246
   79   2HG2  VAL  10          2HG2      VAL  10  -3.942  -2.126  -4.137
   80   3HG2  VAL  10          3HG2      VAL  10  -3.520  -0.920  -2.919
   81    H    VAL  11           H        VAL  11  -2.542  -0.264  -7.918
   82    HA   VAL  11           HA       VAL  11   0.102   1.003  -8.120
   83    HB   VAL  11           HB       VAL  11  -0.321  -0.723  -9.933
   84   1HG1  VAL  11          1HG1      VAL  11  -2.327   1.317 -10.871
   85   2HG1  VAL  11          2HG1      VAL  11  -2.690  -0.304 -10.273
   86   3HG1  VAL  11          3HG1      VAL  11  -1.788  -0.099 -11.777
   87   1HG2  VAL  11          1HG2      VAL  11   0.122   2.128 -10.797
   88   2HG2  VAL  11          2HG2      VAL  11   0.536   0.696 -11.737
   89   3HG2  VAL  11          3HG2      VAL  11   1.352   1.010 -10.206
   90    H    LYS  12           H        LYS  12  -0.031   3.133  -9.286
   91    HA   LYS  12           HA       LYS  12  -2.189   4.694  -8.304
   92   1HB   LYS  12          1HB       LYS  12  -1.118   6.550  -9.545
   93   2HB   LYS  12          2HB       LYS  12   0.016   5.680  -8.527
   94   1HG   LYS  12          1HG       LYS  12   0.809   4.455 -10.526
   95   2HG   LYS  12          2HG       LYS  12  -0.268   5.441 -11.516
   96   1HD   LYS  12          1HD       LYS  12   0.907   7.463 -10.601
   97   2HD   LYS  12          2HD       LYS  12   2.078   6.365  -9.868
   98   1HE   LYS  12          1HE       LYS  12   2.993   7.128 -11.933
   99   2HE   LYS  12          2HE       LYS  12   2.521   5.442 -12.148
  100   1HZ   LYS  12          1HZ       LYS  12   0.509   6.171 -13.259
  101   2HZ   LYS  12          2HZ       LYS  12   1.869   6.822 -14.036
  102   3HZ   LYS  12          3HZ       LYS  12   0.927   7.798 -13.016
  103    H    GLY  13           H        GLY  13  -4.181   4.605  -9.126
  104   1HA   GLY  13          1HA       GLY  13  -4.863   3.625 -11.674
  105   2HA   GLY  13          2HA       GLY  13  -5.910   4.605 -10.651
  106    H    THR  14           H        THR  14  -4.813   6.957 -10.497
  107    HA   THR  14           HA       THR  14  -3.898   7.800 -13.155
  108    HB   THR  14           HB       THR  14  -6.233   8.492 -12.992
  109    HG1  THR  14           HG1      THR  14  -4.454   9.992 -13.781
  110   1HG2  THR  14          1HG2      THR  14  -6.990  10.052 -11.252
  111   2HG2  THR  14          2HG2      THR  14  -5.425   9.912 -10.451
  112   3HG2  THR  14          3HG2      THR  14  -6.486   8.507 -10.568
  113    H    THR  15           H        THR  15  -3.877   8.060  -9.725
  114    HA   THR  15           HA       THR  15  -1.189   9.088  -9.725
  115    HB   THR  15           HB       THR  15  -3.275  10.603  -8.123
  116    HG1  THR  15           HG1      THR  15  -2.680  10.833 -10.770
  117   1HG2  THR  15          1HG2      THR  15  -1.482  12.280  -7.905
  118   2HG2  THR  15          2HG2      THR  15  -0.401  11.229  -8.820
  119   3HG2  THR  15          3HG2      THR  15  -1.002  10.719  -7.242
  120    H    THR  16           H        THR  16  -0.435   9.062  -7.286
  121    HA   THR  16           HA       THR  16  -1.129   6.649  -6.035
  122    HB   THR  16           HB       THR  16  -0.045   9.069  -4.577
  123    HG1  THR  16           HG1      THR  16   1.001   7.970  -6.725
  124   1HG2  THR  16          1HG2      THR  16   1.130   7.376  -3.242
  125   2HG2  THR  16          2HG2      THR  16   0.379   6.101  -4.202
  126   3HG2  THR  16          3HG2      THR  16  -0.618   7.139  -3.180
  127    H    GLU  17           H        GLU  17  -2.505   9.818  -5.906
  128    HA   GLU  17           HA       GLU  17  -4.254   9.536  -3.723
  129   1HB   GLU  17          1HB       GLU  17  -4.676  11.082  -6.295
  130   2HB   GLU  17          2HB       GLU  17  -5.512  11.349  -4.771
  131   1HG   GLU  17          1HG       GLU  17  -3.528  12.134  -3.725
  132   2HG   GLU  17          2HG       GLU  17  -2.539  11.633  -5.095
  133    H    ARG  18           H        ARG  18  -5.767   8.073  -3.482
  134    HA   ARG  18           HA       ARG  18  -7.376   6.539  -3.844
  135   1HB   ARG  18          1HB       ARG  18  -8.600   8.148  -5.190
  136   2HB   ARG  18          2HB       ARG  18  -7.604   7.776  -6.593
  137   1HG   ARG  18          1HG       ARG  18  -8.535   5.609  -6.796
  138   2HG   ARG  18          2HG       ARG  18  -9.310   5.720  -5.215
  139   1HD   ARG  18          1HD       ARG  18  -9.983   7.401  -7.628
  140   2HD   ARG  18          2HD       ARG  18 -10.913   6.021  -7.045
  141    HE   ARG  18           HE       ARG  18 -10.781   8.682  -5.866
  142   1HH1  ARG  18          1HH1      ARG  18 -11.811   5.351  -5.530
  143   2HH1  ARG  18          2HH1      ARG  18 -12.982   5.700  -4.292
  144   1HH2  ARG  18          1HH2      ARG  18 -12.317   9.146  -4.257
  145   2HH2  ARG  18          2HH2      ARG  18 -13.275   7.865  -3.576
  146    H    HIS  19           H        HIS  19  -6.337   4.720  -3.655
  147    HA   HIS  19           HA       HIS  19  -4.474   3.854  -5.704
  148   1HB   HIS  19          1HB       HIS  19  -3.999   1.989  -4.064
  149   2HB   HIS  19          2HB       HIS  19  -3.642   3.611  -3.495
  150    HD1  HIS  19           HD1      HIS  19  -4.678   4.305  -1.330
  151    HD2  HIS  19           HD2      HIS  19  -6.425   0.864  -2.886
  152    HE1  HIS  19           HE1      HIS  19  -6.204   3.435   0.477
  153    HE2  HIS  19           HE2      HIS  19  -7.211   1.316  -0.462
  154    H    ASP  20           H        ASP  20  -4.876   2.368  -7.219
  155    HA   ASP  20           HA       ASP  20  -7.332   0.764  -6.991
  156   1HB   ASP  20          1HB       ASP  20  -7.578   2.948  -8.347
  157   2HB   ASP  20          2HB       ASP  20  -6.563   2.164  -9.550
  158    H    GLN  21           H        GLN  21  -7.377  -0.865  -8.921
  159    HA   GLN  21           HA       GLN  21  -6.469  -2.707  -9.905
  160   1HB   GLN  21          1HB       GLN  21  -4.124  -0.837 -10.103
  161   2HB   GLN  21          2HB       GLN  21  -3.982  -2.509 -10.617
  162   1HG   GLN  21          1HG       GLN  21  -4.435  -1.049 -12.492
  163   2HG   GLN  21          2HG       GLN  21  -5.762  -2.179 -12.237
  164   1HE2  GLN  21          1HE2      GLN  21  -7.736  -1.416 -11.575
  165   2HE2  GLN  21          2HE2      GLN  21  -8.145   0.264 -11.560
  166    H    HIS  22           H        HIS  22  -6.447  -4.365  -8.480
  167    HA   HIS  22           HA       HIS  22  -4.145  -4.522  -6.643
  168   1HB   HIS  22          1HB       HIS  22  -6.997  -5.275  -5.968
  169   2HB   HIS  22          2HB       HIS  22  -5.608  -5.526  -4.924
  170    HD1  HIS  22           HD1      HIS  22  -5.282  -2.258  -6.447
  171    HD2  HIS  22           HD2      HIS  22  -7.397  -3.845  -3.249
  172    HE1  HIS  22           HE1      HIS  22  -6.045  -0.285  -5.093
  173    HE2  HIS  22           HE2      HIS  22  -7.540  -1.261  -3.323
  174    H    ALA  23           H        ALA  23  -3.298  -6.537  -6.266
  175    HA   ALA  23           HA       ALA  23  -4.618  -9.019  -7.127
  176   1HB   ALA  23          1HB       ALA  23  -2.852  -9.726  -8.606
  177   2HB   ALA  23          2HB       ALA  23  -2.021  -8.183  -8.410
  178   3HB   ALA  23          3HB       ALA  23  -3.586  -8.245  -9.219
  179    H    GLU  24           H        GLU  24  -2.903 -10.848  -6.739
  180    HA   GLU  24           HA       GLU  24  -2.062 -10.294  -3.982
  181   1HB   GLU  24          1HB       GLU  24  -3.592 -12.156  -4.175
  182   2HB   GLU  24          2HB       GLU  24  -2.551 -12.940  -5.360
  183   1HG   GLU  24          1HG       GLU  24  -0.832 -13.278  -3.709
  184   2HG   GLU  24          2HG       GLU  24  -1.735 -12.347  -2.521
  185    H    ILE  25           H        ILE  25  -0.094 -10.243  -3.326
  186    HA   ILE  25           HA       ILE  25   2.078 -11.109  -5.057
  187    HB   ILE  25           HB       ILE  25   2.244  -9.885  -2.295
  188   1HG1  ILE  25          1HG1      ILE  25   2.464  -8.512  -4.986
  189   2HG1  ILE  25          2HG1      ILE  25   1.082  -8.386  -3.901
  190   1HG2  ILE  25          1HG2      ILE  25   4.287 -10.177  -4.496
  191   2HG2  ILE  25          2HG2      ILE  25   4.244 -11.083  -2.984
  192   3HG2  ILE  25          3HG2      ILE  25   4.544  -9.346  -2.961
  193   1HD1  ILE  25          1HD1      ILE  25   3.886  -7.464  -3.306
  194   2HD1  ILE  25          2HD1      ILE  25   2.505  -7.339  -2.215
  195   3HD1  ILE  25          3HD1      ILE  25   2.517  -6.436  -3.730
  196    H    ILE  26           H        ILE  26   2.365 -13.222  -5.029
  197    HA   ILE  26           HA       ILE  26   2.314 -14.644  -2.462
  198    HB   ILE  26           HB       ILE  26   2.430 -16.689  -4.161
  199   1HG1  ILE  26          1HG1      ILE  26   0.719 -16.066  -6.024
  200   2HG1  ILE  26          2HG1      ILE  26   1.273 -14.419  -5.760
  201   1HG2  ILE  26          1HG2      ILE  26  -0.007 -16.856  -3.975
  202   2HG2  ILE  26          2HG2      ILE  26  -0.070 -15.173  -3.454
  203   3HG2  ILE  26          3HG2      ILE  26   0.752 -16.374  -2.458
  204   1HD1  ILE  26          1HD1      ILE  26   2.408 -15.460  -7.632
  205   2HD1  ILE  26          2HD1      ILE  26   2.994 -16.745  -6.577
  206   3HD1  ILE  26          3HD1      ILE  26   3.540 -15.087  -6.334
  207    H    GLU  27           H        GLU  27   4.280 -13.826  -5.206
  208    HA   GLU  27           HA       GLU  27   6.569 -14.977  -3.774
  209   1HB   GLU  27          1HB       GLU  27   6.101 -14.854  -6.747
  210   2HB   GLU  27          2HB       GLU  27   7.688 -15.130  -6.042
  211   1HG   GLU  27          1HG       GLU  27   6.743 -17.118  -4.881
  212   2HG   GLU  27          2HG       GLU  27   5.254 -16.875  -5.794
  213    H    VAL  28           H        VAL  28   7.849 -13.494  -3.015
  214    HA   VAL  28           HA       VAL  28   7.658 -10.791  -4.106
  215    HB   VAL  28           HB       VAL  28   8.817 -11.755  -1.488
  216   1HG1  VAL  28          1HG1      VAL  28   8.367  -8.953  -2.506
  217   2HG1  VAL  28          2HG1      VAL  28   9.933  -9.733  -2.278
  218   3HG1  VAL  28          3HG1      VAL  28   8.908  -9.388  -0.885
  219   1HG2  VAL  28          1HG2      VAL  28   6.841 -10.663  -0.523
  220   2HG2  VAL  28          2HG2      VAL  28   6.408 -11.989  -1.603
  221   3HG2  VAL  28          3HG2      VAL  28   6.254 -10.320  -2.151
  222    H    ARG  29           H        ARG  29   9.255 -10.168  -5.479
  223    HA   ARG  29           HA       ARG  29  11.632 -11.829  -5.649
  224   1HB   ARG  29          1HB       ARG  29  10.754  -9.545  -7.420
  225   2HB   ARG  29          2HB       ARG  29  12.084 -10.648  -7.743
  226   1HG   ARG  29          1HG       ARG  29   9.139 -11.215  -7.754
  227   2HG   ARG  29          2HG       ARG  29  10.314 -11.432  -9.054
  228   1HD   ARG  29          1HD       ARG  29  10.208 -13.016  -6.486
  229   2HD   ARG  29          2HD       ARG  29   9.639 -13.571  -8.058
  230    HE   ARG  29           HE       ARG  29  12.035 -13.308  -8.781
  231   1HH1  ARG  29          1HH1      ARG  29  11.221 -13.846  -5.419
  232   2HH1  ARG  29          2HH1      ARG  29  12.663 -14.744  -5.079
  233   1HH2  ARG  29          1HH2      ARG  29  13.933 -14.503  -8.346
  234   2HH2  ARG  29          2HH2      ARG  29  14.228 -15.086  -6.732
  235    H    SER  30           H        SER  30  10.739  -8.885  -4.246
  236    HA   SER  30           HA       SER  30  13.567  -8.365  -3.660
  237   1HB   SER  30          1HB       SER  30  12.631  -6.646  -5.232
  238   2HB   SER  30          2HB       SER  30  11.441  -6.230  -4.001
  239    HG   SER  30           HG       SER  30  14.263  -6.089  -3.675
  240    H    ALA  31           H        ALA  31  13.758  -9.074  -1.645
  241    HA   ALA  31           HA       ALA  31  11.719  -9.595   0.144
  242   1HB   ALA  31          1HB       ALA  31  14.587  -8.992   0.837
  243   2HB   ALA  31          2HB       ALA  31  13.973 -10.549   0.279
  244   3HB   ALA  31          3HB       ALA  31  13.433  -9.891   1.824
  245    H    ASP  32           H        ASP  32  13.573  -6.621  -0.226
  246    HA   ASP  32           HA       ASP  32  12.532  -5.456   2.186
  247   1HB   ASP  32          1HB       ASP  32  14.730  -4.807   1.139
  248   2HB   ASP  32          2HB       ASP  32  13.815  -4.014  -0.141
  249    H    GLY  33           H        GLY  33  12.053  -4.678  -1.274
  250   1HA   GLY  33          1HA       GLY  33   9.404  -4.741  -1.543
  251   2HA   GLY  33          2HA       GLY  33   9.595  -3.270  -0.604
  252    H    SER  34           H        SER  34  10.443  -4.840  -3.646
  253    HA   SER  34           HA       SER  34  10.068  -2.320  -5.018
  254   1HB   SER  34          1HB       SER  34  12.703  -3.812  -5.226
  255   2HB   SER  34          2HB       SER  34  12.233  -2.423  -6.205
  256    HG   SER  34           HG       SER  34  11.929  -1.869  -3.581
  257    HA   PRO  35           HA       PRO  35   8.425  -5.124  -8.072
  258   1HB   PRO  35          1HB       PRO  35   9.112  -3.133 -10.123
  259   2HB   PRO  35          2HB       PRO  35   7.524  -3.712  -9.615
  260   1HG   PRO  35          1HG       PRO  35   8.376  -1.229  -9.035
  261   2HG   PRO  35          2HG       PRO  35   7.345  -2.151  -7.925
  262   1HD   PRO  35          1HD       PRO  35  10.307  -1.693  -7.823
  263   2HD   PRO  35          2HD       PRO  35   9.115  -1.666  -6.503
  264    HA   PRO  36           HA       PRO  36   7.942  -5.822 -10.127
  265   1HB   PRO  36          1HB       PRO  36   8.078  -8.027 -11.611
  266   2HB   PRO  36          2HB       PRO  36   8.601  -6.467 -12.257
  267   1HG   PRO  36          1HG       PRO  36  10.232  -8.757 -11.274
  268   2HG   PRO  36          2HG       PRO  36  10.559  -7.632 -12.603
  269   1HD   PRO  36          1HD       PRO  36  11.609  -7.494 -10.000
  270   2HD   PRO  36          2HD       PRO  36  11.670  -6.214 -11.227
  271    H    TYR  37           H        TYR  37   6.496  -7.866  -9.976
  272    HA   TYR  37           HA       TYR  37   7.384  -9.563  -7.720
  273   1HB   TYR  37          1HB       TYR  37   4.677  -8.222  -7.969
  274   2HB   TYR  37          2HB       TYR  37   5.146  -9.361  -6.713
  275    HD1  TYR  37           HD1      TYR  37   6.687  -8.686  -4.935
  276    HD2  TYR  37           HD2      TYR  37   5.442  -5.937  -7.933
  277    HE1  TYR  37           HE1      TYR  37   7.502  -6.820  -3.556
  278    HE2  TYR  37           HE2      TYR  37   6.253  -4.065  -6.565
  279    HH   TYR  37           HH       TYR  37   8.256  -4.488  -3.872
  280    H    VAL  38           H        VAL  38   6.239 -11.593  -7.577
  281    HA   VAL  38           HA       VAL  38   5.049 -12.422 -10.131
  282    HB   VAL  38           HB       VAL  38   5.883 -14.144  -7.777
  283   1HG1  VAL  38          1HG1      VAL  38   4.078 -15.132  -9.095
  284   2HG1  VAL  38          2HG1      VAL  38   5.586 -16.021  -9.320
  285   3HG1  VAL  38          3HG1      VAL  38   5.021 -14.907 -10.568
  286   1HG2  VAL  38          1HG2      VAL  38   7.252 -13.657 -10.420
  287   2HG2  VAL  38          2HG2      VAL  38   7.746 -14.848  -9.217
  288   3HG2  VAL  38          3HG2      VAL  38   7.815 -13.127  -8.836
  289    H    VAL  39           H        VAL  39   2.908 -12.542 -10.261
  290    HA   VAL  39           HA       VAL  39   1.406 -12.208  -7.767
  291    HB   VAL  39           HB       VAL  39   1.486 -10.340 -10.119
  292   1HG1  VAL  39          1HG1      VAL  39  -0.405  -9.150  -9.146
  293   2HG1  VAL  39          2HG1      VAL  39  -0.563 -10.405  -7.916
  294   3HG1  VAL  39          3HG1      VAL  39  -0.850 -10.791  -9.613
  295   1HG2  VAL  39          1HG2      VAL  39   3.106  -9.918  -8.351
  296   2HG2  VAL  39          2HG2      VAL  39   1.810  -9.895  -7.155
  297   3HG2  VAL  39          3HG2      VAL  39   1.886  -8.645  -8.396
  298    H    ARG  40           H        ARG  40  -0.475 -13.196  -7.716
  299    HA   ARG  40           HA       ARG  40  -1.586 -14.201 -10.240
  300   1HB   ARG  40          1HB       ARG  40  -2.799 -15.855  -8.715
  301   2HB   ARG  40          2HB       ARG  40  -1.072 -16.095  -8.950
  302   1HG   ARG  40          1HG       ARG  40  -0.597 -15.127  -6.801
  303   2HG   ARG  40          2HG       ARG  40  -2.297 -14.706  -6.578
  304   1HD   ARG  40          1HD       ARG  40  -1.614 -16.741  -5.344
  305   2HD   ARG  40          2HD       ARG  40  -2.917 -17.018  -6.497
  306    HE   ARG  40           HE       ARG  40  -0.618 -17.617  -7.879
  307   1HH1  ARG  40          1HH1      ARG  40  -2.034 -18.695  -4.849
  308   2HH1  ARG  40          2HH1      ARG  40  -1.471 -20.331  -5.025
  309   1HH2  ARG  40          1HH2      ARG  40   0.102 -19.759  -8.123
  310   2HH2  ARG  40          2HH2      ARG  40  -0.259 -20.945  -6.893
  311    H    TRP  41           H        TRP  41  -3.689 -13.870 -10.703
  312    HA   TRP  41           HA       TRP  41  -5.119 -11.857  -9.140
  313   1HB   TRP  41          1HB       TRP  41  -6.030 -13.189 -11.710
  314   2HB   TRP  41          2HB       TRP  41  -6.554 -11.644 -11.048
  315    HD1  TRP  41           HD1      TRP  41  -3.767 -13.239 -13.089
  316    HE1  TRP  41           HE1      TRP  41  -2.290 -11.389 -14.093
  317    HE3  TRP  41           HE3      TRP  41  -5.720  -9.211 -10.629
  318    HZ2  TRP  41           HZ2      TRP  41  -1.994  -8.595 -13.880
  319    HZ3  TRP  41           HZ3      TRP  41  -4.779  -6.988 -11.084
  320    HH2  TRP  41           HH2      TRP  41  -2.956  -6.686 -12.674
  321    H    LEU  42           H        LEU  42  -6.414 -12.587  -7.552
  322    HA   LEU  42           HA       LEU  42  -6.872 -15.452  -7.386
  323   1HB   LEU  42          1HB       LEU  42  -7.835 -13.400  -5.416
  324   2HB   LEU  42          2HB       LEU  42  -7.541 -15.105  -5.144
  325    HG   LEU  42           HG       LEU  42  -5.573 -12.864  -5.347
  326   1HD1  LEU  42          1HD1      LEU  42  -6.448 -13.416  -3.167
  327   2HD1  LEU  42          2HD1      LEU  42  -4.753 -13.886  -3.276
  328   3HD1  LEU  42          3HD1      LEU  42  -6.015 -15.109  -3.393
  329   1HD2  LEU  42          1HD2      LEU  42  -4.946 -15.796  -5.655
  330   2HD2  LEU  42          2HD2      LEU  42  -3.764 -14.505  -5.421
  331   3HD2  LEU  42          3HD2      LEU  42  -4.747 -14.547  -6.886
  332    H    VAL  43           H        VAL  43  -8.892 -12.540  -7.178
  333    HA   VAL  43           HA       VAL  43 -11.245 -14.170  -7.015
  334    HB   VAL  43           HB       VAL  43 -12.327 -11.799  -6.997
  335   1HG1  VAL  43          1HG1      VAL  43 -12.209 -13.295  -5.096
  336   2HG1  VAL  43          2HG1      VAL  43 -11.836 -11.646  -4.595
  337   3HG1  VAL  43          3HG1      VAL  43 -10.536 -12.819  -4.807
  338   1HG2  VAL  43          1HG2      VAL  43  -9.454 -11.154  -6.350
  339   2HG2  VAL  43          2HG2      VAL  43 -10.826 -10.074  -6.108
  340   3HG2  VAL  43          3HG2      VAL  43 -10.359 -10.555  -7.739
  341    H    ASN  44           H        ASN  44  -9.422 -12.884  -9.525
  342    HA   ASN  44           HA       ASN  44 -11.695 -13.150 -11.333
  343   1HB   ASN  44          1HB       ASN  44  -8.863 -12.199 -11.774
  344   2HB   ASN  44          2HB       ASN  44  -9.937 -12.567 -13.118
  345   1HD2  ASN  44          1HD2      ASN  44  -9.335 -10.469 -10.420
  346   2HD2  ASN  44          2HD2      ASN  44 -10.399  -9.194 -10.924
  347    H    GLY  45           H        GLY  45  -8.468 -14.515 -10.761
  348   1HA   GLY  45          1HA       GLY  45  -8.202 -16.913 -10.699
  349   2HA   GLY  45          2HA       GLY  45  -9.431 -17.035 -11.949
  350    H    HIS  46           H        HIS  46  -6.123 -15.927 -11.317
  351    HA   HIS  46           HA       HIS  46  -5.197 -17.075 -13.775
  352   1HB   HIS  46          1HB       HIS  46  -5.981 -14.315 -13.800
  353   2HB   HIS  46          2HB       HIS  46  -4.238 -14.416 -14.002
  354    HD1  HIS  46           HD1      HIS  46  -7.386 -14.764 -15.814
  355    HD2  HIS  46           HD2      HIS  46  -3.453 -16.023 -16.289
  356    HE1  HIS  46           HE1      HIS  46  -7.178 -15.456 -18.221
  357    HE2  HIS  46           HE2      HIS  46  -4.726 -15.945 -18.534
  358    H    GLU  47           H        GLU  47  -2.831 -16.774 -14.042
  359    HA   GLU  47           HA       GLU  47  -1.417 -15.982 -11.586
  360   1HB   GLU  47          1HB       GLU  47  -1.646 -18.445 -11.586
  361   2HB   GLU  47          2HB       GLU  47  -0.912 -18.513 -13.180
  362   1HG   GLU  47          1HG       GLU  47   1.013 -18.833 -12.128
  363   2HG   GLU  47          2HG       GLU  47   0.942 -17.125 -11.696
  364    H    THR  48           H        THR  48   0.150 -14.550 -12.068
  365    HA   THR  48           HA       THR  48   1.385 -14.590 -14.725
  366    HB   THR  48           HB       THR  48   0.993 -12.110 -14.932
  367    HG1  THR  48           HG1      THR  48  -0.028 -12.462 -12.492
  368   1HG2  THR  48          1HG2      THR  48  -1.299 -12.279 -15.764
  369   2HG2  THR  48          2HG2      THR  48  -1.516 -13.799 -14.897
  370   3HG2  THR  48          3HG2      THR  48  -0.366 -13.702 -16.230
  371    H    THR  49           H        THR  49   3.020 -12.695 -14.851
  372    HA   THR  49           HA       THR  49   4.171 -12.079 -12.206
  373    HB   THR  49           HB       THR  49   5.705 -12.390 -14.801
  374    HG1  THR  49           HG1      THR  49   4.978 -14.160 -12.826
  375   1HG2  THR  49          1HG2      THR  49   6.659 -11.900 -11.973
  376   2HG2  THR  49          2HG2      THR  49   6.699 -10.732 -13.292
  377   3HG2  THR  49          3HG2      THR  49   7.697 -12.184 -13.368
  378    H    VAL  50           H        VAL  50   3.827  -9.971 -11.763
  379    HA   VAL  50           HA       VAL  50   3.022  -8.313 -14.050
  380    HB   VAL  50           HB       VAL  50   2.261  -7.975 -11.147
  381   1HG1  VAL  50          1HG1      VAL  50   1.202  -6.632 -13.632
  382   2HG1  VAL  50          2HG1      VAL  50   2.190  -5.879 -12.381
  383   3HG1  VAL  50          3HG1      VAL  50   0.560  -6.432 -12.003
  384   1HG2  VAL  50          1HG2      VAL  50   0.690  -9.147 -13.436
  385   2HG2  VAL  50          2HG2      VAL  50   0.061  -8.822 -11.822
  386   3HG2  VAL  50          3HG2      VAL  50   1.329 -10.027 -12.048
  387    H    TYR  51           H        TYR  51   3.886  -6.407 -14.452
  388    HA   TYR  51           HA       TYR  51   5.918  -5.328 -12.629
  389   1HB   TYR  51          1HB       TYR  51   5.360  -4.654 -15.534
  390   2HB   TYR  51          2HB       TYR  51   6.645  -3.963 -14.553
  391    HD1  TYR  51           HD1      TYR  51   8.706  -5.072 -14.292
  392    HD2  TYR  51           HD2      TYR  51   5.450  -7.093 -16.135
  393    HE1  TYR  51           HE1      TYR  51  10.233  -6.854 -15.019
  394    HE2  TYR  51           HE2      TYR  51   6.968  -8.885 -16.867
  395    HH   TYR  51           HH       TYR  51  10.244  -9.093 -15.743
  396    HA   PRO  52           HA       PRO  52   2.472  -2.425 -11.990
  397   1HB   PRO  52          1HB       PRO  52   2.990  -1.865  -9.419
  398   2HB   PRO  52          2HB       PRO  52   2.234  -3.391  -9.891
  399   1HG   PRO  52          1HG       PRO  52   5.064  -2.836  -9.120
  400   2HG   PRO  52          2HG       PRO  52   4.049  -4.237  -8.736
  401   1HD   PRO  52          1HD       PRO  52   5.954  -4.142 -10.754
  402   2HD   PRO  52          2HD       PRO  52   4.617  -5.304 -10.662
  403    H    GLY  53           H        GLY  53   2.443  -0.128 -11.478
  404   1HA   GLY  53          1HA       GLY  53   4.846   1.218 -12.341
  405   2HA   GLY  53          2HA       GLY  53   3.300   1.971 -11.977
  406    H    SER  54           H        SER  54   5.476   3.271 -11.132
  407    HA   SER  54           HA       SER  54   6.510   2.560  -8.630
  408   1HB   SER  54          1HB       SER  54   6.141   5.356  -9.732
  409   2HB   SER  54          2HB       SER  54   7.292   4.853  -8.494
  410    HG   SER  54           HG       SER  54   7.714   4.932 -11.060
  411    H    ASP  55           H        ASP  55   6.044   3.225  -6.549
  412    HA   ASP  55           HA       ASP  55   4.756   3.653  -4.746
  413   1HB   ASP  55          1HB       ASP  55   3.119   5.246  -6.710
  414   2HB   ASP  55          2HB       ASP  55   2.611   5.029  -5.039
  415    H    ALA  56           H        ALA  56   4.643   1.266  -5.335
  416    HA   ALA  56           HA       ALA  56   1.950   0.330  -5.870
  417   1HB   ALA  56          1HB       ALA  56   2.905  -1.909  -5.612
  418   2HB   ALA  56          2HB       ALA  56   4.437  -1.202  -5.096
  419   3HB   ALA  56          3HB       ALA  56   3.854  -0.941  -6.741
  420    H    VAL  57           H        VAL  57   0.472   0.002  -4.333
  421    HA   VAL  57           HA       VAL  57   1.308   0.284  -1.531
  422    HB   VAL  57           HB       VAL  57  -1.531   0.289  -2.535
  423   1HG1  VAL  57          1HG1      VAL  57  -1.988   1.572  -0.522
  424   2HG1  VAL  57          2HG1      VAL  57  -0.281   1.522  -0.088
  425   3HG1  VAL  57          3HG1      VAL  57  -1.224   0.032  -0.126
  426   1HG2  VAL  57          1HG2      VAL  57  -0.365   1.993  -3.803
  427   2HG2  VAL  57          2HG2      VAL  57   0.331   2.653  -2.324
  428   3HG2  VAL  57          3HG2      VAL  57  -1.407   2.754  -2.602
  429    H    VAL  58           H        VAL  58   0.339  -1.130   0.078
  430    HA   VAL  58           HA       VAL  58  -0.182  -3.809  -0.958
  431    HB   VAL  58           HB       VAL  58   0.343  -4.340   1.552
  432   1HG1  VAL  58          1HG1      VAL  58   1.620  -5.171  -0.348
  433   2HG1  VAL  58          2HG1      VAL  58   2.695  -4.686   0.963
  434   3HG1  VAL  58          3HG1      VAL  58   2.488  -3.638  -0.439
  435   1HG2  VAL  58          1HG2      VAL  58   1.811  -1.745   1.156
  436   2HG2  VAL  58          2HG2      VAL  58   2.069  -2.869   2.490
  437   3HG2  VAL  58          3HG2      VAL  58   0.517  -2.046   2.317
  438    H    VAL  59           H        VAL  59  -2.193  -4.563  -0.748
  439    HA   VAL  59           HA       VAL  59  -3.917  -3.441   1.322
  440    HB   VAL  59           HB       VAL  59  -5.707  -4.243  -0.360
  441   1HG1  VAL  59          1HG1      VAL  59  -4.091  -1.757  -0.854
  442   2HG1  VAL  59          2HG1      VAL  59  -5.408  -1.920   0.307
  443   3HG1  VAL  59          3HG1      VAL  59  -5.738  -2.027  -1.422
  444   1HG2  VAL  59          1HG2      VAL  59  -4.245  -5.348  -1.914
  445   2HG2  VAL  59          2HG2      VAL  59  -3.368  -3.843  -2.184
  446   3HG2  VAL  59          3HG2      VAL  59  -5.046  -3.990  -2.705
  447    H    THR  60           H        THR  60  -5.818  -4.950   1.753
  448    HA   THR  60           HA       THR  60  -4.873  -7.703   1.971
  449    HB   THR  60           HB       THR  60  -6.341  -5.702   3.629
  450    HG1  THR  60           HG1      THR  60  -4.267  -7.578   3.980
  451   1HG2  THR  60          1HG2      THR  60  -7.232  -7.354   5.147
  452   2HG2  THR  60          2HG2      THR  60  -6.813  -8.620   3.989
  453   3HG2  THR  60          3HG2      THR  60  -8.001  -7.389   3.562
  454    H    ALA  61           H        ALA  61  -7.377  -8.865   2.475
  455    HA   ALA  61           HA       ALA  61  -7.987  -9.654  -0.097
  456   1HB   ALA  61          1HB       ALA  61  -9.709 -10.001   2.340
  457   2HB   ALA  61          2HB       ALA  61  -8.336 -11.014   1.891
  458   3HB   ALA  61          3HB       ALA  61  -9.769 -10.966   0.864
  459    H    THR  62           H        THR  62  -9.871  -7.346   1.883
  460    HA   THR  62           HA       THR  62 -12.189  -7.526   0.264
  461    HB   THR  62           HB       THR  62 -12.479  -5.093   1.397
  462    HG1  THR  62           HG1      THR  62 -11.516  -5.463   3.579
  463   1HG2  THR  62          1HG2      THR  62 -12.865  -7.771   2.737
  464   2HG2  THR  62          2HG2      THR  62 -13.988  -7.000   1.615
  465   3HG2  THR  62          3HG2      THR  62 -13.670  -6.268   3.187
  466    H    GLU  63           H        GLU  63  -9.921  -4.778   0.540
  467    HA   GLU  63           HA       GLU  63 -10.990  -3.314  -1.594
  468   1HB   GLU  63          1HB       GLU  63  -8.156  -3.377  -0.535
  469   2HB   GLU  63          2HB       GLU  63  -8.769  -2.172  -1.658
  470   1HG   GLU  63          1HG       GLU  63 -10.430  -1.507   0.051
  471   2HG   GLU  63          2HG       GLU  63  -9.668  -2.633   1.174
  472    H    HIS  64           H        HIS  64  -8.951  -6.038  -1.467
  473    HA   HIS  64           HA       HIS  64  -7.578  -5.793  -3.893
  474   1HB   HIS  64          1HB       HIS  64  -6.655  -7.273  -2.359
  475   2HB   HIS  64          2HB       HIS  64  -8.196  -8.058  -2.037
  476    HD1  HIS  64           HD1      HIS  64  -5.573  -7.842  -4.750
  477    HD2  HIS  64           HD2      HIS  64  -8.647 -10.317  -3.477
  478    HE1  HIS  64           HE1      HIS  64  -5.414  -9.893  -6.172
  479    HE2  HIS  64           HE2      HIS  64  -7.469 -11.207  -5.595
  480    H    ALA  65           H        ALA  65 -10.775  -7.129  -3.190
  481    HA   ALA  65           HA       ALA  65 -10.887  -8.888  -5.401
  482   1HB   ALA  65          1HB       ALA  65 -12.299  -9.108  -3.420
  483   2HB   ALA  65          2HB       ALA  65 -13.259  -9.069  -4.898
  484   3HB   ALA  65          3HB       ALA  65 -13.164  -7.640  -3.869
  485    H    GLU  66           H        GLU  66 -12.834  -5.958  -4.973
  486    HA   GLU  66           HA       GLU  66 -13.757  -5.900  -7.611
  487   1HB   GLU  66          1HB       GLU  66 -14.307  -3.440  -6.939
  488   2HB   GLU  66          2HB       GLU  66 -15.120  -4.771  -6.131
  489   1HG   GLU  66          1HG       GLU  66 -14.550  -3.689  -4.251
  490   2HG   GLU  66          2HG       GLU  66 -12.966  -4.421  -4.508
  491    H    ALA  67           H        ALA  67 -11.068  -4.237  -6.064
  492    HA   ALA  67           HA       ALA  67 -10.336  -2.787  -8.391
  493   1HB   ALA  67          1HB       ALA  67  -8.312  -2.226  -7.192
  494   2HB   ALA  67          2HB       ALA  67  -8.677  -3.447  -5.972
  495   3HB   ALA  67          3HB       ALA  67  -9.727  -2.043  -6.157
  496    H    GLU  68           H        GLU  68  -9.875  -6.086  -7.482
  497    HA   GLU  68           HA       GLU  68  -7.460  -6.491  -8.962
  498   1HB   GLU  68          1HB       GLU  68  -8.259  -8.103  -7.201
  499   2HB   GLU  68          2HB       GLU  68  -9.512  -8.617  -8.329
  500   1HG   GLU  68          1HG       GLU  68  -7.589  -9.060  -9.964
  501   2HG   GLU  68          2HG       GLU  68  -6.537  -8.935  -8.559
  502    H    LYS  69           H        LYS  69 -10.924  -7.071  -9.643
  503    HA   LYS  69           HA       LYS  69 -10.394  -7.904 -12.305
  504   1HB   LYS  69          1HB       LYS  69 -12.758  -7.361 -12.823
  505   2HB   LYS  69          2HB       LYS  69 -12.563  -8.372 -11.406
  506   1HG   LYS  69          1HG       LYS  69 -14.177  -6.944 -10.690
  507   2HG   LYS  69          2HG       LYS  69 -12.740  -6.086 -10.135
  508   1HD   LYS  69          1HD       LYS  69 -12.996  -4.406 -11.640
  509   2HD   LYS  69          2HD       LYS  69 -13.691  -5.465 -12.870
  510   1HE   LYS  69          1HE       LYS  69 -15.309  -3.814 -11.988
  511   2HE   LYS  69          2HE       LYS  69 -15.813  -5.481 -11.727
  512   1HZ   LYS  69          1HZ       LYS  69 -15.059  -5.323  -9.441
  513   2HZ   LYS  69          2HZ       LYS  69 -16.204  -4.116  -9.776
  514   3HZ   LYS  69          3HZ       LYS  69 -14.556  -3.717  -9.689
  515    H    ARG  70           H        ARG  70 -10.946  -4.701 -10.922
  516    HA   ARG  70           HA       ARG  70 -10.735  -3.248 -13.343
  517   1HB   ARG  70          1HB       ARG  70 -11.414  -2.512 -10.916
  518   2HB   ARG  70          2HB       ARG  70  -9.698  -2.182 -10.736
  519   1HG   ARG  70          1HG       ARG  70 -10.711  -0.148 -11.347
  520   2HG   ARG  70          2HG       ARG  70  -9.879  -0.731 -12.790
  521   1HD   ARG  70          1HD       ARG  70 -11.991  -1.608 -13.653
  522   2HD   ARG  70          2HD       ARG  70 -12.825  -1.046 -12.205
  523    HE   ARG  70           HE       ARG  70 -11.799   0.606 -14.397
  524   1HH1  ARG  70          1HH1      ARG  70 -13.438   0.399 -11.307
  525   2HH1  ARG  70          2HH1      ARG  70 -14.065   2.013 -11.383
  526   1HH2  ARG  70          1HH2      ARG  70 -12.633   2.722 -14.508
  527   2HH2  ARG  70          2HH2      ARG  70 -13.581   3.355 -13.195
  528    H    ALA  71           H        ALA  71  -8.414  -4.897 -11.415
  529    HA   ALA  71           HA       ALA  71  -6.105  -3.443 -12.353
  530   1HB   ALA  71          1HB       ALA  71  -6.259  -6.032 -10.823
  531   2HB   ALA  71          2HB       ALA  71  -6.142  -4.423 -10.114
  532   3HB   ALA  71          3HB       ALA  71  -4.812  -5.057 -11.083
  533    H    ALA  72           H        ALA  72  -7.523  -6.663 -12.932
  534    HA   ALA  72           HA       ALA  72  -5.599  -7.479 -14.817
  535   1HB   ALA  72          1HB       ALA  72  -8.512  -8.255 -14.691
  536   2HB   ALA  72          2HB       ALA  72  -7.198  -9.035 -13.810
  537   3HB   ALA  72          3HB       ALA  72  -7.244  -9.112 -15.571
  538    H    ALA  73           H        ALA  73  -8.233  -5.248 -14.973
  539    HA   ALA  73           HA       ALA  73  -8.285  -5.000 -17.816
  540   1HB   ALA  73          1HB       ALA  73  -9.077  -2.981 -15.721
  541   2HB   ALA  73          2HB       ALA  73 -10.125  -4.233 -16.391
  542   3HB   ALA  73          3HB       ALA  73  -9.518  -2.943 -17.429
  543    H    ARG  74           H        ARG  74  -6.916  -2.745 -15.366
  544    HA   ARG  74           HA       ARG  74  -5.458  -1.358 -17.444
  545   1HB   ARG  74          1HB       ARG  74  -5.552  -0.922 -14.461
  546   2HB   ARG  74          2HB       ARG  74  -4.651   0.091 -15.577
  547   1HG   ARG  74          1HG       ARG  74  -6.787   0.624 -16.729
  548   2HG   ARG  74          2HG       ARG  74  -7.636  -0.278 -15.470
  549   1HD   ARG  74          1HD       ARG  74  -6.540   1.222 -13.787
  550   2HD   ARG  74          2HD       ARG  74  -5.935   2.189 -15.130
  551    HE   ARG  74           HE       ARG  74  -8.361   2.516 -15.721
  552   1HH1  ARG  74          1HH1      ARG  74  -7.280   1.887 -12.453
  553   2HH1  ARG  74          2HH1      ARG  74  -8.670   2.617 -11.698
  554   1HH2  ARG  74          1HH2      ARG  74 -10.163   3.563 -14.744
  555   2HH2  ARG  74          2HH2      ARG  74 -10.293   3.607 -13.016
  556    H    ALA  75           H        ALA  75  -4.427  -2.897 -14.391
  557    HA   ALA  75           HA       ALA  75  -1.672  -2.393 -14.810
  558   1HB   ALA  75          1HB       ALA  75  -1.301  -3.840 -12.884
  559   2HB   ALA  75          2HB       ALA  75  -2.970  -4.403 -12.973
  560   3HB   ALA  75          3HB       ALA  75  -2.629  -2.717 -12.589
  561    H    GLY  76           H        GLY  76  -3.543  -5.418 -15.089
  562   1HA   GLY  76          1HA       GLY  76  -1.210  -6.868 -15.980
  563   2HA   GLY  76          2HA       GLY  76  -2.839  -7.504 -15.825
  564    H    HIS  77           H        HIS  77  -1.939  -4.666 -17.692
  565    HA   HIS  77           HA       HIS  77  -2.651  -6.145 -20.140
  566   1HB   HIS  77          1HB       HIS  77  -4.476  -4.673 -19.481
  567   2HB   HIS  77          2HB       HIS  77  -3.374  -3.306 -19.386
  568    HD1  HIS  77           HD1      HIS  77  -4.744  -5.721 -21.987
  569    HD2  HIS  77           HD2      HIS  77  -3.179  -1.874 -21.684
  570    HE1  HIS  77           HE1      HIS  77  -5.027  -4.685 -24.262
  571    HE2  HIS  77           HE2      HIS  77  -4.210  -2.315 -24.016
  572    H    ALA  78           H        ALA  78  -0.430  -4.032 -18.567
  573    HA   ALA  78           HA       ALA  78   1.256  -3.984 -20.926
  574   1HB   ALA  78          1HB       ALA  78   1.509  -1.563 -20.959
  575   2HB   ALA  78          2HB       ALA  78   0.330  -1.408 -19.656
  576   3HB   ALA  78          3HB       ALA  78  -0.175  -2.014 -21.234
  577    H    ALA  79           H        ALA  79   3.183  -2.281 -20.210
  578    HA   ALA  79           HA       ALA  79   3.862  -2.698 -17.396
  579   1HB   ALA  79          1HB       ALA  79   4.894  -4.583 -18.579
  580   2HB   ALA  79          2HB       ALA  79   6.114  -3.476 -17.952
  581   3HB   ALA  79          3HB       ALA  79   5.706  -3.457 -19.667
  582    H    THR  80           H        THR  80   4.198  -0.696 -16.680
  583    HA   THR  80           HA       THR  80   5.533   1.204 -18.477
  584    HB   THR  80           HB       THR  80   3.192   1.796 -18.348
  585    HG1  THR  80           HG1      THR  80   3.974   3.740 -18.382
  586   1HG2  THR  80          1HG2      THR  80   3.547   1.919 -15.355
  587   2HG2  THR  80          2HG2      THR  80   2.570   0.753 -16.247
  588   3HG2  THR  80          3HG2      THR  80   2.121   2.458 -16.239
  Start of MODEL   16
    1    H    MET   1           H        MET   1   6.643   2.595   1.437
    2    HA   MET   1           HA       MET   1   5.933   0.773   2.838
    3   1HB   MET   1          1HB       MET   1   4.349  -0.247   1.279
    4   2HB   MET   1          2HB       MET   1   4.502   1.472   0.955
    5   1HG   MET   1          1HG       MET   1   4.489   0.557  -1.163
    6   2HG   MET   1          2HG       MET   1   6.211   0.745  -0.846
    7   1HE   MET   1          1HE       MET   1   5.082  -1.081  -3.168
    8   2HE   MET   1          2HE       MET   1   6.077  -2.527  -2.989
    9   3HE   MET   1          3HE       MET   1   6.805  -0.931  -2.817
   10    H    HIS   2           H        HIS   2   5.490  -1.697   2.676
   11    HA   HIS   2           HA       HIS   2   7.799  -3.079   1.499
   12   1HB   HIS   2          1HB       HIS   2   6.814  -3.233   4.321
   13   2HB   HIS   2          2HB       HIS   2   7.527  -4.661   3.576
   14    HD1  HIS   2           HD1      HIS   2   8.745  -2.828   5.961
   15    HD2  HIS   2           HD2      HIS   2   9.927  -2.961   1.974
   16    HE1  HIS   2           HE1      HIS   2  11.129  -2.014   5.926
   17    HE2  HIS   2           HE2      HIS   2  11.800  -2.038   3.490
   18    H    ALA   3           H        ALA   3   7.343  -4.873   0.411
   19    HA   ALA   3           HA       ALA   3   4.515  -5.609   0.216
   20   1HB   ALA   3          1HB       ALA   3   6.806  -6.250  -1.641
   21   2HB   ALA   3          2HB       ALA   3   5.638  -4.947  -1.859
   22   3HB   ALA   3          3HB       ALA   3   5.105  -6.627  -1.920
   23    H    LYS   4           H        LYS   4   3.809  -7.436   1.073
   24    HA   LYS   4           HA       LYS   4   5.752  -9.572   1.624
   25   1HB   LYS   4          1HB       LYS   4   3.516  -8.558   3.380
   26   2HB   LYS   4          2HB       LYS   4   4.335 -10.090   3.651
   27   1HG   LYS   4          1HG       LYS   4   6.440  -8.945   3.974
   28   2HG   LYS   4          2HG       LYS   4   5.678  -7.396   3.609
   29   1HD   LYS   4          1HD       LYS   4   4.289  -7.566   5.568
   30   2HD   LYS   4          2HD       LYS   4   4.886  -9.195   5.893
   31   1HE   LYS   4          1HE       LYS   4   7.095  -8.355   6.329
   32   2HE   LYS   4          2HE       LYS   4   6.620  -6.731   5.831
   33   1HZ   LYS   4          1HZ       LYS   4   5.476  -8.185   8.157
   34   2HZ   LYS   4          2HZ       LYS   4   5.147  -6.584   7.703
   35   3HZ   LYS   4          3HZ       LYS   4   6.693  -7.009   8.254
   36    H    VAL   5           H        VAL   5   4.838 -11.716   1.736
   37    HA   VAL   5           HA       VAL   5   2.907 -12.156  -0.344
   38    HB   VAL   5           HB       VAL   5   4.726 -13.736  -0.128
   39   1HG1  VAL   5          1HG1      VAL   5   3.695 -14.307   2.648
   40   2HG1  VAL   5          2HG1      VAL   5   5.197 -13.476   2.243
   41   3HG1  VAL   5          3HG1      VAL   5   4.993 -15.180   1.835
   42   1HG2  VAL   5          1HG2      VAL   5   2.618 -14.663  -0.916
   43   2HG2  VAL   5          2HG2      VAL   5   2.143 -15.028   0.742
   44   3HG2  VAL   5          3HG2      VAL   5   3.517 -15.862   0.016
   45    H    GLY   6           H        GLY   6   0.835 -13.002  -0.154
   46   1HA   GLY   6          1HA       GLY   6  -1.138 -13.622   0.944
   47   2HA   GLY   6          2HA       GLY   6  -0.320 -13.400   2.489
   48    H    ASP   7           H        ASP   7   0.233 -10.920   0.334
   49    HA   ASP   7           HA       ASP   7  -1.980  -9.201   1.418
   50   1HB   ASP   7          1HB       ASP   7   0.477  -9.026   2.497
   51   2HB   ASP   7          2HB       ASP   7   0.808  -8.106   1.036
   52    H    TYR   8           H        TYR   8  -2.422  -7.457  -0.072
   53    HA   TYR   8           HA       TYR   8  -1.963  -8.506  -2.760
   54   1HB   TYR   8          1HB       TYR   8  -4.166  -6.786  -1.625
   55   2HB   TYR   8          2HB       TYR   8  -4.024  -7.192  -3.332
   56    HD1  TYR   8           HD1      TYR   8  -4.180  -9.605  -4.016
   57    HD2  TYR   8           HD2      TYR   8  -5.142  -8.306  -0.089
   58    HE1  TYR   8           HE1      TYR   8  -5.455 -11.676  -3.656
   59    HE2  TYR   8           HE2      TYR   8  -6.420 -10.380   0.278
   60    HH   TYR   8           HH       TYR   8  -6.152 -13.070  -1.620
   61    H    LEU   9           H        LEU   9  -1.717  -7.084  -4.515
   62    HA   LEU   9           HA       LEU   9  -0.112  -4.743  -3.812
   63   1HB   LEU   9          1HB       LEU   9   0.907  -6.483  -5.224
   64   2HB   LEU   9          2HB       LEU   9  -0.373  -6.287  -6.400
   65    HG   LEU   9           HG       LEU   9   1.322  -3.913  -5.746
   66   1HD1  LEU   9          1HD1      LEU   9   2.152  -6.172  -7.564
   67   2HD1  LEU   9          2HD1      LEU   9   2.928  -5.727  -6.044
   68   3HD1  LEU   9          3HD1      LEU   9   2.966  -4.615  -7.414
   69   1HD2  LEU   9          1HD2      LEU   9   0.933  -3.427  -8.112
   70   2HD2  LEU   9          2HD2      LEU   9  -0.589  -3.681  -7.260
   71   3HD2  LEU   9          3HD2      LEU   9   0.068  -4.954  -8.288
   72    H    VAL  10           H        VAL  10  -0.724  -2.753  -4.289
   73    HA   VAL  10           HA       VAL  10  -2.791  -2.315  -6.340
   74    HB   VAL  10           HB       VAL  10  -3.499  -1.918  -3.812
   75   1HG1  VAL  10          1HG1      VAL  10  -3.097   0.380  -3.097
   76   2HG1  VAL  10          2HG1      VAL  10  -2.064   0.636  -4.504
   77   3HG1  VAL  10          3HG1      VAL  10  -1.584  -0.513  -3.255
   78   1HG2  VAL  10          1HG2      VAL  10  -4.009   0.121  -5.963
   79   2HG2  VAL  10          2HG2      VAL  10  -4.991  -0.134  -4.520
   80   3HG2  VAL  10          3HG2      VAL  10  -4.879  -1.396  -5.746
   81    H    VAL  11           H        VAL  11  -2.606  -0.036  -7.236
   82    HA   VAL  11           HA       VAL  11  -0.061   1.262  -6.538
   83    HB   VAL  11           HB       VAL  11   0.114  -0.198  -8.677
   84   1HG1  VAL  11          1HG1      VAL  11  -0.541   0.933 -10.746
   85   2HG1  VAL  11          2HG1      VAL  11  -1.346   2.183  -9.798
   86   3HG1  VAL  11          3HG1      VAL  11  -1.934   0.522  -9.746
   87   1HG2  VAL  11          1HG2      VAL  11   1.630   1.416  -9.723
   88   2HG2  VAL  11          2HG2      VAL  11   1.835   1.355  -7.972
   89   3HG2  VAL  11          3HG2      VAL  11   0.957   2.694  -8.710
   90    H    LYS  12           H        LYS  12   0.025   3.546  -7.300
   91    HA   LYS  12           HA       LYS  12  -0.767   5.546  -8.048
   92   1HB   LYS  12          1HB       LYS  12  -1.879   3.822  -9.730
   93   2HB   LYS  12          2HB       LYS  12  -3.350   4.365  -8.941
   94   1HG   LYS  12          1HG       LYS  12  -3.068   6.572  -9.690
   95   2HG   LYS  12          2HG       LYS  12  -1.382   6.285 -10.139
   96   1HD   LYS  12          1HD       LYS  12  -3.811   5.056 -11.447
   97   2HD   LYS  12          2HD       LYS  12  -2.792   6.329 -12.126
   98   1HE   LYS  12          1HE       LYS  12  -0.888   4.823 -12.163
   99   2HE   LYS  12          2HE       LYS  12  -1.848   3.556 -11.400
  100   1HZ   LYS  12          1HZ       LYS  12  -3.238   3.446 -13.345
  101   2HZ   LYS  12          2HZ       LYS  12  -1.618   3.271 -13.809
  102   3HZ   LYS  12          3HZ       LYS  12  -2.417   4.743 -14.065
  103    H    GLY  13           H        GLY  13  -1.746   4.098  -5.445
  104   1HA   GLY  13          1HA       GLY  13  -4.164   5.577  -4.837
  105   2HA   GLY  13          2HA       GLY  13  -3.282   4.519  -3.742
  106    H    THR  14           H        THR  14  -2.340   7.395  -5.580
  107    HA   THR  14           HA       THR  14  -0.870   8.362  -3.274
  108    HB   THR  14           HB       THR  14  -1.048   9.737  -5.947
  109    HG1  THR  14           HG1      THR  14   1.106   8.066  -5.676
  110   1HG2  THR  14          1HG2      THR  14   1.231  10.441  -5.385
  111   2HG2  THR  14          2HG2      THR  14   1.147   9.523  -3.882
  112   3HG2  THR  14          3HG2      THR  14   0.091  10.914  -4.124
  113    H    THR  15           H        THR  15  -3.783   9.128  -5.059
  114    HA   THR  15           HA       THR  15  -4.073  11.579  -3.459
  115    HB   THR  15           HB       THR  15  -3.507  12.209  -5.729
  116    HG1  THR  15           HG1      THR  15  -5.009  13.719  -5.829
  117   1HG2  THR  15          1HG2      THR  15  -5.920  10.610  -6.577
  118   2HG2  THR  15          2HG2      THR  15  -4.235  10.204  -6.903
  119   3HG2  THR  15          3HG2      THR  15  -4.949  11.646  -7.624
  120    H    THR  16           H        THR  16  -5.878  11.789  -2.359
  121    HA   THR  16           HA       THR  16  -7.928  11.443  -1.473
  122    HB   THR  16           HB       THR  16  -8.818  10.485  -4.194
  123    HG1  THR  16           HG1      THR  16  -7.912  12.965  -3.365
  124   1HG2  THR  16          1HG2      THR  16 -10.248  11.971  -1.981
  125   2HG2  THR  16          2HG2      THR  16 -10.459  10.267  -2.384
  126   3HG2  THR  16          3HG2      THR  16 -10.949  11.513  -3.533
  127    H    GLU  17           H        GLU  17  -8.600   8.919  -3.788
  128    HA   GLU  17           HA       GLU  17  -7.639   6.744  -2.249
  129   1HB   GLU  17          1HB       GLU  17  -9.693   7.592  -0.926
  130   2HB   GLU  17          2HB       GLU  17 -10.649   6.960  -2.255
  131   1HG   GLU  17          1HG       GLU  17  -8.698   5.265  -0.724
  132   2HG   GLU  17          2HG       GLU  17 -10.371   5.479  -0.218
  133    H    ARG  18           H        ARG  18  -6.825   6.215  -4.267
  134    HA   ARG  18           HA       ARG  18  -8.824   4.972  -6.017
  135   1HB   ARG  18          1HB       ARG  18  -8.025   6.899  -7.237
  136   2HB   ARG  18          2HB       ARG  18  -6.350   6.476  -6.895
  137   1HG   ARG  18          1HG       ARG  18  -6.624   4.417  -8.221
  138   2HG   ARG  18          2HG       ARG  18  -8.273   4.908  -8.606
  139   1HD   ARG  18          1HD       ARG  18  -7.491   6.834  -9.794
  140   2HD   ARG  18          2HD       ARG  18  -5.835   6.547  -9.260
  141    HE   ARG  18           HE       ARG  18  -6.398   4.270 -10.576
  142   1HH1  ARG  18          1HH1      ARG  18  -6.873   7.617 -11.472
  143   2HH1  ARG  18          2HH1      ARG  18  -6.567   7.347 -13.157
  144   1HH2  ARG  18          1HH2      ARG  18  -6.013   3.885 -12.769
  145   2HH2  ARG  18          2HH2      ARG  18  -6.073   5.208 -13.909
  146    H    HIS  19           H        HIS  19  -8.529   2.980  -5.105
  147    HA   HIS  19           HA       HIS  19  -5.910   1.819  -4.985
  148   1HB   HIS  19          1HB       HIS  19  -7.228  -0.322  -4.487
  149   2HB   HIS  19          2HB       HIS  19  -7.325   0.985  -3.318
  150    HD1  HIS  19           HD1      HIS  19  -9.617   2.309  -3.219
  151    HD2  HIS  19           HD2      HIS  19  -9.617  -1.102  -5.597
  152    HE1  HIS  19           HE1      HIS  19 -12.037   1.712  -3.570
  153    HE2  HIS  19           HE2      HIS  19 -11.980  -0.521  -4.739
  154    H    ASP  20           H        ASP  20  -5.049   1.891  -6.976
  155    HA   ASP  20           HA       ASP  20  -6.488   0.882  -9.281
  156   1HB   ASP  20          1HB       ASP  20  -4.890   2.938  -9.142
  157   2HB   ASP  20          2HB       ASP  20  -3.607   1.745  -9.283
  158    H    GLN  21           H        GLN  21  -3.421   0.093 -10.047
  159    HA   GLN  21           HA       GLN  21  -4.250  -2.363 -10.910
  160   1HB   GLN  21          1HB       GLN  21  -1.427  -1.545 -10.237
  161   2HB   GLN  21          2HB       GLN  21  -1.849  -2.981 -11.160
  162   1HG   GLN  21          1HG       GLN  21  -2.948  -1.534 -12.834
  163   2HG   GLN  21          2HG       GLN  21  -2.401  -0.123 -11.930
  164   1HE2  GLN  21          1HE2      GLN  21  -0.505  -3.035 -12.311
  165   2HE2  GLN  21          2HE2      GLN  21   0.705  -2.343 -13.335
  166    H    HIS  22           H        HIS  22  -4.663  -4.312 -10.063
  167    HA   HIS  22           HA       HIS  22  -3.886  -4.696  -7.249
  168   1HB   HIS  22          1HB       HIS  22  -6.438  -4.058  -8.250
  169   2HB   HIS  22          2HB       HIS  22  -6.500  -5.745  -7.754
  170    HD1  HIS  22           HD1      HIS  22  -6.124  -2.294  -6.439
  171    HD2  HIS  22           HD2      HIS  22  -6.214  -6.191  -5.012
  172    HE1  HIS  22           HE1      HIS  22  -6.450  -2.098  -3.949
  173    HE2  HIS  22           HE2      HIS  22  -6.752  -4.464  -3.166
  174    H    ALA  23           H        ALA  23  -3.509  -6.702  -6.543
  175    HA   ALA  23           HA       ALA  23  -4.580  -9.114  -7.571
  176   1HB   ALA  23          1HB       ALA  23  -3.103  -8.689  -9.484
  177   2HB   ALA  23          2HB       ALA  23  -2.648 -10.136  -8.584
  178   3HB   ALA  23          3HB       ALA  23  -1.721  -8.650  -8.388
  179    H    GLU  24           H        GLU  24  -3.084 -11.001  -6.817
  180    HA   GLU  24           HA       GLU  24  -2.504 -10.430  -3.996
  181   1HB   GLU  24          1HB       GLU  24  -4.027 -12.253  -4.343
  182   2HB   GLU  24          2HB       GLU  24  -2.959 -12.994  -5.524
  183   1HG   GLU  24          1HG       GLU  24  -2.710 -14.287  -3.600
  184   2HG   GLU  24          2HG       GLU  24  -1.287 -13.252  -3.629
  185    H    ILE  25           H        ILE  25  -0.503 -10.392  -3.228
  186    HA   ILE  25           HA       ILE  25   1.685 -11.195  -4.986
  187    HB   ILE  25           HB       ILE  25   2.000  -9.946  -2.260
  188   1HG1  ILE  25          1HG1      ILE  25   1.743  -8.477  -4.899
  189   2HG1  ILE  25          2HG1      ILE  25   0.506  -8.510  -3.645
  190   1HG2  ILE  25          1HG2      ILE  25   3.981 -10.933  -3.275
  191   2HG2  ILE  25          2HG2      ILE  25   4.124  -9.176  -3.224
  192   3HG2  ILE  25          3HG2      ILE  25   3.720  -9.984  -4.739
  193   1HD1  ILE  25          1HD1      ILE  25   1.782  -6.446  -3.576
  194   2HD1  ILE  25          2HD1      ILE  25   3.275  -7.361  -3.365
  195   3HD1  ILE  25          3HD1      ILE  25   2.039  -7.389  -2.107
  196    H    ILE  26           H        ILE  26   1.858 -13.341  -4.905
  197    HA   ILE  26           HA       ILE  26   1.985 -14.651  -2.280
  198    HB   ILE  26           HB       ILE  26   1.762 -16.788  -3.404
  199   1HG1  ILE  26          1HG1      ILE  26   2.952 -16.110  -5.536
  200   2HG1  ILE  26          2HG1      ILE  26   1.486 -17.049  -5.783
  201   1HG2  ILE  26          1HG2      ILE  26  -0.295 -14.772  -4.356
  202   2HG2  ILE  26          2HG2      ILE  26  -0.294 -15.623  -2.811
  203   3HG2  ILE  26          3HG2      ILE  26  -0.529 -16.519  -4.312
  204   1HD1  ILE  26          1HD1      ILE  26   1.674 -15.261  -7.400
  205   2HD1  ILE  26          2HD1      ILE  26   1.757 -14.069  -6.101
  206   3HD1  ILE  26          3HD1      ILE  26   0.281 -15.004  -6.349
  207    H    GLU  27           H        GLU  27   3.862 -13.685  -4.976
  208    HA   GLU  27           HA       GLU  27   6.208 -14.984  -3.792
  209   1HB   GLU  27          1HB       GLU  27   5.567 -14.751  -6.738
  210   2HB   GLU  27          2HB       GLU  27   7.096 -15.328  -6.085
  211   1HG   GLU  27          1HG       GLU  27   6.025 -17.221  -5.081
  212   2HG   GLU  27          2HG       GLU  27   4.432 -16.607  -5.519
  213    H    VAL  28           H        VAL  28   7.224 -13.349  -2.884
  214    HA   VAL  28           HA       VAL  28   7.283 -10.756  -4.235
  215    HB   VAL  28           HB       VAL  28   8.143 -11.438  -1.420
  216   1HG1  VAL  28          1HG1      VAL  28   7.691  -8.777  -2.770
  217   2HG1  VAL  28          2HG1      VAL  28   9.252  -9.454  -2.304
  218   3HG1  VAL  28          3HG1      VAL  28   8.076  -9.012  -1.065
  219   1HG2  VAL  28          1HG2      VAL  28   6.055 -10.381  -0.731
  220   2HG2  VAL  28          2HG2      VAL  28   5.755 -11.793  -1.744
  221   3HG2  VAL  28          3HG2      VAL  28   5.600 -10.172  -2.421
  222    H    ARG  29           H        ARG  29   9.003 -10.504  -5.557
  223    HA   ARG  29           HA       ARG  29  11.378 -12.043  -5.324
  224   1HB   ARG  29          1HB       ARG  29  10.230 -10.672  -7.359
  225   2HB   ARG  29          2HB       ARG  29  11.488  -9.536  -6.888
  226   1HG   ARG  29          1HG       ARG  29  11.935 -12.422  -7.631
  227   2HG   ARG  29          2HG       ARG  29  12.191 -11.042  -8.696
  228   1HD   ARG  29          1HD       ARG  29  13.961 -10.218  -7.326
  229   2HD   ARG  29          2HD       ARG  29  13.597 -11.388  -6.057
  230    HE   ARG  29           HE       ARG  29  14.193 -12.744  -8.460
  231   1HH1  ARG  29          1HH1      ARG  29  15.756 -10.843  -5.960
  232   2HH1  ARG  29          2HH1      ARG  29  17.278 -11.678  -6.105
  233   1HH2  ARG  29          1HH2      ARG  29  16.202 -13.822  -8.663
  234   2HH2  ARG  29          2HH2      ARG  29  17.530 -13.358  -7.649
  235    H    SER  30           H        SER  30  10.598  -8.682  -4.674
  236    HA   SER  30           HA       SER  30  12.942  -8.551  -2.912
  237   1HB   SER  30          1HB       SER  30  11.835  -6.334  -4.655
  238   2HB   SER  30          2HB       SER  30  13.161  -6.158  -3.504
  239    HG   SER  30           HG       SER  30  13.358  -6.866  -6.008
  240    H    ALA  31           H        ALA  31  12.305  -8.442  -0.887
  241    HA   ALA  31           HA       ALA  31   9.590  -8.103  -0.175
  242   1HB   ALA  31          1HB       ALA  31  11.143  -9.545   1.051
  243   2HB   ALA  31          2HB       ALA  31  10.337  -8.386   2.110
  244   3HB   ALA  31          3HB       ALA  31  12.009  -8.117   1.618
  245    H    ASP  32           H        ASP  32  12.165  -5.814  -0.473
  246    HA   ASP  32           HA       ASP  32  11.002  -3.917   1.353
  247   1HB   ASP  32          1HB       ASP  32  13.462  -4.002   0.829
  248   2HB   ASP  32          2HB       ASP  32  13.081  -3.353  -0.764
  249    H    GLY  33           H        GLY  33  11.615  -3.702  -2.165
  250   1HA   GLY  33          1HA       GLY  33   9.031  -3.278  -3.004
  251   2HA   GLY  33          2HA       GLY  33   9.594  -1.697  -2.484
  252    H    SER  34           H        SER  34  10.472  -4.420  -4.562
  253    HA   SER  34           HA       SER  34  11.065  -2.568  -6.701
  254   1HB   SER  34          1HB       SER  34  13.163  -4.480  -5.640
  255   2HB   SER  34          2HB       SER  34  13.287  -3.601  -7.163
  256    HG   SER  34           HG       SER  34  12.699  -2.041  -4.960
  257    HA   PRO  35           HA       PRO  35   9.058  -5.957  -8.824
  258   1HB   PRO  35          1HB       PRO  35   9.815  -4.407 -11.219
  259   2HB   PRO  35          2HB       PRO  35   8.211  -4.882 -10.652
  260   1HG   PRO  35          1HG       PRO  35   9.034  -2.339 -10.523
  261   2HG   PRO  35          2HG       PRO  35   8.017  -3.050  -9.255
  262   1HD   PRO  35          1HD       PRO  35  10.979  -2.575  -9.264
  263   2HD   PRO  35          2HD       PRO  35   9.797  -2.282  -7.970
  264    HA   PRO  36           HA       PRO  36   8.687  -6.835 -11.165
  265   1HB   PRO  36          1HB       PRO  36   9.090  -9.640 -11.656
  266   2HB   PRO  36          2HB       PRO  36   8.913  -8.337 -12.831
  267   1HG   PRO  36          1HG       PRO  36  11.234  -9.756 -12.427
  268   2HG   PRO  36          2HG       PRO  36  11.166  -8.123 -13.109
  269   1HD   PRO  36          1HD       PRO  36  11.817  -8.991 -10.325
  270   2HD   PRO  36          2HD       PRO  36  12.546  -7.700 -11.304
  271    H    TYR  37           H        TYR  37   6.810  -7.693 -10.312
  272    HA   TYR  37           HA       TYR  37   7.114  -9.294  -7.840
  273   1HB   TYR  37          1HB       TYR  37   4.824  -7.554  -8.792
  274   2HB   TYR  37          2HB       TYR  37   4.795  -8.539  -7.336
  275    HD1  TYR  37           HD1      TYR  37   5.758  -5.391  -8.774
  276    HD2  TYR  37           HD2      TYR  37   6.434  -7.999  -5.483
  277    HE1  TYR  37           HE1      TYR  37   6.712  -3.518  -7.492
  278    HE2  TYR  37           HE2      TYR  37   7.396  -6.137  -4.195
  279    HH   TYR  37           HH       TYR  37   7.073  -2.905  -5.124
  280    H    VAL  38           H        VAL  38   6.163 -11.314  -7.754
  281    HA   VAL  38           HA       VAL  38   4.872 -12.178 -10.238
  282    HB   VAL  38           HB       VAL  38   5.839 -13.903  -7.946
  283   1HG1  VAL  38          1HG1      VAL  38   3.971 -14.887  -9.181
  284   2HG1  VAL  38          2HG1      VAL  38   5.468 -15.762  -9.506
  285   3HG1  VAL  38          3HG1      VAL  38   4.831 -14.631 -10.700
  286   1HG2  VAL  38          1HG2      VAL  38   7.638 -14.568  -9.483
  287   2HG2  VAL  38          2HG2      VAL  38   7.701 -12.845  -9.115
  288   3HG2  VAL  38          3HG2      VAL  38   7.055 -13.394 -10.662
  289    H    VAL  39           H        VAL  39   2.819 -12.019 -10.280
  290    HA   VAL  39           HA       VAL  39   1.379 -11.852  -7.728
  291    HB   VAL  39           HB       VAL  39   1.893  -9.839  -9.592
  292   1HG1  VAL  39          1HG1      VAL  39  -0.998 -10.657  -9.788
  293   2HG1  VAL  39          2HG1      VAL  39   0.194 -10.686 -11.088
  294   3HG1  VAL  39          3HG1      VAL  39  -0.312  -9.147 -10.392
  295   1HG2  VAL  39          1HG2      VAL  39  -0.156  -9.955  -7.392
  296   2HG2  VAL  39          2HG2      VAL  39   0.442  -8.482  -8.155
  297   3HG2  VAL  39          3HG2      VAL  39   1.542  -9.506  -7.233
  298    H    ARG  40           H        ARG  40  -0.802 -12.528  -7.755
  299    HA   ARG  40           HA       ARG  40  -1.529 -14.133 -10.106
  300   1HB   ARG  40          1HB       ARG  40  -0.715 -15.541  -8.224
  301   2HB   ARG  40          2HB       ARG  40  -2.004 -14.892  -7.219
  302   1HG   ARG  40          1HG       ARG  40  -3.673 -15.888  -8.638
  303   2HG   ARG  40          2HG       ARG  40  -2.431 -16.440  -9.764
  304   1HD   ARG  40          1HD       ARG  40  -2.721 -17.299  -6.888
  305   2HD   ARG  40          2HD       ARG  40  -3.185 -18.248  -8.301
  306    HE   ARG  40           HE       ARG  40  -0.394 -17.397  -8.077
  307   1HH1  ARG  40          1HH1      ARG  40  -2.773 -19.940  -7.835
  308   2HH1  ARG  40          2HH1      ARG  40  -1.612 -21.225  -7.935
  309   1HH2  ARG  40          1HH2      ARG  40   1.157 -19.071  -8.188
  310   2HH2  ARG  40          2HH2      ARG  40   0.630 -20.729  -8.130
  311    H    TRP  41           H        TRP  41  -3.423 -13.635 -10.934
  312    HA   TRP  41           HA       TRP  41  -5.269 -11.877  -9.609
  313   1HB   TRP  41          1HB       TRP  41  -6.033 -13.557 -11.978
  314   2HB   TRP  41          2HB       TRP  41  -6.513 -11.913 -11.587
  315    HD1  TRP  41           HD1      TRP  41  -4.500 -13.711 -13.975
  316    HE1  TRP  41           HE1      TRP  41  -2.781 -12.182 -15.130
  317    HE3  TRP  41           HE3      TRP  41  -4.665  -9.726 -10.776
  318    HZ2  TRP  41           HZ2      TRP  41  -1.644  -9.638 -14.742
  319    HZ3  TRP  41           HZ3      TRP  41  -3.228  -7.781 -11.243
  320    HH2  TRP  41           HH2      TRP  41  -1.748  -7.740 -13.185
  321    H    LEU  42           H        LEU  42  -6.376 -12.678  -7.902
  322    HA   LEU  42           HA       LEU  42  -6.837 -15.547  -7.727
  323   1HB   LEU  42          1HB       LEU  42  -7.748 -13.445  -5.778
  324   2HB   LEU  42          2HB       LEU  42  -7.570 -15.163  -5.489
  325    HG   LEU  42           HG       LEU  42  -5.419 -13.091  -5.764
  326   1HD1  LEU  42          1HD1      LEU  42  -6.126 -15.090  -3.634
  327   2HD1  LEU  42          2HD1      LEU  42  -6.419 -13.352  -3.584
  328   3HD1  LEU  42          3HD1      LEU  42  -4.767 -13.968  -3.581
  329   1HD2  LEU  42          1HD2      LEU  42  -3.778 -14.895  -5.623
  330   2HD2  LEU  42          2HD2      LEU  42  -4.725 -14.993  -7.108
  331   3HD2  LEU  42          3HD2      LEU  42  -5.072 -16.084  -5.766
  332    H    VAL  43           H        VAL  43  -8.809 -12.606  -7.561
  333    HA   VAL  43           HA       VAL  43 -11.224 -14.141  -7.682
  334    HB   VAL  43           HB       VAL  43 -12.225 -11.760  -7.736
  335   1HG1  VAL  43          1HG1      VAL  43 -10.634 -12.758  -5.391
  336   2HG1  VAL  43          2HG1      VAL  43 -12.266 -13.267  -5.825
  337   3HG1  VAL  43          3HG1      VAL  43 -11.966 -11.606  -5.310
  338   1HG2  VAL  43          1HG2      VAL  43 -10.174 -10.563  -8.324
  339   2HG2  VAL  43          2HG2      VAL  43  -9.413 -11.150  -6.844
  340   3HG2  VAL  43          3HG2      VAL  43 -10.785 -10.045  -6.753
  341    H    ASN  44           H        ASN  44  -9.054 -12.894  -9.900
  342    HA   ASN  44           HA       ASN  44 -11.067 -13.117 -11.988
  343   1HB   ASN  44          1HB       ASN  44  -8.154 -12.320 -12.067
  344   2HB   ASN  44          2HB       ASN  44  -9.057 -12.679 -13.533
  345   1HD2  ASN  44          1HD2      ASN  44  -8.672 -10.493 -10.864
  346   2HD2  ASN  44          2HD2      ASN  44  -9.578  -9.189 -11.560
  347    H    GLY  45           H        GLY  45  -7.726 -14.404 -11.777
  348   1HA   GLY  45          1HA       GLY  45  -7.710 -16.837 -11.074
  349   2HA   GLY  45          2HA       GLY  45  -8.866 -17.060 -12.371
  350    H    HIS  46           H        HIS  46  -5.531 -15.842 -11.814
  351    HA   HIS  46           HA       HIS  46  -4.385 -17.852 -13.375
  352   1HB   HIS  46          1HB       HIS  46  -5.513 -16.211 -15.142
  353   2HB   HIS  46          2HB       HIS  46  -4.010 -15.324 -14.904
  354    HD1  HIS  46           HD1      HIS  46  -3.256 -18.815 -14.482
  355    HD2  HIS  46           HD2      HIS  46  -3.833 -16.290 -17.750
  356    HE1  HIS  46           HE1      HIS  46  -2.214 -19.986 -16.447
  357    HE2  HIS  46           HE2      HIS  46  -2.755 -18.541 -18.439
  358    H    GLU  47           H        GLU  47  -2.004 -17.307 -13.923
  359    HA   GLU  47           HA       GLU  47  -0.922 -15.733 -11.674
  360   1HB   GLU  47          1HB       GLU  47   0.445 -18.145 -12.848
  361   2HB   GLU  47          2HB       GLU  47   0.700 -17.400 -11.279
  362   1HG   GLU  47          1HG       GLU  47  -0.437 -19.272 -10.663
  363   2HG   GLU  47          2HG       GLU  47  -1.778 -18.149 -10.868
  364    H    THR  48           H        THR  48   0.987 -14.520 -12.067
  365    HA   THR  48           HA       THR  48   2.502 -14.756 -14.450
  366    HB   THR  48           HB       THR  48   0.448 -13.827 -15.419
  367    HG1  THR  48           HG1      THR  48   1.621 -12.735 -16.802
  368   1HG2  THR  48          1HG2      THR  48  -0.335 -12.467 -13.565
  369   2HG2  THR  48          2HG2      THR  48  -0.148 -11.477 -15.012
  370   3HG2  THR  48          3HG2      THR  48   1.065 -11.407 -13.735
  371    H    THR  49           H        THR  49   3.686 -12.580 -14.853
  372    HA   THR  49           HA       THR  49   4.626 -11.554 -12.244
  373    HB   THR  49           HB       THR  49   6.223 -11.828 -14.807
  374    HG1  THR  49           HG1      THR  49   5.582 -13.716 -13.173
  375   1HG2  THR  49          1HG2      THR  49   7.081 -11.048 -12.018
  376   2HG2  THR  49          2HG2      THR  49   6.961  -9.962 -13.402
  377   3HG2  THR  49          3HG2      THR  49   8.151 -11.264 -13.405
  378    H    VAL  50           H        VAL  50   4.319  -9.395 -11.945
  379    HA   VAL  50           HA       VAL  50   3.484  -7.861 -14.327
  380    HB   VAL  50           HB       VAL  50   1.929  -6.613 -12.902
  381   1HG1  VAL  50          1HG1      VAL  50   1.529  -9.599 -12.835
  382   2HG1  VAL  50          2HG1      VAL  50   1.110  -8.516 -14.162
  383   3HG1  VAL  50          3HG1      VAL  50   0.265  -8.387 -12.620
  384   1HG2  VAL  50          1HG2      VAL  50   2.705  -8.595 -10.763
  385   2HG2  VAL  50          2HG2      VAL  50   1.385  -7.430 -10.653
  386   3HG2  VAL  50          3HG2      VAL  50   3.053  -6.866 -10.760
  387    H    TYR  51           H        TYR  51   3.756  -5.618 -14.294
  388    HA   TYR  51           HA       TYR  51   5.610  -4.515 -12.292
  389   1HB   TYR  51          1HB       TYR  51   5.434  -3.778 -15.230
  390   2HB   TYR  51          2HB       TYR  51   6.498  -3.029 -14.046
  391    HD1  TYR  51           HD1      TYR  51   8.333  -4.421 -13.019
  392    HD2  TYR  51           HD2      TYR  51   6.066  -5.745 -16.365
  393    HE1  TYR  51           HE1      TYR  51  10.079  -6.064 -13.546
  394    HE2  TYR  51           HE2      TYR  51   7.808  -7.398 -16.898
  395    HH   TYR  51           HH       TYR  51  10.358  -7.598 -16.441
  396    HA   PRO  52           HA       PRO  52   1.723  -2.174 -11.998
  397   1HB   PRO  52          1HB       PRO  52   2.022  -1.390  -9.439
  398   2HB   PRO  52          2HB       PRO  52   1.534  -3.034  -9.867
  399   1HG   PRO  52          1HG       PRO  52   4.221  -2.007  -9.046
  400   2HG   PRO  52          2HG       PRO  52   3.402  -3.506  -8.573
  401   1HD   PRO  52          1HD       PRO  52   5.349  -3.363 -10.498
  402   2HD   PRO  52          2HD       PRO  52   4.091  -4.613 -10.450
  403    H    GLY  53           H        GLY  53   4.990  -1.107 -11.349
  404   1HA   GLY  53          1HA       GLY  53   5.803   0.974 -12.206
  405   2HA   GLY  53          2HA       GLY  53   4.190   1.645 -12.009
  406    H    SER  54           H        SER  54   5.390   3.394 -10.935
  407    HA   SER  54           HA       SER  54   6.478   2.796  -8.316
  408   1HB   SER  54          1HB       SER  54   6.746   5.342  -8.266
  409   2HB   SER  54          2HB       SER  54   7.671   4.470  -9.488
  410    HG   SER  54           HG       SER  54   5.266   5.935  -9.837
  411    H    ASP  55           H        ASP  55   5.738   4.183  -6.442
  412    HA   ASP  55           HA       ASP  55   4.145   4.685  -4.914
  413   1HB   ASP  55          1HB       ASP  55   2.858   5.651  -7.434
  414   2HB   ASP  55          2HB       ASP  55   1.911   5.616  -5.950
  415    H    ALA  56           H        ALA  56   4.405   2.059  -5.630
  416    HA   ALA  56           HA       ALA  56   1.749   0.909  -5.825
  417   1HB   ALA  56          1HB       ALA  56   4.427  -0.420  -5.399
  418   2HB   ALA  56          2HB       ALA  56   3.624  -0.192  -6.953
  419   3HB   ALA  56          3HB       ALA  56   2.904  -1.244  -5.733
  420    H    VAL  57           H        VAL  57   0.602   0.072  -4.149
  421    HA   VAL  57           HA       VAL  57   1.787   0.342  -1.460
  422    HB   VAL  57           HB       VAL  57  -1.120   0.894  -2.065
  423   1HG1  VAL  57          1HG1      VAL  57   0.604   1.587   0.306
  424   2HG1  VAL  57          2HG1      VAL  57  -0.618   0.317   0.242
  425   3HG1  VAL  57          3HG1      VAL  57  -1.097   2.009   0.108
  426   1HG2  VAL  57          1HG2      VAL  57   1.110   2.911  -1.841
  427   2HG2  VAL  57          2HG2      VAL  57  -0.610   3.289  -1.929
  428   3HG2  VAL  57          3HG2      VAL  57   0.196   2.524  -3.300
  429    H    VAL  58           H        VAL  58   0.747  -1.060   0.164
  430    HA   VAL  58           HA       VAL  58  -0.056  -3.582  -1.041
  431    HB   VAL  58           HB       VAL  58   0.526  -4.379   1.347
  432   1HG1  VAL  58          1HG1      VAL  58   2.875  -4.645   0.701
  433   2HG1  VAL  58          2HG1      VAL  58   2.659  -3.418  -0.549
  434   3HG1  VAL  58          3HG1      VAL  58   1.793  -4.951  -0.658
  435   1HG2  VAL  58          1HG2      VAL  58   1.989  -1.752   1.272
  436   2HG2  VAL  58          2HG2      VAL  58   2.247  -3.031   2.458
  437   3HG2  VAL  58          3HG2      VAL  58   0.696  -2.193   2.387
  438    H    VAL  59           H        VAL  59  -2.029  -4.334  -0.783
  439    HA   VAL  59           HA       VAL  59  -3.834  -3.051   1.148
  440    HB   VAL  59           HB       VAL  59  -5.531  -3.910  -0.671
  441   1HG1  VAL  59          1HG1      VAL  59  -5.470  -1.695  -1.727
  442   2HG1  VAL  59          2HG1      VAL  59  -3.888  -1.408  -0.999
  443   3HG1  VAL  59          3HG1      VAL  59  -5.312  -1.588   0.026
  444   1HG2  VAL  59          1HG2      VAL  59  -3.897  -4.991  -2.077
  445   2HG2  VAL  59          2HG2      VAL  59  -3.018  -3.472  -2.253
  446   3HG2  VAL  59          3HG2      VAL  59  -4.635  -3.640  -2.939
  447    H    THR  60           H        THR  60  -5.869  -4.489   1.414
  448    HA   THR  60           HA       THR  60  -4.917  -7.259   1.964
  449    HB   THR  60           HB       THR  60  -5.577  -5.779   3.914
  450    HG1  THR  60           HG1      THR  60  -7.393  -7.586   4.459
  451   1HG2  THR  60          1HG2      THR  60  -7.427  -4.575   2.889
  452   2HG2  THR  60          2HG2      THR  60  -7.950  -5.395   4.360
  453   3HG2  THR  60          3HG2      THR  60  -8.352  -6.073   2.782
  454    H    ALA  61           H        ALA  61  -7.364  -8.419   2.503
  455    HA   ALA  61           HA       ALA  61  -8.034  -9.377  -0.035
  456   1HB   ALA  61          1HB       ALA  61  -8.187 -10.694   2.016
  457   2HB   ALA  61          2HB       ALA  61  -9.692 -10.732   1.097
  458   3HB   ALA  61          3HB       ALA  61  -9.561  -9.720   2.536
  459    H    THR  62           H        THR  62  -9.922  -7.212   2.098
  460    HA   THR  62           HA       THR  62 -12.198  -7.243   0.396
  461    HB   THR  62           HB       THR  62 -12.678  -5.062   1.763
  462    HG1  THR  62           HG1      THR  62 -11.536  -5.198   3.809
  463   1HG2  THR  62          1HG2      THR  62 -13.575  -6.445   3.582
  464   2HG2  THR  62          2HG2      THR  62 -12.596  -7.804   3.029
  465   3HG2  THR  62          3HG2      THR  62 -13.887  -7.171   2.007
  466    H    GLU  63           H        GLU  63  -9.442  -5.090   0.787
  467    HA   GLU  63           HA       GLU  63 -10.356  -3.127  -1.076
  468   1HB   GLU  63          1HB       GLU  63  -7.510  -3.772  -0.272
  469   2HB   GLU  63          2HB       GLU  63  -8.096  -2.260  -0.957
  470   1HG   GLU  63          1HG       GLU  63  -9.339  -1.770   1.026
  471   2HG   GLU  63          2HG       GLU  63  -8.985  -3.361   1.696
  472    H    HIS  64           H        HIS  64  -9.193  -6.252  -1.340
  473    HA   HIS  64           HA       HIS  64  -7.782  -5.980  -3.824
  474   1HB   HIS  64          1HB       HIS  64  -6.807  -7.612  -2.568
  475   2HB   HIS  64          2HB       HIS  64  -8.332  -8.160  -1.892
  476    HD1  HIS  64           HD1      HIS  64  -9.033 -10.388  -2.698
  477    HD2  HIS  64           HD2      HIS  64  -6.645  -8.403  -5.475
  478    HE1  HIS  64           HE1      HIS  64  -8.723 -11.995  -4.609
  479    HE2  HIS  64           HE2      HIS  64  -7.242 -10.787  -6.267
  480    H    ALA  65           H        ALA  65 -10.977  -7.246  -2.880
  481    HA   ALA  65           HA       ALA  65 -11.264  -8.969  -5.070
  482   1HB   ALA  65          1HB       ALA  65 -13.609  -9.088  -4.468
  483   2HB   ALA  65          2HB       ALA  65 -13.446  -7.639  -3.477
  484   3HB   ALA  65          3HB       ALA  65 -12.596  -9.115  -3.024
  485    H    GLU  66           H        GLU  66 -13.071  -5.954  -4.603
  486    HA   GLU  66           HA       GLU  66 -14.138  -5.916  -7.199
  487   1HB   GLU  66          1HB       GLU  66 -14.366  -3.331  -6.442
  488   2HB   GLU  66          2HB       GLU  66 -15.440  -4.607  -5.894
  489   1HG   GLU  66          1HG       GLU  66 -14.840  -3.380  -3.964
  490   2HG   GLU  66          2HG       GLU  66 -13.912  -4.876  -3.893
  491    H    ALA  67           H        ALA  67 -11.277  -4.480  -5.813
  492    HA   ALA  67           HA       ALA  67 -10.637  -2.863  -8.062
  493   1HB   ALA  67          1HB       ALA  67  -8.546  -2.463  -6.933
  494   2HB   ALA  67          2HB       ALA  67  -8.864  -3.797  -5.825
  495   3HB   ALA  67          3HB       ALA  67  -9.888  -2.362  -5.794
  496    H    GLU  68           H        GLU  68 -10.048  -6.237  -7.351
  497    HA   GLU  68           HA       GLU  68  -7.824  -6.350  -9.189
  498   1HB   GLU  68          1HB       GLU  68  -8.152  -7.998  -7.251
  499   2HB   GLU  68          2HB       GLU  68  -9.375  -8.767  -8.260
  500   1HG   GLU  68          1HG       GLU  68  -7.532  -8.849 -10.060
  501   2HG   GLU  68          2HG       GLU  68  -6.421  -8.539  -8.732
  502    H    LYS  69           H        LYS  69 -11.297  -7.035  -9.246
  503    HA   LYS  69           HA       LYS  69 -11.407  -7.978 -11.884
  504   1HB   LYS  69          1HB       LYS  69 -13.335  -6.212 -10.371
  505   2HB   LYS  69          2HB       LYS  69 -13.676  -6.846 -11.975
  506   1HG   LYS  69          1HG       LYS  69 -13.405  -9.142 -11.068
  507   2HG   LYS  69          2HG       LYS  69 -13.223  -8.443  -9.459
  508   1HD   LYS  69          1HD       LYS  69 -15.437  -7.518  -9.548
  509   2HD   LYS  69          2HD       LYS  69 -15.619  -7.996 -11.234
  510   1HE   LYS  69          1HE       LYS  69 -16.841  -9.540  -9.871
  511   2HE   LYS  69          2HE       LYS  69 -15.431 -10.367 -10.526
  512   1HZ   LYS  69          1HZ       LYS  69 -16.023 -10.678  -8.065
  513   2HZ   LYS  69          2HZ       LYS  69 -15.332  -9.146  -7.838
  514   3HZ   LYS  69          3HZ       LYS  69 -14.404 -10.413  -8.473
  515    H    ARG  70           H        ARG  70 -11.900  -4.597 -10.851
  516    HA   ARG  70           HA       ARG  70 -11.819  -3.457 -13.418
  517   1HB   ARG  70          1HB       ARG  70 -10.955  -2.124 -10.849
  518   2HB   ARG  70          2HB       ARG  70 -11.537  -1.331 -12.301
  519   1HG   ARG  70          1HG       ARG  70 -13.234  -3.200 -10.680
  520   2HG   ARG  70          2HG       ARG  70 -13.131  -1.469 -10.359
  521   1HD   ARG  70          1HD       ARG  70 -13.687  -1.299 -12.924
  522   2HD   ARG  70          2HD       ARG  70 -14.355  -2.912 -12.657
  523    HE   ARG  70           HE       ARG  70 -15.169  -0.716 -10.883
  524   1HH1  ARG  70          1HH1      ARG  70 -15.982  -3.034 -13.382
  525   2HH1  ARG  70          2HH1      ARG  70 -17.692  -2.760 -13.256
  526   1HH2  ARG  70          1HH2      ARG  70 -17.417  -0.384 -10.690
  527   2HH2  ARG  70          2HH2      ARG  70 -18.514  -1.275 -11.709
  528    H    ALA  71           H        ALA  71  -9.301  -3.342 -10.916
  529    HA   ALA  71           HA       ALA  71  -7.582  -1.899 -12.691
  530   1HB   ALA  71          1HB       ALA  71  -7.797  -1.304 -10.335
  531   2HB   ALA  71          2HB       ALA  71  -6.128  -1.649 -10.789
  532   3HB   ALA  71          3HB       ALA  71  -7.062  -2.844  -9.889
  533    H    ALA  72           H        ALA  72  -7.852  -5.279 -11.864
  534    HA   ALA  72           HA       ALA  72  -5.136  -5.792 -12.733
  535   1HB   ALA  72          1HB       ALA  72  -7.365  -7.784 -12.360
  536   2HB   ALA  72          2HB       ALA  72  -6.181  -7.330 -11.134
  537   3HB   ALA  72          3HB       ALA  72  -5.658  -8.150 -12.604
  538    H    ALA  73           H        ALA  73  -8.422  -5.947 -14.107
  539    HA   ALA  73           HA       ALA  73  -7.731  -6.885 -16.650
  540   1HB   ALA  73          1HB       ALA  73  -9.772  -4.770 -15.962
  541   2HB   ALA  73          2HB       ALA  73 -10.043  -6.512 -15.928
  542   3HB   ALA  73          3HB       ALA  73  -9.708  -5.701 -17.458
  543    H    ARG  74           H        ARG  74  -7.374  -3.699 -15.207
  544    HA   ARG  74           HA       ARG  74  -6.372  -2.491 -17.631
  545   1HB   ARG  74          1HB       ARG  74  -6.263  -1.468 -14.788
  546   2HB   ARG  74          2HB       ARG  74  -6.005  -0.518 -16.247
  547   1HG   ARG  74          1HG       ARG  74  -8.282  -0.791 -16.909
  548   2HG   ARG  74          2HG       ARG  74  -8.574  -1.945 -15.609
  549   1HD   ARG  74          1HD       ARG  74  -9.503   0.110 -14.899
  550   2HD   ARG  74          2HD       ARG  74  -8.006  -0.102 -13.995
  551    HE   ARG  74           HE       ARG  74  -7.245   1.386 -16.130
  552   1HH1  ARG  74          1HH1      ARG  74  -9.806   1.692 -13.774
  553   2HH1  ARG  74          2HH1      ARG  74  -9.788   3.434 -13.776
  554   1HH2  ARG  74          1HH2      ARG  74  -7.223   3.689 -16.169
  555   2HH2  ARG  74          2HH2      ARG  74  -8.325   4.561 -15.143
  556    H    ALA  75           H        ALA  75  -4.944  -3.747 -14.648
  557    HA   ALA  75           HA       ALA  75  -2.313  -2.838 -14.906
  558   1HB   ALA  75          1HB       ALA  75  -1.710  -4.630 -13.384
  559   2HB   ALA  75          2HB       ALA  75  -3.250  -5.434 -13.686
  560   3HB   ALA  75          3HB       ALA  75  -3.217  -3.867 -12.875
  561    H    GLY  76           H        GLY  76  -3.599  -6.050 -15.831
  562   1HA   GLY  76          1HA       GLY  76  -1.094  -6.662 -17.165
  563   2HA   GLY  76          2HA       GLY  76  -2.460  -7.745 -16.972
  564    H    HIS  77           H        HIS  77  -2.329  -4.496 -18.365
  565    HA   HIS  77           HA       HIS  77  -3.658  -5.428 -20.764
  566   1HB   HIS  77          1HB       HIS  77  -4.285  -3.265 -19.783
  567   2HB   HIS  77          2HB       HIS  77  -2.642  -2.678 -19.999
  568    HD1  HIS  77           HD1      HIS  77  -5.648  -3.747 -22.066
  569    HD2  HIS  77           HD2      HIS  77  -2.144  -1.525 -22.428
  570    HE1  HIS  77           HE1      HIS  77  -5.797  -2.594 -24.295
  571    HE2  HIS  77           HE2      HIS  77  -3.691  -1.227 -24.486
  572    H    ALA  78           H        ALA  78  -0.463  -4.458 -19.732
  573    HA   ALA  78           HA       ALA  78   0.557  -5.292 -22.359
  574   1HB   ALA  78          1HB       ALA  78   1.619  -2.987 -20.732
  575   2HB   ALA  78          2HB       ALA  78   0.679  -2.855 -22.219
  576   3HB   ALA  78          3HB       ALA  78   2.286  -3.583 -22.252
  577    H    ALA  79           H        ALA  79   1.144  -7.307 -21.678
  578    HA   ALA  79           HA       ALA  79   3.440  -7.355 -19.835
  579   1HB   ALA  79          1HB       ALA  79   1.292  -9.469 -20.029
  580   2HB   ALA  79          2HB       ALA  79   1.506  -8.334 -18.697
  581   3HB   ALA  79          3HB       ALA  79   2.739  -9.551 -19.023
  582    H    THR  80           H        THR  80   5.042  -7.484 -21.299
  583    HA   THR  80           HA       THR  80   5.163  -9.825 -23.004
  584    HB   THR  80           HB       THR  80   5.320  -7.039 -24.186
  585    HG1  THR  80           HG1      THR  80   3.247  -8.729 -23.786
  586   1HG2  THR  80          1HG2      THR  80   6.877  -8.594 -25.261
  587   2HG2  THR  80          2HG2      THR  80   5.541  -8.196 -26.341
  588   3HG2  THR  80          3HG2      THR  80   5.566  -9.749 -25.504
  Start of MODEL   17
    1    H    MET   1           H        MET   1   7.610   2.900   0.890
    2    HA   MET   1           HA       MET   1   6.277   0.917   1.180
    3   1HB   MET   1          1HB       MET   1   6.587   2.061  -1.062
    4   2HB   MET   1          2HB       MET   1   7.782   0.833  -1.443
    5   1HG   MET   1          1HG       MET   1   4.943   0.174  -0.720
    6   2HG   MET   1          2HG       MET   1   5.467   0.483  -2.371
    7   1HE   MET   1          1HE       MET   1   4.622  -1.837  -3.248
    8   2HE   MET   1          2HE       MET   1   3.972  -2.164  -1.640
    9   3HE   MET   1          3HE       MET   1   4.968  -3.373  -2.451
   10    H    HIS   2           H        HIS   2   6.356  -1.075   2.010
   11    HA   HIS   2           HA       HIS   2   8.501  -2.858   1.103
   12   1HB   HIS   2          1HB       HIS   2   8.846  -1.926   3.488
   13   2HB   HIS   2          2HB       HIS   2   7.482  -2.944   3.940
   14    HD1  HIS   2           HD1      HIS   2   7.893  -5.617   3.149
   15    HD2  HIS   2           HD2      HIS   2  11.218  -3.180   3.712
   16    HE1  HIS   2           HE1      HIS   2   9.832  -7.179   3.473
   17    HE2  HIS   2           HE2      HIS   2  11.793  -5.689   3.987
   18    H    ALA   3           H        ALA   3   7.708  -4.681   0.293
   19    HA   ALA   3           HA       ALA   3   4.850  -5.208   0.672
   20   1HB   ALA   3          1HB       ALA   3   6.755  -6.332  -1.382
   21   2HB   ALA   3          2HB       ALA   3   5.676  -4.958  -1.630
   22   3HB   ALA   3          3HB       ALA   3   5.006  -6.564  -1.342
   23    H    LYS   4           H        LYS   4   4.211  -7.543   0.674
   24    HA   LYS   4           HA       LYS   4   6.087  -9.469   1.650
   25   1HB   LYS   4          1HB       LYS   4   4.794  -9.869   3.800
   26   2HB   LYS   4          2HB       LYS   4   5.799  -8.430   3.761
   27   1HG   LYS   4          1HG       LYS   4   3.871  -7.657   4.751
   28   2HG   LYS   4          2HG       LYS   4   3.614  -7.221   3.062
   29   1HD   LYS   4          1HD       LYS   4   1.585  -8.165   3.858
   30   2HD   LYS   4          2HD       LYS   4   2.336  -9.369   2.810
   31   1HE   LYS   4          1HE       LYS   4   3.267 -10.460   4.848
   32   2HE   LYS   4          2HE       LYS   4   2.339  -9.321   5.825
   33   1HZ   LYS   4          1HZ       LYS   4   0.328 -10.169   4.577
   34   2HZ   LYS   4          2HZ       LYS   4   1.034 -11.250   5.683
   35   3HZ   LYS   4          3HZ       LYS   4   1.319 -11.432   4.022
   36    H    VAL   5           H        VAL   5   5.009 -11.587   2.017
   37    HA   VAL   5           HA       VAL   5   3.130 -11.969  -0.154
   38    HB   VAL   5           HB       VAL   5   4.910 -13.537  -0.127
   39   1HG1  VAL   5          1HG1      VAL   5   4.253 -14.094   2.761
   40   2HG1  VAL   5          2HG1      VAL   5   5.662 -13.221   2.155
   41   3HG1  VAL   5          3HG1      VAL   5   5.471 -14.940   1.804
   42   1HG2  VAL   5          1HG2      VAL   5   2.762 -14.578  -0.633
   43   2HG2  VAL   5          2HG2      VAL   5   2.526 -14.942   1.077
   44   3HG2  VAL   5          3HG2      VAL   5   3.838 -15.713   0.184
   45    H    GLY   6           H        GLY   6   1.111 -12.913  -0.024
   46   1HA   GLY   6          1HA       GLY   6  -0.747 -13.840   1.121
   47   2HA   GLY   6          2HA       GLY   6  -0.025 -13.339   2.650
   48    H    ASP   7           H        ASP   7   0.326 -10.960   0.383
   49    HA   ASP   7           HA       ASP   7  -2.227  -9.598   1.141
   50   1HB   ASP   7          1HB       ASP   7   0.574  -8.666   1.648
   51   2HB   ASP   7          2HB       ASP   7  -0.611  -7.474   1.124
   52    H    TYR   8           H        TYR   8  -2.403  -7.563  -0.263
   53    HA   TYR   8           HA       TYR   8  -1.949  -8.587  -2.967
   54   1HB   TYR   8          1HB       TYR   8  -4.061  -6.735  -1.867
   55   2HB   TYR   8          2HB       TYR   8  -3.894  -7.137  -3.571
   56    HD1  TYR   8           HD1      TYR   8  -4.921  -8.367  -0.274
   57    HD2  TYR   8           HD2      TYR   8  -4.518  -9.333  -4.395
   58    HE1  TYR   8           HE1      TYR   8  -6.384 -10.325   0.037
   59    HE2  TYR   8           HE2      TYR   8  -5.974 -11.294  -4.091
   60    HH   TYR   8           HH       TYR   8  -6.631 -12.806  -2.159
   61    H    LEU   9           H        LEU   9  -1.542  -7.140  -4.654
   62    HA   LEU   9           HA       LEU   9   0.023  -4.781  -3.915
   63   1HB   LEU   9          1HB       LEU   9   1.029  -6.520  -5.386
   64   2HB   LEU   9          2HB       LEU   9  -0.248  -6.251  -6.551
   65    HG   LEU   9           HG       LEU   9   1.578  -3.995  -5.766
   66   1HD1  LEU   9          1HD1      LEU   9   2.110  -6.103  -7.855
   67   2HD1  LEU   9          2HD1      LEU   9   3.026  -5.853  -6.369
   68   3HD1  LEU   9          3HD1      LEU   9   3.036  -4.619  -7.628
   69   1HD2  LEU   9          1HD2      LEU   9   1.077  -3.225  -8.030
   70   2HD2  LEU   9          2HD2      LEU   9  -0.405  -3.470  -7.109
   71   3HD2  LEU   9          3HD2      LEU   9   0.092  -4.660  -8.313
   72    H    VAL  10           H        VAL  10  -0.645  -2.777  -4.458
   73    HA   VAL  10           HA       VAL  10  -2.792  -2.491  -6.425
   74    HB   VAL  10           HB       VAL  10  -3.211  -2.104  -3.686
   75   1HG1  VAL  10          1HG1      VAL  10  -3.723   0.269  -3.451
   76   2HG1  VAL  10          2HG1      VAL  10  -3.071   0.578  -5.059
   77   3HG1  VAL  10          3HG1      VAL  10  -2.005   0.024  -3.769
   78   1HG2  VAL  10          1HG2      VAL  10  -4.896  -2.672  -5.322
   79   2HG2  VAL  10          2HG2      VAL  10  -4.766  -1.067  -6.044
   80   3HG2  VAL  10          3HG2      VAL  10  -5.389  -1.250  -4.403
   81    H    VAL  11           H        VAL  11  -2.849  -0.248  -7.316
   82    HA   VAL  11           HA       VAL  11  -0.284   1.147  -6.945
   83    HB   VAL  11           HB       VAL  11  -2.052   1.046  -9.402
   84   1HG1  VAL  11          1HG1      VAL  11   0.458   2.658  -8.956
   85   2HG1  VAL  11          2HG1      VAL  11  -1.173   3.304  -9.133
   86   3HG1  VAL  11          3HG1      VAL  11  -0.398   2.486 -10.489
   87   1HG2  VAL  11          1HG2      VAL  11  -0.083   0.056 -10.468
   88   2HG2  VAL  11          2HG2      VAL  11  -0.637  -0.910  -9.101
   89   3HG2  VAL  11          3HG2      VAL  11   0.781   0.126  -8.930
   90    H    LYS  12           H        LYS  12  -0.348   3.373  -6.615
   91    HA   LYS  12           HA       LYS  12  -2.757   4.463  -5.549
   92   1HB   LYS  12          1HB       LYS  12  -0.616   5.187  -4.674
   93   2HB   LYS  12          2HB       LYS  12  -0.124   5.767  -6.260
   94   1HG   LYS  12          1HG       LYS  12  -2.064   7.370  -6.147
   95   2HG   LYS  12          2HG       LYS  12  -2.240   6.897  -4.456
   96   1HD   LYS  12          1HD       LYS  12  -0.035   7.682  -3.944
   97   2HD   LYS  12          2HD       LYS  12   0.304   7.982  -5.652
   98   1HE   LYS  12          1HE       LYS  12  -1.524   9.651  -5.671
   99   2HE   LYS  12          2HE       LYS  12  -1.735   9.396  -3.938
  100   1HZ   LYS  12          1HZ       LYS  12   0.733  10.385  -5.256
  101   2HZ   LYS  12          2HZ       LYS  12   0.539  10.133  -3.593
  102   3HZ   LYS  12          3HZ       LYS  12  -0.368  11.334  -4.380
  103    H    GLY  13           H        GLY  13  -4.385   4.681  -6.979
  104   1HA   GLY  13          1HA       GLY  13  -3.938   5.780  -9.615
  105   2HA   GLY  13          2HA       GLY  13  -5.484   5.299  -8.930
  106    H    THR  14           H        THR  14  -4.627   7.761 -10.369
  107    HA   THR  14           HA       THR  14  -4.618   9.897  -8.474
  108    HB   THR  14           HB       THR  14  -5.421  10.095 -11.380
  109    HG1  THR  14           HG1      THR  14  -3.157  10.422 -11.768
  110   1HG2  THR  14          1HG2      THR  14  -4.088  12.043  -9.495
  111   2HG2  THR  14          2HG2      THR  14  -5.766  12.107 -10.033
  112   3HG2  THR  14          3HG2      THR  14  -4.458  12.346 -11.192
  113    H    THR  15           H        THR  15  -7.061   8.853 -10.849
  114    HA   THR  15           HA       THR  15  -9.154   9.710  -8.978
  115    HB   THR  15           HB       THR  15 -10.476  10.461 -10.998
  116    HG1  THR  15           HG1      THR  15  -9.588  10.092 -12.871
  117   1HG2  THR  15          1HG2      THR  15  -9.373  12.645 -11.147
  118   2HG2  THR  15          2HG2      THR  15  -7.922  11.968 -10.409
  119   3HG2  THR  15          3HG2      THR  15  -9.418  12.068  -9.481
  120    H    THR  16           H        THR  16  -8.245   7.106  -9.203
  121    HA   THR  16           HA       THR  16 -10.083   5.702 -10.966
  122    HB   THR  16           HB       THR  16  -8.959   3.650  -9.927
  123    HG1  THR  16           HG1      THR  16  -6.865   4.196  -9.002
  124   1HG2  THR  16          1HG2      THR  16  -6.971   3.895 -11.336
  125   2HG2  THR  16          2HG2      THR  16  -7.257   5.632 -11.444
  126   3HG2  THR  16          3HG2      THR  16  -8.409   4.502 -12.157
  127    H    GLU  17           H        GLU  17 -10.432   7.168  -8.144
  128    HA   GLU  17           HA       GLU  17 -12.025   7.162  -6.544
  129   1HB   GLU  17          1HB       GLU  17 -13.622   6.498  -8.236
  130   2HB   GLU  17          2HB       GLU  17 -13.134   4.817  -8.093
  131   1HG   GLU  17          1HG       GLU  17 -13.951   4.835  -5.747
  132   2HG   GLU  17          2HG       GLU  17 -14.557   6.469  -6.019
  133    H    ARG  18           H        ARG  18 -11.550   3.682  -7.165
  134    HA   ARG  18           HA       ARG  18 -11.350   3.272  -4.288
  135   1HB   ARG  18          1HB       ARG  18 -11.704   1.392  -6.617
  136   2HB   ARG  18          2HB       ARG  18 -11.402   0.820  -4.981
  137   1HG   ARG  18          1HG       ARG  18 -13.700   2.620  -5.706
  138   2HG   ARG  18          2HG       ARG  18 -13.807   0.858  -5.682
  139   1HD   ARG  18          1HD       ARG  18 -13.012   2.582  -3.335
  140   2HD   ARG  18          2HD       ARG  18 -14.619   1.901  -3.593
  141    HE   ARG  18           HE       ARG  18 -12.933  -0.256  -3.705
  142   1HH1  ARG  18          1HH1      ARG  18 -13.494   2.267  -1.327
  143   2HH1  ARG  18          2HH1      ARG  18 -13.170   1.234   0.031
  144   1HH2  ARG  18          1HH2      ARG  18 -12.524  -1.606  -1.942
  145   2HH2  ARG  18          2HH2      ARG  18 -12.630  -0.988  -0.320
  146    H    HIS  19           H        HIS  19  -9.696   1.478  -6.851
  147    HA   HIS  19           HA       HIS  19  -7.096   2.137  -5.710
  148   1HB   HIS  19          1HB       HIS  19  -8.057  -0.728  -5.926
  149   2HB   HIS  19          2HB       HIS  19  -6.479  -0.197  -5.365
  150    HD1  HIS  19           HD1      HIS  19  -9.926  -0.883  -4.223
  151    HD2  HIS  19           HD2      HIS  19  -6.517   0.993  -2.740
  152    HE1  HIS  19           HE1      HIS  19 -10.301  -0.649  -1.754
  153    HE2  HIS  19           HE2      HIS  19  -8.160   0.321  -0.852
  154    H    ASP  20           H        ASP  20  -5.321   1.327  -7.096
  155    HA   ASP  20           HA       ASP  20  -6.208   1.027  -9.884
  156   1HB   ASP  20          1HB       ASP  20  -4.535   2.855  -9.008
  157   2HB   ASP  20          2HB       ASP  20  -3.363   1.548  -9.099
  158    H    GLN  21           H        GLN  21  -3.465  -0.036 -10.578
  159    HA   GLN  21           HA       GLN  21  -4.221  -2.575 -11.197
  160   1HB   GLN  21          1HB       GLN  21  -1.378  -1.792 -10.547
  161   2HB   GLN  21          2HB       GLN  21  -1.886  -3.120 -11.583
  162   1HG   GLN  21          1HG       GLN  21  -2.881  -1.517 -13.140
  163   2HG   GLN  21          2HG       GLN  21  -2.351  -0.192 -12.105
  164   1HE2  GLN  21          1HE2      GLN  21  -1.039   0.749 -13.621
  165   2HE2  GLN  21          2HE2      GLN  21   0.436   0.025 -14.169
  166    H    HIS  22           H        HIS  22  -4.240  -4.630 -10.284
  167    HA   HIS  22           HA       HIS  22  -3.478  -4.818  -7.469
  168   1HB   HIS  22          1HB       HIS  22  -5.752  -3.743  -7.677
  169   2HB   HIS  22          2HB       HIS  22  -6.326  -5.261  -8.354
  170    HD1  HIS  22           HD1      HIS  22  -5.734  -7.412  -6.610
  171    HD2  HIS  22           HD2      HIS  22  -6.179  -3.585  -5.052
  172    HE1  HIS  22           HE1      HIS  22  -6.231  -7.726  -4.178
  173    HE2  HIS  22           HE2      HIS  22  -6.735  -5.414  -3.324
  174    H    ALA  23           H        ALA  23  -3.108  -6.840  -6.735
  175    HA   ALA  23           HA       ALA  23  -4.381  -9.226  -7.640
  176   1HB   ALA  23          1HB       ALA  23  -2.499 -10.378  -8.634
  177   2HB   ALA  23          2HB       ALA  23  -1.509  -8.924  -8.497
  178   3HB   ALA  23          3HB       ALA  23  -2.902  -8.944  -9.581
  179    H    GLU  24           H        GLU  24  -3.051 -11.182  -6.742
  180    HA   GLU  24           HA       GLU  24  -2.379 -10.410  -3.987
  181   1HB   GLU  24          1HB       GLU  24  -4.099 -12.253  -4.705
  182   2HB   GLU  24          2HB       GLU  24  -2.666 -13.255  -4.876
  183   1HG   GLU  24          1HG       GLU  24  -2.947 -11.761  -2.342
  184   2HG   GLU  24          2HG       GLU  24  -4.083 -13.075  -2.621
  185    H    ILE  25           H        ILE  25  -0.382 -10.513  -3.191
  186    HA   ILE  25           HA       ILE  25   1.728 -11.440  -4.991
  187    HB   ILE  25           HB       ILE  25   2.160  -9.966  -2.399
  188   1HG1  ILE  25          1HG1      ILE  25   1.784  -8.729  -5.140
  189   2HG1  ILE  25          2HG1      ILE  25   0.617  -8.642  -3.822
  190   1HG2  ILE  25          1HG2      ILE  25   4.241  -9.278  -3.523
  191   2HG2  ILE  25          2HG2      ILE  25   3.789 -10.254  -4.921
  192   3HG2  ILE  25          3HG2      ILE  25   4.107 -11.030  -3.369
  193   1HD1  ILE  25          1HD1      ILE  25   2.214  -7.405  -2.472
  194   2HD1  ILE  25          2HD1      ILE  25   1.924  -6.595  -4.012
  195   3HD1  ILE  25          3HD1      ILE  25   3.407  -7.516  -3.766
  196    H    ILE  26           H        ILE  26   2.106 -13.533  -4.739
  197    HA   ILE  26           HA       ILE  26   2.360 -14.629  -2.040
  198    HB   ILE  26           HB       ILE  26   2.347 -16.850  -3.013
  199   1HG1  ILE  26          1HG1      ILE  26   3.450 -16.173  -5.208
  200   2HG1  ILE  26          2HG1      ILE  26   2.116 -17.308  -5.353
  201   1HG2  ILE  26          1HG2      ILE  26   0.109 -15.101  -4.073
  202   2HG2  ILE  26          2HG2      ILE  26   0.196 -15.845  -2.477
  203   3HG2  ILE  26          3HG2      ILE  26   0.038 -16.856  -3.912
  204   1HD1  ILE  26          1HD1      ILE  26   2.050 -15.646  -7.109
  205   2HD1  ILE  26          2HD1      ILE  26   1.995 -14.354  -5.910
  206   3HD1  ILE  26          3HD1      ILE  26   0.649 -15.485  -6.050
  207    H    GLU  27           H        GLU  27   4.194 -13.819  -4.884
  208    HA   GLU  27           HA       GLU  27   6.598 -14.860  -3.543
  209   1HB   GLU  27          1HB       GLU  27   6.107 -14.587  -6.512
  210   2HB   GLU  27          2HB       GLU  27   7.628 -15.080  -5.781
  211   1HG   GLU  27          1HG       GLU  27   5.010 -16.560  -5.689
  212   2HG   GLU  27          2HG       GLU  27   6.466 -17.020  -6.572
  213    H    VAL  28           H        VAL  28   7.377 -13.126  -2.531
  214    HA   VAL  28           HA       VAL  28   7.563 -10.601  -3.991
  215    HB   VAL  28           HB       VAL  28   8.137 -11.143  -1.074
  216   1HG1  VAL  28          1HG1      VAL  28   8.133  -8.691  -0.848
  217   2HG1  VAL  28          2HG1      VAL  28   7.958  -8.538  -2.597
  218   3HG1  VAL  28          3HG1      VAL  28   9.421  -9.251  -1.917
  219   1HG2  VAL  28          1HG2      VAL  28   5.757  -9.861  -2.406
  220   2HG2  VAL  28          2HG2      VAL  28   6.033  -9.951  -0.666
  221   3HG2  VAL  28          3HG2      VAL  28   5.784 -11.427  -1.597
  222    H    ARG  29           H        ARG  29   9.342 -10.724  -5.299
  223    HA   ARG  29           HA       ARG  29  11.860 -11.746  -4.242
  224   1HB   ARG  29          1HB       ARG  29  12.744 -11.255  -6.507
  225   2HB   ARG  29          2HB       ARG  29  11.338 -12.308  -6.545
  226   1HG   ARG  29          1HG       ARG  29   9.935 -10.558  -7.305
  227   2HG   ARG  29          2HG       ARG  29  11.171  -9.341  -6.984
  228   1HD   ARG  29          1HD       ARG  29  11.436 -11.563  -9.005
  229   2HD   ARG  29          2HD       ARG  29  10.934  -9.917  -9.390
  230    HE   ARG  29           HE       ARG  29  13.399  -9.884  -7.991
  231   1HH1  ARG  29          1HH1      ARG  29  12.061 -10.691 -11.140
  232   2HH1  ARG  29          2HH1      ARG  29  13.527 -10.294 -11.996
  233   1HH2  ARG  29          1HH2      ARG  29  15.315  -9.400  -9.100
  234   2HH2  ARG  29          2HH2      ARG  29  15.386  -9.579 -10.827
  235    H    SER  30           H        SER  30  10.189  -9.010  -3.963
  236    HA   SER  30           HA       SER  30  12.208  -7.035  -4.454
  237   1HB   SER  30          1HB       SER  30   9.709  -6.621  -2.836
  238   2HB   SER  30          2HB       SER  30  10.533  -5.489  -3.910
  239    HG   SER  30           HG       SER  30   9.655  -6.443  -5.642
  240    H    ALA  31           H        ALA  31  13.802  -6.526  -3.076
  241    HA   ALA  31           HA       ALA  31  14.042  -7.549  -0.463
  242   1HB   ALA  31          1HB       ALA  31  15.891  -5.973  -0.200
  243   2HB   ALA  31          2HB       ALA  31  15.375  -5.117  -1.654
  244   3HB   ALA  31          3HB       ALA  31  15.964  -6.775  -1.770
  245    H    ASP  32           H        ASP  32  12.926  -4.431  -1.681
  246    HA   ASP  32           HA       ASP  32  11.680  -3.938   0.943
  247   1HB   ASP  32          1HB       ASP  32  12.422  -1.930  -1.202
  248   2HB   ASP  32          2HB       ASP  32  11.574  -1.546   0.290
  249    H    GLY  33           H        GLY  33  11.165  -2.919  -2.412
  250   1HA   GLY  33          1HA       GLY  33   8.686  -4.238  -2.739
  251   2HA   GLY  33          2HA       GLY  33   8.419  -2.566  -2.259
  252    H    SER  34           H        SER  34  10.694  -4.223  -4.422
  253    HA   SER  34           HA       SER  34  10.175  -2.166  -6.445
  254   1HB   SER  34          1HB       SER  34  12.375  -3.143  -7.394
  255   2HB   SER  34          2HB       SER  34  12.469  -2.163  -5.930
  256    HG   SER  34           HG       SER  34  13.258  -4.677  -6.278
  257    HA   PRO  35           HA       PRO  35   8.332  -5.265  -9.088
  258   1HB   PRO  35          1HB       PRO  35   9.130  -3.590 -11.359
  259   2HB   PRO  35          2HB       PRO  35   7.510  -3.982 -10.777
  260   1HG   PRO  35          1HG       PRO  35   8.567  -1.509 -10.531
  261   2HG   PRO  35          2HG       PRO  35   7.445  -2.188  -9.337
  262   1HD   PRO  35          1HD       PRO  35  10.431  -1.959  -9.217
  263   2HD   PRO  35          2HD       PRO  35   9.226  -1.668  -7.944
  264    HA   PRO  36           HA       PRO  36   7.844  -6.275 -10.904
  265   1HB   PRO  36          1HB       PRO  36   7.913  -8.711 -11.989
  266   2HB   PRO  36          2HB       PRO  36   8.405  -7.285 -12.910
  267   1HG   PRO  36          1HG       PRO  36  10.085  -9.376 -11.608
  268   2HG   PRO  36          2HG       PRO  36  10.346  -8.512 -13.132
  269   1HD   PRO  36          1HD       PRO  36  11.537  -7.907 -10.671
  270   2HD   PRO  36          2HD       PRO  36  11.481  -6.844 -12.090
  271    H    TYR  37           H        TYR  37   6.324  -8.057 -10.286
  272    HA   TYR  37           HA       TYR  37   7.206  -9.499  -7.859
  273   1HB   TYR  37          1HB       TYR  37   4.433  -8.403  -8.358
  274   2HB   TYR  37          2HB       TYR  37   5.043  -9.118  -6.873
  275    HD1  TYR  37           HD1      TYR  37   5.346  -6.170  -9.101
  276    HD2  TYR  37           HD2      TYR  37   6.067  -7.769  -5.223
  277    HE1  TYR  37           HE1      TYR  37   5.891  -3.921  -8.281
  278    HE2  TYR  37           HE2      TYR  37   6.620  -5.517  -4.395
  279    HH   TYR  37           HH       TYR  37   7.385  -3.340  -5.312
  280    H    VAL  38           H        VAL  38   6.331 -11.634  -7.641
  281    HA   VAL  38           HA       VAL  38   4.982 -12.586 -10.069
  282    HB   VAL  38           HB       VAL  38   6.198 -14.211  -7.819
  283   1HG1  VAL  38          1HG1      VAL  38   4.877 -15.113 -10.387
  284   2HG1  VAL  38          2HG1      VAL  38   4.218 -15.310  -8.764
  285   3HG1  VAL  38          3HG1      VAL  38   5.690 -16.162  -9.226
  286   1HG2  VAL  38          1HG2      VAL  38   7.858 -13.166  -9.279
  287   2HG2  VAL  38          2HG2      VAL  38   7.039 -13.827 -10.694
  288   3HG2  VAL  38          3HG2      VAL  38   7.808 -14.911  -9.534
  289    H    VAL  39           H        VAL  39   2.924 -12.577 -10.037
  290    HA   VAL  39           HA       VAL  39   1.538 -12.406  -7.452
  291    HB   VAL  39           HB       VAL  39   2.186 -10.301  -9.113
  292   1HG1  VAL  39          1HG1      VAL  39  -0.688 -10.997  -9.656
  293   2HG1  VAL  39          2HG1      VAL  39   0.634 -10.977 -10.824
  294   3HG1  VAL  39          3HG1      VAL  39   0.099  -9.474 -10.074
  295   1HG2  VAL  39          1HG2      VAL  39   1.613 -10.099  -6.787
  296   2HG2  VAL  39          2HG2      VAL  39  -0.078 -10.451  -7.142
  297   3HG2  VAL  39          3HG2      VAL  39   0.663  -8.970  -7.750
  298    H    ARG  40           H        ARG  40  -0.856 -12.692  -7.722
  299    HA   ARG  40           HA       ARG  40  -1.629 -13.943 -10.236
  300   1HB   ARG  40          1HB       ARG  40  -2.822 -15.764  -8.961
  301   2HB   ARG  40          2HB       ARG  40  -1.071 -15.882  -9.009
  302   1HG   ARG  40          1HG       ARG  40  -0.934 -14.997  -6.746
  303   2HG   ARG  40          2HG       ARG  40  -2.691 -14.827  -6.698
  304   1HD   ARG  40          1HD       ARG  40  -2.011 -16.855  -5.554
  305   2HD   ARG  40          2HD       ARG  40  -2.920 -17.252  -7.011
  306    HE   ARG  40           HE       ARG  40   0.025 -17.366  -6.884
  307   1HH1  ARG  40          1HH1      ARG  40  -3.061 -18.728  -7.821
  308   2HH1  ARG  40          2HH1      ARG  40  -2.359 -20.113  -8.609
  309   1HH2  ARG  40          1HH2      ARG  40   0.959 -19.181  -7.910
  310   2HH2  ARG  40          2HH2      ARG  40  -0.071 -20.377  -8.650
  311    H    TRP  41           H        TRP  41  -3.583 -13.377 -10.904
  312    HA   TRP  41           HA       TRP  41  -5.186 -11.619  -9.254
  313   1HB   TRP  41          1HB       TRP  41  -6.326 -12.634 -11.791
  314   2HB   TRP  41          2HB       TRP  41  -6.264 -10.994 -11.167
  315    HD1  TRP  41           HD1      TRP  41  -4.432 -13.409 -13.433
  316    HE1  TRP  41           HE1      TRP  41  -2.623 -12.140 -14.748
  317    HE3  TRP  41           HE3      TRP  41  -4.598  -8.956 -10.936
  318    HZ2  TRP  41           HZ2      TRP  41  -1.429  -9.590 -14.726
  319    HZ3  TRP  41           HZ3      TRP  41  -3.089  -7.151 -11.652
  320    HH2  TRP  41           HH2      TRP  41  -1.537  -7.463 -13.506
  321    H    LEU  42           H        LEU  42  -6.424 -12.553  -7.733
  322    HA   LEU  42           HA       LEU  42  -7.020 -15.369  -7.883
  323   1HB   LEU  42          1HB       LEU  42  -8.029 -13.423  -5.828
  324   2HB   LEU  42          2HB       LEU  42  -7.825 -15.155  -5.658
  325    HG   LEU  42           HG       LEU  42  -5.655 -13.071  -5.805
  326   1HD1  LEU  42          1HD1      LEU  42  -5.114 -13.893  -3.578
  327   2HD1  LEU  42          2HD1      LEU  42  -6.484 -15.001  -3.653
  328   3HD1  LEU  42          3HD1      LEU  42  -6.756 -13.259  -3.658
  329   1HD2  LEU  42          1HD2      LEU  42  -5.385 -16.071  -5.699
  330   2HD2  LEU  42          2HD2      LEU  42  -4.070 -14.903  -5.559
  331   3HD2  LEU  42          3HD2      LEU  42  -4.973 -15.036  -7.068
  332    H    VAL  43           H        VAL  43  -8.940 -12.380  -7.728
  333    HA   VAL  43           HA       VAL  43 -11.390 -13.837  -8.011
  334    HB   VAL  43           HB       VAL  43 -12.306 -11.449  -8.228
  335   1HG1  VAL  43          1HG1      VAL  43 -10.903 -12.356  -5.730
  336   2HG1  VAL  43          2HG1      VAL  43 -12.525 -12.828  -6.236
  337   3HG1  VAL  43          3HG1      VAL  43 -12.191 -11.154  -5.791
  338   1HG2  VAL  43          1HG2      VAL  43 -10.211 -10.325  -8.756
  339   2HG2  VAL  43          2HG2      VAL  43  -9.550 -10.836  -7.204
  340   3HG2  VAL  43          3HG2      VAL  43 -10.903  -9.706  -7.256
  341    H    ASN  44           H        ASN  44  -9.051 -12.831 -10.119
  342    HA   ASN  44           HA       ASN  44 -10.933 -12.643 -12.342
  343   1HB   ASN  44          1HB       ASN  44  -7.990 -12.029 -12.152
  344   2HB   ASN  44          2HB       ASN  44  -8.818 -12.151 -13.699
  345   1HD2  ASN  44          1HD2      ASN  44  -8.379 -10.284 -10.827
  346   2HD2  ASN  44          2HD2      ASN  44  -9.229  -8.881 -11.364
  347    H    GLY  45           H        GLY  45  -7.972 -14.434 -11.440
  348   1HA   GLY  45          1HA       GLY  45  -8.013 -16.851 -11.543
  349   2HA   GLY  45          2HA       GLY  45  -9.070 -16.725 -12.940
  350    H    HIS  46           H        HIS  46  -5.797 -15.794 -11.874
  351    HA   HIS  46           HA       HIS  46  -4.491 -17.204 -13.940
  352   1HB   HIS  46          1HB       HIS  46  -5.245 -14.442 -14.565
  353   2HB   HIS  46          2HB       HIS  46  -3.522 -14.741 -14.722
  354    HD1  HIS  46           HD1      HIS  46  -6.288 -14.572 -16.780
  355    HD2  HIS  46           HD2      HIS  46  -3.319 -17.447 -16.295
  356    HE1  HIS  46           HE1      HIS  46  -6.242 -15.872 -18.933
  357    HE2  HIS  46           HE2      HIS  46  -4.316 -17.478 -18.684
  358    H    GLU  47           H        GLU  47  -2.143 -16.876 -13.875
  359    HA   GLU  47           HA       GLU  47  -1.169 -15.347 -11.560
  360   1HB   GLU  47          1HB       GLU  47  -1.298 -17.662 -10.834
  361   2HB   GLU  47          2HB       GLU  47  -0.458 -18.203 -12.278
  362   1HG   GLU  47          1HG       GLU  47   1.036 -16.256 -10.684
  363   2HG   GLU  47          2HG       GLU  47   0.694 -17.770  -9.849
  364    H    THR  48           H        THR  48   0.828 -14.320 -11.905
  365    HA   THR  48           HA       THR  48   2.541 -14.905 -14.065
  366    HB   THR  48           HB       THR  48   0.788 -14.152 -15.487
  367    HG1  THR  48           HG1      THR  48   2.085 -11.857 -15.878
  368   1HG2  THR  48          1HG2      THR  48  -0.509 -12.820 -13.901
  369   2HG2  THR  48          2HG2      THR  48  -0.183 -11.897 -15.368
  370   3HG2  THR  48          3HG2      THR  48   0.750 -11.585 -13.904
  371    H    THR  49           H        THR  49   3.998 -13.031 -14.576
  372    HA   THR  49           HA       THR  49   4.751 -11.724 -12.057
  373    HB   THR  49           HB       THR  49   6.399 -12.017 -14.584
  374    HG1  THR  49           HG1      THR  49   5.645 -13.940 -12.975
  375   1HG2  THR  49          1HG2      THR  49   7.139 -10.234 -13.065
  376   2HG2  THR  49          2HG2      THR  49   8.293 -11.569 -13.095
  377   3HG2  THR  49          3HG2      THR  49   7.186 -11.390 -11.734
  378    H    VAL  50           H        VAL  50   4.100  -9.664 -11.860
  379    HA   VAL  50           HA       VAL  50   3.337  -8.261 -14.334
  380    HB   VAL  50           HB       VAL  50   1.728  -7.010 -13.003
  381   1HG1  VAL  50          1HG1      VAL  50   1.037  -9.090 -14.054
  382   2HG1  VAL  50          2HG1      VAL  50   0.188  -8.851 -12.526
  383   3HG1  VAL  50          3HG1      VAL  50   1.529  -9.992 -12.621
  384   1HG2  VAL  50          1HG2      VAL  50   1.266  -7.640 -10.672
  385   2HG2  VAL  50          2HG2      VAL  50   2.891  -6.980 -10.865
  386   3HG2  VAL  50          3HG2      VAL  50   2.661  -8.721 -10.696
  387    H    TYR  51           H        TYR  51   3.577  -6.029 -14.484
  388    HA   TYR  51           HA       TYR  51   5.505  -4.788 -12.641
  389   1HB   TYR  51          1HB       TYR  51   5.107  -4.265 -15.601
  390   2HB   TYR  51          2HB       TYR  51   6.176  -3.341 -14.553
  391    HD1  TYR  51           HD1      TYR  51   5.623  -6.681 -16.058
  392    HD2  TYR  51           HD2      TYR  51   8.365  -4.110 -14.061
  393    HE1  TYR  51           HE1      TYR  51   7.448  -8.253 -16.553
  394    HE2  TYR  51           HE2      TYR  51  10.196  -5.676 -14.551
  395    HH   TYR  51           HH       TYR  51   9.843  -8.308 -16.744
  396    HA   PRO  52           HA       PRO  52   1.700  -2.372 -12.060
  397   1HB   PRO  52          1HB       PRO  52   2.401  -1.306  -9.684
  398   2HB   PRO  52          2HB       PRO  52   1.835  -2.975  -9.833
  399   1HG   PRO  52          1HG       PRO  52   4.636  -1.937  -9.606
  400   2HG   PRO  52          2HG       PRO  52   3.887  -3.325  -8.794
  401   1HD   PRO  52          1HD       PRO  52   5.479  -3.564 -10.990
  402   2HD   PRO  52          2HD       PRO  52   4.166  -4.697 -10.617
  403    H    GLY  53           H        GLY  53   4.874  -1.471 -12.662
  404   1HA   GLY  53          1HA       GLY  53   5.645   0.454 -13.699
  405   2HA   GLY  53          2HA       GLY  53   4.078   1.199 -13.412
  406    H    SER  54           H        SER  54   3.610   1.887 -11.202
  407    HA   SER  54           HA       SER  54   5.791   2.332  -9.398
  408   1HB   SER  54          1HB       SER  54   5.498   4.893  -9.606
  409   2HB   SER  54          2HB       SER  54   6.458   4.077 -10.840
  410    HG   SER  54           HG       SER  54   3.699   4.752 -11.078
  411    H    ASP  55           H        ASP  55   5.084   3.708  -7.531
  412    HA   ASP  55           HA       ASP  55   3.642   4.327  -5.890
  413   1HB   ASP  55          1HB       ASP  55   1.580   4.332  -8.102
  414   2HB   ASP  55          2HB       ASP  55   1.311   4.951  -6.477
  415    H    ALA  56           H        ALA  56   4.176   1.573  -6.209
  416    HA   ALA  56           HA       ALA  56   1.714   0.112  -6.006
  417   1HB   ALA  56          1HB       ALA  56   4.531  -0.800  -5.430
  418   2HB   ALA  56          2HB       ALA  56   3.710  -0.903  -6.989
  419   3HB   ALA  56          3HB       ALA  56   3.114  -1.836  -5.615
  420    H    VAL  57           H        VAL  57   0.618  -0.456  -4.265
  421    HA   VAL  57           HA       VAL  57   1.733   0.096  -1.588
  422    HB   VAL  57           HB       VAL  57  -1.183   0.447  -2.311
  423   1HG1  VAL  57          1HG1      VAL  57  -0.738   0.102   0.045
  424   2HG1  VAL  57          2HG1      VAL  57  -1.264   1.761  -0.242
  425   3HG1  VAL  57          3HG1      VAL  57   0.442   1.412   0.037
  426   1HG2  VAL  57          1HG2      VAL  57   0.935   2.594  -2.225
  427   2HG2  VAL  57          2HG2      VAL  57  -0.801   2.872  -2.362
  428   3HG2  VAL  57          3HG2      VAL  57   0.062   2.038  -3.654
  429    H    VAL  58           H        VAL  58   0.693  -1.222   0.125
  430    HA   VAL  58           HA       VAL  58   0.079  -3.903  -0.889
  431    HB   VAL  58           HB       VAL  58   0.847  -3.049   1.911
  432   1HG1  VAL  58          1HG1      VAL  58   1.223  -5.436   2.303
  433   2HG1  VAL  58          2HG1      VAL  58   0.631  -5.792   0.679
  434   3HG1  VAL  58          3HG1      VAL  58  -0.457  -5.101   1.883
  435   1HG2  VAL  58          1HG2      VAL  58   2.516  -4.321  -0.258
  436   2HG2  VAL  58          2HG2      VAL  58   3.036  -4.041   1.404
  437   3HG2  VAL  58          3HG2      VAL  58   2.674  -2.673   0.349
  438    H    VAL  59           H        VAL  59  -1.970  -4.518  -0.943
  439    HA   VAL  59           HA       VAL  59  -3.909  -3.269   0.879
  440    HB   VAL  59           HB       VAL  59  -5.482  -4.328  -1.007
  441   1HG1  VAL  59          1HG1      VAL  59  -5.562  -2.109  -2.050
  442   2HG1  VAL  59          2HG1      VAL  59  -4.068  -1.679  -1.218
  443   3HG1  VAL  59          3HG1      VAL  59  -5.531  -2.012  -0.289
  444   1HG2  VAL  59          1HG2      VAL  59  -4.519  -3.968  -3.220
  445   2HG2  VAL  59          2HG2      VAL  59  -3.644  -5.216  -2.329
  446   3HG2  VAL  59          3HG2      VAL  59  -2.963  -3.595  -2.477
  447    H    THR  60           H        THR  60  -5.924  -4.743   1.119
  448    HA   THR  60           HA       THR  60  -4.969  -7.457   1.822
  449    HB   THR  60           HB       THR  60  -5.276  -5.875   3.766
  450    HG1  THR  60           HG1      THR  60  -6.317  -7.435   5.033
  451   1HG2  THR  60          1HG2      THR  60  -7.549  -5.358   4.522
  452   2HG2  THR  60          2HG2      THR  60  -8.199  -6.070   3.043
  453   3HG2  THR  60          3HG2      THR  60  -7.203  -4.616   2.960
  454    H    ALA  61           H        ALA  61  -7.455  -8.376   2.778
  455    HA   ALA  61           HA       ALA  61  -8.410  -9.570   0.450
  456   1HB   ALA  61          1HB       ALA  61  -9.787  -9.423   3.124
  457   2HB   ALA  61          2HB       ALA  61  -8.527 -10.573   2.678
  458   3HB   ALA  61          3HB       ALA  61 -10.085 -10.610   1.852
  459    H    THR  62           H        THR  62  -9.925  -6.900   2.320
  460    HA   THR  62           HA       THR  62 -12.246  -6.970   0.602
  461    HB   THR  62           HB       THR  62 -12.599  -4.671   1.855
  462    HG1  THR  62           HG1      THR  62 -11.618  -4.870   3.985
  463   1HG2  THR  62          1HG2      THR  62 -13.735  -5.915   3.653
  464   2HG2  THR  62          2HG2      THR  62 -12.901  -7.382   3.144
  465   3HG2  THR  62          3HG2      THR  62 -14.055  -6.606   2.061
  466    H    GLU  63           H        GLU  63  -9.376  -5.043   1.000
  467    HA   GLU  63           HA       GLU  63  -9.872  -3.074  -0.949
  468   1HB   GLU  63          1HB       GLU  63  -7.235  -4.326  -0.159
  469   2HB   GLU  63          2HB       GLU  63  -7.452  -2.774  -0.952
  470   1HG   GLU  63          1HG       GLU  63  -8.542  -3.407   1.776
  471   2HG   GLU  63          2HG       GLU  63  -6.960  -2.681   1.497
  472    H    HIS  64           H        HIS  64  -9.478  -6.374  -1.168
  473    HA   HIS  64           HA       HIS  64  -8.007  -6.501  -3.622
  474   1HB   HIS  64          1HB       HIS  64  -7.407  -8.265  -2.368
  475   2HB   HIS  64          2HB       HIS  64  -8.952  -8.348  -1.546
  476    HD1  HIS  64           HD1      HIS  64  -9.921 -10.598  -1.913
  477    HD2  HIS  64           HD2      HIS  64  -7.952  -9.191  -5.293
  478    HE1  HIS  64           HE1      HIS  64 -10.126 -12.420  -3.630
  479    HE2  HIS  64           HE2      HIS  64  -8.738 -11.624  -5.579
  480    H    ALA  65           H        ALA  65 -11.419  -7.171  -2.741
  481    HA   ALA  65           HA       ALA  65 -11.982  -8.764  -4.945
  482   1HB   ALA  65          1HB       ALA  65 -14.319  -8.408  -4.409
  483   2HB   ALA  65          2HB       ALA  65 -13.903  -7.003  -3.428
  484   3HB   ALA  65          3HB       ALA  65 -13.379  -8.612  -2.930
  485    H    GLU  66           H        GLU  66 -13.184  -5.482  -4.506
  486    HA   GLU  66           HA       GLU  66 -14.171  -5.221  -7.121
  487   1HB   GLU  66          1HB       GLU  66 -13.941  -2.646  -6.316
  488   2HB   GLU  66          2HB       GLU  66 -15.240  -3.715  -5.815
  489   1HG   GLU  66          1HG       GLU  66 -14.444  -2.605  -3.862
  490   2HG   GLU  66          2HG       GLU  66 -13.886  -4.272  -3.770
  491    H    ALA  67           H        ALA  67 -11.246  -3.980  -5.610
  492    HA   ALA  67           HA       ALA  67 -10.363  -2.452  -7.795
  493   1HB   ALA  67          1HB       ALA  67  -8.255  -2.315  -6.595
  494   2HB   ALA  67          2HB       ALA  67  -8.763  -3.627  -5.531
  495   3HB   ALA  67          3HB       ALA  67  -9.618  -2.086  -5.501
  496    H    GLU  68           H        GLU  68  -9.771  -5.819  -6.877
  497    HA   GLU  68           HA       GLU  68  -7.558  -6.110  -8.641
  498   1HB   GLU  68          1HB       GLU  68  -7.969  -7.580  -6.673
  499   2HB   GLU  68          2HB       GLU  68  -9.302  -8.312  -7.554
  500   1HG   GLU  68          1HG       GLU  68  -7.864  -9.273  -9.143
  501   2HG   GLU  68          2HG       GLU  68  -6.507  -8.263  -8.641
  502    H    LYS  69           H        LYS  69 -11.026  -6.894  -8.932
  503    HA   LYS  69           HA       LYS  69 -10.814  -8.112 -11.453
  504   1HB   LYS  69          1HB       LYS  69 -13.065  -6.519 -10.236
  505   2HB   LYS  69          2HB       LYS  69 -13.194  -7.307 -11.804
  506   1HG   LYS  69          1HG       LYS  69 -12.467  -9.437 -10.532
  507   2HG   LYS  69          2HG       LYS  69 -12.945  -8.536  -9.092
  508   1HD   LYS  69          1HD       LYS  69 -14.770  -9.941  -9.939
  509   2HD   LYS  69          2HD       LYS  69 -15.181  -8.225 -10.008
  510   1HE   LYS  69          1HE       LYS  69 -14.682  -8.160 -12.370
  511   2HE   LYS  69          2HE       LYS  69 -14.119  -9.830 -12.332
  512   1HZ   LYS  69          1HZ       LYS  69 -16.898  -8.995 -11.696
  513   2HZ   LYS  69          2HZ       LYS  69 -16.321 -10.581 -11.863
  514   3HZ   LYS  69          3HZ       LYS  69 -16.392  -9.559 -13.217
  515    H    ARG  70           H        ARG  70 -11.568  -4.703 -10.710
  516    HA   ARG  70           HA       ARG  70 -11.640  -3.887 -13.422
  517   1HB   ARG  70          1HB       ARG  70 -11.016  -2.180 -11.004
  518   2HB   ARG  70          2HB       ARG  70 -11.618  -1.616 -12.557
  519   1HG   ARG  70          1HG       ARG  70 -13.708  -2.759 -12.213
  520   2HG   ARG  70          2HG       ARG  70 -13.109  -3.469 -10.714
  521   1HD   ARG  70          1HD       ARG  70 -12.851  -1.169  -9.802
  522   2HD   ARG  70          2HD       ARG  70 -13.608  -0.546 -11.269
  523    HE   ARG  70           HE       ARG  70 -15.290  -2.491 -10.190
  524   1HH1  ARG  70          1HH1      ARG  70 -14.117   0.720  -9.411
  525   2HH1  ARG  70          2HH1      ARG  70 -15.513   1.124  -8.453
  526   1HH2  ARG  70          1HH2      ARG  70 -17.108  -1.966  -8.934
  527   2HH2  ARG  70          2HH2      ARG  70 -17.226  -0.391  -8.201
  528    H    ALA  71           H        ALA  71  -9.083  -3.814 -11.006
  529    HA   ALA  71           HA       ALA  71  -7.324  -2.313 -12.705
  530   1HB   ALA  71          1HB       ALA  71  -7.395  -1.926 -10.308
  531   2HB   ALA  71          2HB       ALA  71  -5.779  -2.379 -10.859
  532   3HB   ALA  71          3HB       ALA  71  -6.794  -3.561 -10.032
  533    H    ALA  72           H        ALA  72  -7.836  -5.715 -12.138
  534    HA   ALA  72           HA       ALA  72  -5.262  -6.459 -13.173
  535   1HB   ALA  72          1HB       ALA  72  -6.181  -8.692 -13.477
  536   2HB   ALA  72          2HB       ALA  72  -7.803  -8.087 -13.141
  537   3HB   ALA  72          3HB       ALA  72  -6.575  -8.071 -11.875
  538    H    ALA  73           H        ALA  73  -8.502  -5.966 -14.479
  539    HA   ALA  73           HA       ALA  73  -7.903  -6.526 -17.179
  540   1HB   ALA  73          1HB       ALA  73 -10.190  -6.313 -16.340
  541   2HB   ALA  73          2HB       ALA  73  -9.910  -5.225 -17.700
  542   3HB   ALA  73          3HB       ALA  73  -9.931  -4.592 -16.055
  543    H    ARG  74           H        ARG  74  -7.278  -3.753 -15.174
  544    HA   ARG  74           HA       ARG  74  -6.430  -2.064 -17.352
  545   1HB   ARG  74          1HB       ARG  74  -7.344  -1.014 -15.413
  546   2HB   ARG  74          2HB       ARG  74  -6.214  -1.842 -14.354
  547   1HG   ARG  74          1HG       ARG  74  -4.389  -0.525 -15.153
  548   2HG   ARG  74          2HG       ARG  74  -5.394   0.188 -16.420
  549   1HD   ARG  74          1HD       ARG  74  -6.678   1.400 -14.862
  550   2HD   ARG  74          2HD       ARG  74  -6.070   0.457 -13.504
  551    HE   ARG  74           HE       ARG  74  -4.047   1.657 -13.599
  552   1HH1  ARG  74          1HH1      ARG  74  -6.449   2.849 -15.867
  553   2HH1  ARG  74          2HH1      ARG  74  -5.628   4.366 -16.115
  554   1HH2  ARG  74          1HH2      ARG  74  -2.986   3.642 -13.929
  555   2HH2  ARG  74          2HH2      ARG  74  -3.680   4.818 -15.004
  556    H    ALA  75           H        ALA  75  -4.700  -3.682 -14.681
  557    HA   ALA  75           HA       ALA  75  -2.111  -2.863 -15.277
  558   1HB   ALA  75          1HB       ALA  75  -1.374  -4.702 -13.871
  559   2HB   ALA  75          2HB       ALA  75  -2.970  -5.447 -13.982
  560   3HB   ALA  75          3HB       ALA  75  -2.775  -3.895 -13.165
  561    H    GLY  76           H        GLY  76  -3.516  -6.078 -16.025
  562   1HA   GLY  76          1HA       GLY  76  -1.186  -6.661 -17.674
  563   2HA   GLY  76          2HA       GLY  76  -2.465  -7.788 -17.248
  564    H    HIS  77           H        HIS  77  -3.130  -4.631 -18.522
  565    HA   HIS  77           HA       HIS  77  -3.967  -5.831 -21.081
  566   1HB   HIS  77          1HB       HIS  77  -5.720  -4.733 -19.604
  567   2HB   HIS  77          2HB       HIS  77  -4.900  -3.208 -19.906
  568    HD1  HIS  77           HD1      HIS  77  -5.290  -2.080 -22.168
  569    HD2  HIS  77           HD2      HIS  77  -7.127  -5.795 -21.802
  570    HE1  HIS  77           HE1      HIS  77  -6.868  -2.256 -24.117
  571    HE2  HIS  77           HE2      HIS  77  -8.130  -4.398 -23.732
  572    H    ALA  78           H        ALA  78  -2.109  -3.368 -19.491
  573    HA   ALA  78           HA       ALA  78  -1.257  -2.219 -22.048
  574   1HB   ALA  78          1HB       ALA  78  -0.733  -1.270 -19.233
  575   2HB   ALA  78          2HB       ALA  78  -1.984  -0.650 -20.310
  576   3HB   ALA  78          3HB       ALA  78  -0.283  -0.424 -20.715
  577    H    ALA  79           H        ALA  79  -0.312  -4.481 -19.736
  578    HA   ALA  79           HA       ALA  79   2.443  -4.442 -20.765
  579   1HB   ALA  79          1HB       ALA  79   2.425  -3.602 -18.465
  580   2HB   ALA  79          2HB       ALA  79   3.258  -5.152 -18.574
  581   3HB   ALA  79          3HB       ALA  79   1.619  -5.075 -17.931
  582    H    THR  80           H        THR  80   2.380  -6.102 -22.153
  583    HA   THR  80           HA       THR  80   2.206  -8.747 -21.103
  584    HB   THR  80           HB       THR  80  -0.130  -8.628 -21.380
  585    HG1  THR  80           HG1      THR  80   0.860  -9.747 -23.809
  586   1HG2  THR  80          1HG2      THR  80   0.295  -7.411 -24.114
  587   2HG2  THR  80          2HG2      THR  80  -0.253  -6.551 -22.674
  588   3HG2  THR  80          3HG2      THR  80  -1.261  -7.810 -23.386
  Start of MODEL   18
    1    H    MET   1           H        MET   1   9.384   2.286  -0.153
    2    HA   MET   1           HA       MET   1   6.588   1.318  -0.128
    3   1HB   MET   1          1HB       MET   1   7.442   2.073  -2.371
    4   2HB   MET   1          2HB       MET   1   8.733   0.891  -2.225
    5   1HG   MET   1          1HG       MET   1   5.827   0.136  -2.135
    6   2HG   MET   1          2HG       MET   1   6.742   0.239  -3.637
    7   1HE   MET   1          1HE       MET   1   5.145  -2.356  -2.388
    8   2HE   MET   1          2HE       MET   1   6.258  -3.635  -2.873
    9   3HE   MET   1          3HE       MET   1   5.871  -2.331  -3.994
   10    H    HIS   2           H        HIS   2   6.333  -0.623   0.759
   11    HA   HIS   2           HA       HIS   2   8.602  -2.478   0.825
   12   1HB   HIS   2          1HB       HIS   2   8.425  -1.348   3.059
   13   2HB   HIS   2          2HB       HIS   2   6.792  -1.989   3.205
   14    HD1  HIS   2           HD1      HIS   2  10.382  -3.170   2.985
   15    HD2  HIS   2           HD2      HIS   2   6.646  -4.544   4.193
   16    HE1  HIS   2           HE1      HIS   2  10.802  -5.371   4.135
   17    HE2  HIS   2           HE2      HIS   2   8.560  -6.048   5.064
   18    H    ALA   3           H        ALA   3   8.005  -4.567   0.351
   19    HA   ALA   3           HA       ALA   3   5.168  -4.951  -0.279
   20   1HB   ALA   3          1HB       ALA   3   6.742  -5.323  -2.107
   21   2HB   ALA   3          2HB       ALA   3   5.890  -6.807  -1.682
   22   3HB   ALA   3          3HB       ALA   3   7.557  -6.567  -1.157
   23    H    LYS   4           H        LYS   4   4.098  -6.902   0.293
   24    HA   LYS   4           HA       LYS   4   5.288  -8.440   2.475
   25   1HB   LYS   4          1HB       LYS   4   3.987  -6.465   3.355
   26   2HB   LYS   4          2HB       LYS   4   2.549  -7.166   2.632
   27   1HG   LYS   4          1HG       LYS   4   4.135  -8.818   4.530
   28   2HG   LYS   4          2HG       LYS   4   3.132  -7.514   5.165
   29   1HD   LYS   4          1HD       LYS   4   1.262  -8.542   3.721
   30   2HD   LYS   4          2HD       LYS   4   2.306  -9.965   3.649
   31   1HE   LYS   4          1HE       LYS   4   2.279 -10.177   6.038
   32   2HE   LYS   4          2HE       LYS   4   1.410  -8.652   6.209
   33   1HZ   LYS   4          1HZ       LYS   4  -0.394  -9.754   4.838
   34   2HZ   LYS   4          2HZ       LYS   4  -0.204 -10.305   6.430
   35   3HZ   LYS   4          3HZ       LYS   4   0.406 -11.221   5.142
   36    H    VAL   5           H        VAL   5   4.824 -10.557   2.307
   37    HA   VAL   5           HA       VAL   5   3.361 -11.435  -0.018
   38    HB   VAL   5           HB       VAL   5   5.458 -12.535   0.512
   39   1HG1  VAL   5          1HG1      VAL   5   5.725 -13.935   2.515
   40   2HG1  VAL   5          2HG1      VAL   5   4.157 -13.378   3.100
   41   3HG1  VAL   5          3HG1      VAL   5   5.488 -12.235   2.921
   42   1HG2  VAL   5          1HG2      VAL   5   3.789 -13.884  -0.608
   43   2HG2  VAL   5          2HG2      VAL   5   3.111 -14.375   0.944
   44   3HG2  VAL   5          3HG2      VAL   5   4.738 -14.884   0.492
   45    H    GLY   6           H        GLY   6   1.494 -12.633  -0.078
   46   1HA   GLY   6          1HA       GLY   6  -0.424 -13.683   0.783
   47   2HA   GLY   6          2HA       GLY   6   0.100 -13.259   2.412
   48    H    ASP   7           H        ASP   7   0.460 -10.705   0.360
   49    HA   ASP   7           HA       ASP   7  -2.160  -9.502   1.130
   50   1HB   ASP   7          1HB       ASP   7   0.623  -8.501   1.527
   51   2HB   ASP   7          2HB       ASP   7  -0.583  -7.328   1.006
   52    H    TYR   8           H        TYR   8  -2.377  -7.402  -0.230
   53    HA   TYR   8           HA       TYR   8  -2.045  -8.367  -2.985
   54   1HB   TYR   8          1HB       TYR   8  -4.194  -6.650  -1.749
   55   2HB   TYR   8          2HB       TYR   8  -4.083  -7.011  -3.468
   56    HD1  TYR   8           HD1      TYR   8  -4.465  -9.311  -4.276
   57    HD2  TYR   8           HD2      TYR   8  -5.021  -8.288  -0.186
   58    HE1  TYR   8           HE1      TYR   8  -5.766 -11.373  -3.949
   59    HE2  TYR   8           HE2      TYR   8  -6.318 -10.356   0.149
   60    HH   TYR   8           HH       TYR   8  -6.311 -12.894  -1.953
   61    H    LEU   9           H        LEU   9  -1.714  -6.900  -4.650
   62    HA   LEU   9           HA       LEU   9  -0.148  -4.549  -3.878
   63   1HB   LEU   9          1HB       LEU   9   1.059  -6.200  -5.155
   64   2HB   LEU   9          2HB       LEU   9  -0.207  -6.261  -6.360
   65    HG   LEU   9           HG       LEU   9   1.146  -3.643  -5.985
   66   1HD1  LEU   9          1HD1      LEU   9   3.007  -5.205  -5.875
   67   2HD1  LEU   9          2HD1      LEU   9   3.006  -4.335  -7.409
   68   3HD1  LEU   9          3HD1      LEU   9   2.435  -6.003  -7.340
   69   1HD2  LEU   9          1HD2      LEU   9  -0.642  -3.932  -7.632
   70   2HD2  LEU   9          2HD2      LEU   9   0.271  -5.231  -8.398
   71   3HD2  LEU   9          3HD2      LEU   9   0.898  -3.583  -8.417
   72    H    VAL  10           H        VAL  10  -0.584  -2.570  -4.659
   73    HA   VAL  10           HA       VAL  10  -2.658  -2.129  -6.672
   74    HB   VAL  10           HB       VAL  10  -2.795  -1.201  -3.812
   75   1HG1  VAL  10          1HG1      VAL  10  -2.767   0.868  -5.103
   76   2HG1  VAL  10          2HG1      VAL  10  -4.369   0.567  -4.426
   77   3HG1  VAL  10          3HG1      VAL  10  -4.058   0.251  -6.134
   78   1HG2  VAL  10          1HG2      VAL  10  -4.166  -3.078  -4.479
   79   2HG2  VAL  10          2HG2      VAL  10  -4.866  -2.127  -5.789
   80   3HG2  VAL  10          3HG2      VAL  10  -5.176  -1.680  -4.111
   81    H    VAL  11           H        VAL  11  -2.236  -0.261  -7.902
   82    HA   VAL  11           HA       VAL  11   0.099   1.309  -7.064
   83    HB   VAL  11           HB       VAL  11   0.196   2.253  -9.280
   84   1HG1  VAL  11          1HG1      VAL  11   1.321   0.134  -8.933
   85   2HG1  VAL  11          2HG1      VAL  11   0.706   0.247 -10.582
   86   3HG1  VAL  11          3HG1      VAL  11  -0.142  -0.739  -9.390
   87   1HG2  VAL  11          1HG2      VAL  11  -1.323   1.544 -11.070
   88   2HG2  VAL  11          2HG2      VAL  11  -2.171   2.400  -9.783
   89   3HG2  VAL  11          3HG2      VAL  11  -2.279   0.643  -9.893
   90    H    LYS  12           H        LYS  12   0.008   3.583  -7.008
   91    HA   LYS  12           HA       LYS  12  -2.721   4.614  -6.567
   92   1HB   LYS  12          1HB       LYS  12  -1.255   4.110  -4.497
   93   2HB   LYS  12          2HB       LYS  12  -0.311   5.506  -4.992
   94   1HG   LYS  12          1HG       LYS  12  -2.023   6.994  -4.520
   95   2HG   LYS  12          2HG       LYS  12  -3.268   5.741  -4.595
   96   1HD   LYS  12          1HD       LYS  12  -2.373   4.732  -2.550
   97   2HD   LYS  12          2HD       LYS  12  -1.126   5.977  -2.481
   98   1HE   LYS  12          1HE       LYS  12  -4.071   6.601  -2.433
   99   2HE   LYS  12          2HE       LYS  12  -3.123   6.319  -0.973
  100   1HZ   LYS  12          1HZ       LYS  12  -1.664   8.151  -1.654
  101   2HZ   LYS  12          2HZ       LYS  12  -3.263   8.655  -1.401
  102   3HZ   LYS  12          3HZ       LYS  12  -2.676   8.462  -2.983
  103    H    GLY  13           H        GLY  13  -0.056   4.751  -8.436
  104   1HA   GLY  13          1HA       GLY  13   0.336   7.509  -8.887
  105   2HA   GLY  13          2HA       GLY  13   0.672   6.222 -10.037
  106    H    THR  14           H        THR  14  -2.108   5.277 -10.037
  107    HA   THR  14           HA       THR  14  -3.234   7.137 -11.915
  108    HB   THR  14           HB       THR  14  -4.602   4.715 -10.723
  109    HG1  THR  14           HG1      THR  14  -3.591   3.479 -12.266
  110   1HG2  THR  14          1HG2      THR  14  -4.923   6.128 -13.376
  111   2HG2  THR  14          2HG2      THR  14  -6.037   6.232 -12.012
  112   3HG2  THR  14          3HG2      THR  14  -5.814   4.698 -12.855
  113    H    THR  15           H        THR  15  -3.438   8.987 -10.582
  114    HA   THR  15           HA       THR  15  -4.634   8.986  -8.036
  115    HB   THR  15           HB       THR  15  -4.429  11.375  -9.870
  116    HG1  THR  15           HG1      THR  15  -2.285  11.536  -9.250
  117   1HG2  THR  15          1HG2      THR  15  -4.086  12.600  -7.779
  118   2HG2  THR  15          2HG2      THR  15  -4.220  11.097  -6.865
  119   3HG2  THR  15          3HG2      THR  15  -5.616  11.726  -7.742
  120    H    THR  16           H        THR  16  -6.007   9.265 -11.230
  121    HA   THR  16           HA       THR  16  -8.430  10.527 -10.450
  122    HB   THR  16           HB       THR  16  -7.601  10.576 -12.774
  123    HG1  THR  16           HG1      THR  16  -9.760  10.990 -12.623
  124   1HG2  THR  16          1HG2      THR  16  -6.738   8.305 -12.957
  125   2HG2  THR  16          2HG2      THR  16  -7.927   8.611 -14.223
  126   3HG2  THR  16          3HG2      THR  16  -8.371   7.655 -12.811
  127    H    GLU  17           H        GLU  17  -7.274   7.336 -10.095
  128    HA   GLU  17           HA       GLU  17  -9.991   6.254  -9.889
  129   1HB   GLU  17          1HB       GLU  17  -7.359   5.086 -10.547
  130   2HB   GLU  17          2HB       GLU  17  -8.423   4.079  -9.572
  131   1HG   GLU  17          1HG       GLU  17  -9.016   5.261 -12.272
  132   2HG   GLU  17          2HG       GLU  17  -8.763   3.559 -11.878
  133    H    ARG  18           H        ARG  18 -10.077   4.399  -8.198
  134    HA   ARG  18           HA       ARG  18  -9.589   5.591  -5.614
  135   1HB   ARG  18          1HB       ARG  18 -10.655   2.835  -6.290
  136   2HB   ARG  18          2HB       ARG  18 -10.702   3.596  -4.710
  137   1HG   ARG  18          1HG       ARG  18 -12.853   3.902  -5.475
  138   2HG   ARG  18          2HG       ARG  18 -12.086   5.432  -5.899
  139   1HD   ARG  18          1HD       ARG  18 -11.811   4.706  -8.184
  140   2HD   ARG  18          2HD       ARG  18 -12.422   3.103  -7.783
  141    HE   ARG  18           HE       ARG  18 -14.421   4.848  -7.073
  142   1HH1  ARG  18          1HH1      ARG  18 -12.696   4.052 -10.029
  143   2HH1  ARG  18          2HH1      ARG  18 -14.052   4.441 -11.051
  144   1HH2  ARG  18          1HH2      ARG  18 -16.181   5.344  -8.432
  145   2HH2  ARG  18          2HH2      ARG  18 -16.009   5.187 -10.158
  146    H    HIS  19           H        HIS  19  -8.849   2.390  -6.913
  147    HA   HIS  19           HA       HIS  19  -6.071   2.654  -6.251
  148   1HB   HIS  19          1HB       HIS  19  -6.222   0.303  -5.060
  149   2HB   HIS  19          2HB       HIS  19  -6.440   1.789  -4.151
  150    HD1  HIS  19           HD1      HIS  19  -8.105   1.267  -2.399
  151    HD2  HIS  19           HD2      HIS  19  -9.177  -0.359  -6.074
  152    HE1  HIS  19           HE1      HIS  19 -10.344   0.195  -2.038
  153    HE2  HIS  19           HE2      HIS  19 -10.831  -1.020  -4.188
  154    H    ASP  20           H        ASP  20  -5.045   1.952  -7.952
  155    HA   ASP  20           HA       ASP  20  -6.535   0.317  -9.885
  156   1HB   ASP  20          1HB       ASP  20  -5.886   2.578 -10.588
  157   2HB   ASP  20          2HB       ASP  20  -4.203   2.225 -10.226
  158    H    GLN  21           H        GLN  21  -4.973  -0.924 -11.413
  159    HA   GLN  21           HA       GLN  21  -3.890  -2.941 -11.568
  160   1HB   GLN  21          1HB       GLN  21  -1.698  -1.204 -10.435
  161   2HB   GLN  21          2HB       GLN  21  -1.473  -2.667 -11.389
  162   1HG   GLN  21          1HG       GLN  21  -2.654  -1.573 -13.269
  163   2HG   GLN  21          2HG       GLN  21  -2.748  -0.100 -12.307
  164   1HE2  GLN  21          1HE2      GLN  21  -1.563   1.110 -13.718
  165   2HE2  GLN  21          2HE2      GLN  21   0.137   0.892 -13.951
  166    H    HIS  22           H        HIS  22  -4.683  -4.507 -10.253
  167    HA   HIS  22           HA       HIS  22  -3.560  -4.695  -7.546
  168   1HB   HIS  22          1HB       HIS  22  -5.757  -3.590  -7.416
  169   2HB   HIS  22          2HB       HIS  22  -6.489  -4.959  -8.243
  170    HD1  HIS  22           HD1      HIS  22  -6.073  -7.351  -6.846
  171    HD2  HIS  22           HD2      HIS  22  -5.912  -3.779  -4.733
  172    HE1  HIS  22           HE1      HIS  22  -6.406  -7.972  -4.449
  173    HE2  HIS  22           HE2      HIS  22  -6.480  -5.782  -3.214
  174    H    ALA  23           H        ALA  23  -3.129  -6.661  -6.809
  175    HA   ALA  23           HA       ALA  23  -4.477  -9.073  -7.623
  176   1HB   ALA  23          1HB       ALA  23  -3.059  -8.804  -9.607
  177   2HB   ALA  23          2HB       ALA  23  -2.614 -10.224  -8.661
  178   3HB   ALA  23          3HB       ALA  23  -1.634  -8.761  -8.567
  179    H    GLU  24           H        GLU  24  -3.078 -11.003  -6.759
  180    HA   GLU  24           HA       GLU  24  -2.315 -10.201  -4.035
  181   1HB   GLU  24          1HB       GLU  24  -3.982 -11.988  -4.193
  182   2HB   GLU  24          2HB       GLU  24  -2.864 -12.966  -5.137
  183   1HG   GLU  24          1HG       GLU  24  -1.336 -13.077  -3.241
  184   2HG   GLU  24          2HG       GLU  24  -2.426 -12.075  -2.291
  185    H    ILE  25           H        ILE  25  -0.317 -10.234  -3.312
  186    HA   ILE  25           HA       ILE  25   1.804 -11.249  -5.036
  187    HB   ILE  25           HB       ILE  25   2.077  -9.774  -2.412
  188   1HG1  ILE  25          1HG1      ILE  25   2.166  -8.666  -5.231
  189   2HG1  ILE  25          2HG1      ILE  25   0.871  -8.395  -4.069
  190   1HG2  ILE  25          1HG2      ILE  25   4.037 -10.283  -4.647
  191   2HG2  ILE  25          2HG2      ILE  25   4.040 -11.054  -3.061
  192   3HG2  ILE  25          3HG2      ILE  25   4.354  -9.324  -3.201
  193   1HD1  ILE  25          1HD1      ILE  25   2.375  -6.484  -4.211
  194   2HD1  ILE  25          2HD1      ILE  25   3.730  -7.510  -3.740
  195   3HD1  ILE  25          3HD1      ILE  25   2.411  -7.214  -2.607
  196    H    ILE  26           H        ILE  26   2.038 -13.372  -4.828
  197    HA   ILE  26           HA       ILE  26   2.102 -14.536  -2.142
  198    HB   ILE  26           HB       ILE  26   2.077 -16.753  -3.254
  199   1HG1  ILE  26          1HG1      ILE  26   2.942 -15.765  -5.503
  200   2HG1  ILE  26          2HG1      ILE  26   1.733 -17.036  -5.573
  201   1HG2  ILE  26          1HG2      ILE  26  -0.315 -16.647  -3.880
  202   2HG2  ILE  26          2HG2      ILE  26  -0.219 -14.888  -3.941
  203   3HG2  ILE  26          3HG2      ILE  26   0.020 -15.730  -2.410
  204   1HD1  ILE  26          1HD1      ILE  26   0.003 -15.363  -5.976
  205   2HD1  ILE  26          2HD1      ILE  26   1.280 -15.293  -7.192
  206   3HD1  ILE  26          3HD1      ILE  26   1.222 -14.090  -5.905
  207    H    GLU  27           H        GLU  27   4.087 -13.852  -4.923
  208    HA   GLU  27           HA       GLU  27   6.364 -14.709  -3.291
  209   1HB   GLU  27          1HB       GLU  27   6.145 -16.328  -5.110
  210   2HB   GLU  27          2HB       GLU  27   6.175 -15.023  -6.293
  211   1HG   GLU  27          1HG       GLU  27   8.429 -14.482  -5.763
  212   2HG   GLU  27          2HG       GLU  27   8.420 -15.553  -4.367
  213    H    VAL  28           H        VAL  28   7.584 -13.103  -2.771
  214    HA   VAL  28           HA       VAL  28   7.465 -10.638  -4.337
  215    HB   VAL  28           HB       VAL  28   8.759 -11.003  -1.635
  216   1HG1  VAL  28          1HG1      VAL  28   7.760  -8.569  -3.109
  217   2HG1  VAL  28          2HG1      VAL  28   9.445  -9.024  -2.862
  218   3HG1  VAL  28          3HG1      VAL  28   8.443  -8.572  -1.483
  219   1HG2  VAL  28          1HG2      VAL  28   6.709 -10.119  -0.640
  220   2HG2  VAL  28          2HG2      VAL  28   6.407 -11.647  -1.468
  221   3HG2  VAL  28          3HG2      VAL  28   5.933 -10.126  -2.224
  222    H    ARG  29           H        ARG  29   9.099 -10.202  -5.686
  223    HA   ARG  29           HA       ARG  29  11.306 -11.925  -6.008
  224   1HB   ARG  29          1HB       ARG  29  10.255 -10.540  -7.795
  225   2HB   ARG  29          2HB       ARG  29  10.959  -9.111  -7.060
  226   1HG   ARG  29          1HG       ARG  29  12.817 -11.300  -7.771
  227   2HG   ARG  29          2HG       ARG  29  12.079 -10.408  -9.101
  228   1HD   ARG  29          1HD       ARG  29  12.853  -8.296  -7.977
  229   2HD   ARG  29          2HD       ARG  29  13.757  -9.310  -6.855
  230    HE   ARG  29           HE       ARG  29  14.749 -10.222  -9.101
  231   1HH1  ARG  29          1HH1      ARG  29  13.986  -6.899  -8.301
  232   2HH1  ARG  29          2HH1      ARG  29  15.209  -6.231  -9.333
  233   1HH2  ARG  29          1HH2      ARG  29  16.326  -9.361 -10.474
  234   2HH2  ARG  29          2HH2      ARG  29  16.538  -7.638 -10.586
  235    H    SER  30           H        SER  30  10.889  -8.890  -4.320
  236    HA   SER  30           HA       SER  30  13.334  -9.394  -2.843
  237   1HB   SER  30          1HB       SER  30  14.153  -7.985  -4.652
  238   2HB   SER  30          2HB       SER  30  12.854  -6.825  -4.382
  239    HG   SER  30           HG       SER  30  15.119  -6.524  -3.407
  240    H    ALA  31           H        ALA  31  13.019  -8.936  -0.732
  241    HA   ALA  31           HA       ALA  31  10.421  -8.285   0.168
  242   1HB   ALA  31          1HB       ALA  31  12.996  -8.330   1.737
  243   2HB   ALA  31          2HB       ALA  31  11.950  -9.718   1.435
  244   3HB   ALA  31          3HB       ALA  31  11.367  -8.367   2.408
  245    H    ASP  32           H        ASP  32  13.187  -6.376  -0.569
  246    HA   ASP  32           HA       ASP  32  12.544  -4.055   0.925
  247   1HB   ASP  32          1HB       ASP  32  14.125  -4.333  -1.644
  248   2HB   ASP  32          2HB       ASP  32  14.058  -2.879  -0.655
  249    H    GLY  33           H        GLY  33  11.166  -5.483  -1.843
  250   1HA   GLY  33          1HA       GLY  33   9.014  -4.727  -2.591
  251   2HA   GLY  33          2HA       GLY  33   9.512  -3.081  -2.230
  252    H    SER  34           H        SER  34  12.043  -4.676  -3.673
  253    HA   SER  34           HA       SER  34  11.917  -3.100  -6.014
  254   1HB   SER  34          1HB       SER  34  13.629  -5.554  -5.601
  255   2HB   SER  34          2HB       SER  34  13.965  -4.166  -6.638
  256    HG   SER  34           HG       SER  34  14.963  -4.370  -4.390
  257    HA   PRO  35           HA       PRO  35   9.180  -5.759  -8.371
  258   1HB   PRO  35          1HB       PRO  35   9.873  -3.973 -10.601
  259   2HB   PRO  35          2HB       PRO  35   8.306  -4.252  -9.837
  260   1HG   PRO  35          1HG       PRO  35   9.644  -1.941  -9.527
  261   2HG   PRO  35          2HG       PRO  35   8.647  -2.634  -8.236
  262   1HD   PRO  35          1HD       PRO  35  11.622  -2.704  -8.572
  263   2HD   PRO  35          2HD       PRO  35  10.661  -2.420  -7.105
  264    HA   PRO  36           HA       PRO  36   8.325  -6.258 -10.617
  265   1HB   PRO  36          1HB       PRO  36   7.873  -8.600 -11.804
  266   2HB   PRO  36          2HB       PRO  36   8.659  -7.273 -12.669
  267   1HG   PRO  36          1HG       PRO  36   9.887  -9.680 -11.380
  268   2HG   PRO  36          2HG       PRO  36  10.248  -8.953 -12.956
  269   1HD   PRO  36          1HD       PRO  36  11.738  -8.522 -10.697
  270   2HD   PRO  36          2HD       PRO  36  11.630  -7.373 -12.046
  271    H    TYR  37           H        TYR  37   6.504  -7.948 -10.247
  272    HA   TYR  37           HA       TYR  37   7.097  -9.512  -7.808
  273   1HB   TYR  37          1HB       TYR  37   4.457  -8.180  -8.421
  274   2HB   TYR  37          2HB       TYR  37   4.943  -8.954  -6.917
  275    HD1  TYR  37           HD1      TYR  37   5.276  -5.970  -9.009
  276    HD2  TYR  37           HD2      TYR  37   6.346  -7.776  -5.309
  277    HE1  TYR  37           HE1      TYR  37   6.015  -3.787  -8.166
  278    HE2  TYR  37           HE2      TYR  37   7.089  -5.588  -4.453
  279    HH   TYR  37           HH       TYR  37   7.910  -3.406  -5.439
  280    H    VAL  38           H        VAL  38   6.072 -11.556  -7.669
  281    HA   VAL  38           HA       VAL  38   4.812 -12.406 -10.180
  282    HB   VAL  38           HB       VAL  38   5.796 -14.109  -7.875
  283   1HG1  VAL  38          1HG1      VAL  38   5.254 -16.022  -9.324
  284   2HG1  VAL  38          2HG1      VAL  38   4.576 -14.922 -10.523
  285   3HG1  VAL  38          3HG1      VAL  38   3.811 -15.081  -8.941
  286   1HG2  VAL  38          1HG2      VAL  38   7.459 -14.901  -9.490
  287   2HG2  VAL  38          2HG2      VAL  38   7.595 -13.161  -9.229
  288   3HG2  VAL  38          3HG2      VAL  38   6.825 -13.778 -10.692
  289    H    VAL  39           H        VAL  39   2.789 -12.030 -10.211
  290    HA   VAL  39           HA       VAL  39   1.356 -11.878  -7.657
  291    HB   VAL  39           HB       VAL  39   2.116  -9.791  -9.265
  292   1HG1  VAL  39          1HG1      VAL  39   0.113  -8.865 -10.300
  293   2HG1  VAL  39          2HG1      VAL  39  -0.758 -10.354  -9.940
  294   3HG1  VAL  39          3HG1      VAL  39   0.610 -10.380 -11.054
  295   1HG2  VAL  39          1HG2      VAL  39   1.459  -9.590  -6.968
  296   2HG2  VAL  39          2HG2      VAL  39  -0.225  -9.907  -7.387
  297   3HG2  VAL  39          3HG2      VAL  39   0.563  -8.431  -7.949
  298    H    ARG  40           H        ARG  40  -0.839 -12.488  -7.689
  299    HA   ARG  40           HA       ARG  40  -1.602 -13.963 -10.119
  300   1HB   ARG  40          1HB       ARG  40  -0.908 -15.418  -8.195
  301   2HB   ARG  40          2HB       ARG  40  -2.273 -14.774  -7.287
  302   1HG   ARG  40          1HG       ARG  40  -3.812 -15.653  -8.945
  303   2HG   ARG  40          2HG       ARG  40  -2.458 -16.263  -9.896
  304   1HD   ARG  40          1HD       ARG  40  -1.815 -17.633  -7.878
  305   2HD   ARG  40          2HD       ARG  40  -3.365 -17.170  -7.173
  306    HE   ARG  40           HE       ARG  40  -3.488 -18.327  -9.827
  307   1HH1  ARG  40          1HH1      ARG  40  -3.608 -18.975  -6.380
  308   2HH1  ARG  40          2HH1      ARG  40  -4.521 -20.441  -6.570
  309   1HH2  ARG  40          1HH2      ARG  40  -4.656 -20.250 -10.067
  310   2HH2  ARG  40          2HH2      ARG  40  -5.110 -21.169  -8.662
  311    H    TRP  41           H        TRP  41  -3.481 -13.439 -10.988
  312    HA   TRP  41           HA       TRP  41  -5.306 -11.652  -9.645
  313   1HB   TRP  41          1HB       TRP  41  -6.015 -13.184 -12.130
  314   2HB   TRP  41          2HB       TRP  41  -6.514 -11.570 -11.653
  315    HD1  TRP  41           HD1      TRP  41  -4.164 -13.346 -13.867
  316    HE1  TRP  41           HE1      TRP  41  -2.518 -11.699 -14.959
  317    HE3  TRP  41           HE3      TRP  41  -5.055  -9.243 -10.946
  318    HZ2  TRP  41           HZ2      TRP  41  -1.707  -9.020 -14.632
  319    HZ3  TRP  41           HZ3      TRP  41  -3.802  -7.178 -11.409
  320    HH2  TRP  41           HH2      TRP  41  -2.163  -7.071 -13.212
  321    H    LEU  42           H        LEU  42  -6.224 -12.668  -7.896
  322    HA   LEU  42           HA       LEU  42  -6.759 -15.486  -7.904
  323   1HB   LEU  42          1HB       LEU  42  -7.848 -13.472  -5.954
  324   2HB   LEU  42          2HB       LEU  42  -7.610 -15.189  -5.701
  325    HG   LEU  42           HG       LEU  42  -5.500 -13.051  -5.867
  326   1HD1  LEU  42          1HD1      LEU  42  -6.678 -13.241  -3.761
  327   2HD1  LEU  42          2HD1      LEU  42  -5.023 -13.829  -3.600
  328   3HD1  LEU  42          3HD1      LEU  42  -6.359 -14.975  -3.718
  329   1HD2  LEU  42          1HD2      LEU  42  -5.141 -16.041  -5.693
  330   2HD2  LEU  42          2HD2      LEU  42  -3.864 -14.834  -5.539
  331   3HD2  LEU  42          3HD2      LEU  42  -4.719 -15.024  -7.071
  332    H    VAL  43           H        VAL  43  -8.873 -12.658  -7.547
  333    HA   VAL  43           HA       VAL  43 -11.218 -14.250  -7.794
  334    HB   VAL  43           HB       VAL  43 -12.295 -11.913  -7.928
  335   1HG1  VAL  43          1HG1      VAL  43 -12.357 -13.329  -5.959
  336   2HG1  VAL  43          2HG1      VAL  43 -12.059 -11.654  -5.488
  337   3HG1  VAL  43          3HG1      VAL  43 -10.728 -12.810  -5.522
  338   1HG2  VAL  43          1HG2      VAL  43 -10.307 -10.649  -8.529
  339   2HG2  VAL  43          2HG2      VAL  43  -9.515 -11.176  -7.044
  340   3HG2  VAL  43          3HG2      VAL  43 -10.925 -10.121  -6.965
  341    H    ASN  44           H        ASN  44  -9.078 -13.062 -10.026
  342    HA   ASN  44           HA       ASN  44 -11.097 -12.971 -12.127
  343   1HB   ASN  44          1HB       ASN  44  -8.138 -12.333 -12.220
  344   2HB   ASN  44          2HB       ASN  44  -9.210 -12.273 -13.615
  345   1HD2  ASN  44          1HD2      ASN  44  -8.188 -10.708 -10.727
  346   2HD2  ASN  44          2HD2      ASN  44  -9.087  -9.252 -10.951
  347    H    GLY  45           H        GLY  45  -7.841 -14.452 -11.782
  348   1HA   GLY  45          1HA       GLY  45  -7.956 -16.950 -11.561
  349   2HA   GLY  45          2HA       GLY  45  -9.005 -16.898 -12.964
  350    H    HIS  46           H        HIS  46  -5.751 -15.666 -12.057
  351    HA   HIS  46           HA       HIS  46  -4.461 -17.392 -13.924
  352   1HB   HIS  46          1HB       HIS  46  -5.055 -14.644 -14.796
  353   2HB   HIS  46          2HB       HIS  46  -3.391 -15.147 -15.016
  354    HD1  HIS  46           HD1      HIS  46  -3.793 -18.042 -15.885
  355    HD2  HIS  46           HD2      HIS  46  -6.058 -14.863 -17.315
  356    HE1  HIS  46           HE1      HIS  46  -4.655 -18.781 -18.127
  357    HE2  HIS  46           HE2      HIS  46  -5.783 -16.740 -19.080
  358    H    GLU  47           H        GLU  47  -2.201 -17.301 -13.844
  359    HA   GLU  47           HA       GLU  47  -1.083 -15.772 -11.579
  360   1HB   GLU  47          1HB       GLU  47  -0.032 -18.328 -12.824
  361   2HB   GLU  47          2HB       GLU  47   0.704 -17.466 -11.486
  362   1HG   GLU  47          1HG       GLU  47  -0.385 -19.195 -10.441
  363   2HG   GLU  47          2HG       GLU  47  -1.537 -17.872 -10.285
  364    H    THR  48           H        THR  48   0.825 -14.560 -11.939
  365    HA   THR  48           HA       THR  48   2.211 -14.680 -14.436
  366    HB   THR  48           HB       THR  48   0.182 -13.636 -15.214
  367    HG1  THR  48           HG1      THR  48   1.122 -11.792 -16.163
  368   1HG2  THR  48          1HG2      THR  48   0.726 -11.479 -13.185
  369   2HG2  THR  48          2HG2      THR  48  -0.615 -12.624 -13.159
  370   3HG2  THR  48          3HG2      THR  48  -0.513 -11.411 -14.436
  371    H    THR  49           H        THR  49   3.471 -12.529 -14.719
  372    HA   THR  49           HA       THR  49   4.503 -11.628 -12.110
  373    HB   THR  49           HB       THR  49   6.169 -12.116 -14.592
  374    HG1  THR  49           HG1      THR  49   5.223 -13.944 -13.098
  375   1HG2  THR  49          1HG2      THR  49   7.056 -10.353 -13.135
  376   2HG2  THR  49          2HG2      THR  49   8.078 -11.789 -13.079
  377   3HG2  THR  49          3HG2      THR  49   6.969 -11.445 -11.754
  378    H    VAL  50           H        VAL  50   3.890  -9.555 -11.945
  379    HA   VAL  50           HA       VAL  50   3.527  -8.033 -14.440
  380    HB   VAL  50           HB       VAL  50   2.068  -7.725 -11.808
  381   1HG1  VAL  50          1HG1      VAL  50   1.616  -6.289 -14.424
  382   2HG1  VAL  50          2HG1      VAL  50   2.292  -5.576 -12.961
  383   3HG1  VAL  50          3HG1      VAL  50   0.621  -6.139 -12.976
  384   1HG2  VAL  50          1HG2      VAL  50   1.429  -9.739 -13.009
  385   2HG2  VAL  50          2HG2      VAL  50   1.132  -8.790 -14.466
  386   3HG2  VAL  50          3HG2      VAL  50   0.126  -8.552 -13.037
  387    H    TYR  51           H        TYR  51   4.215  -5.956 -14.612
  388    HA   TYR  51           HA       TYR  51   5.830  -4.842 -12.422
  389   1HB   TYR  51          1HB       TYR  51   5.765  -4.132 -15.371
  390   2HB   TYR  51          2HB       TYR  51   6.748  -3.314 -14.165
  391    HD1  TYR  51           HD1      TYR  51   6.218  -6.600 -15.821
  392    HD2  TYR  51           HD2      TYR  51   8.864  -4.113 -13.608
  393    HE1  TYR  51           HE1      TYR  51   8.047  -8.193 -16.232
  394    HE2  TYR  51           HE2      TYR  51  10.700  -5.696 -14.010
  395    HH   TYR  51           HH       TYR  51  10.438  -8.297 -16.261
  396    HA   PRO  52           HA       PRO  52   2.116  -2.179 -12.251
  397   1HB   PRO  52          1HB       PRO  52   2.216  -1.687  -9.628
  398   2HB   PRO  52          2HB       PRO  52   1.662  -3.249 -10.247
  399   1HG   PRO  52          1HG       PRO  52   4.330  -2.503  -9.110
  400   2HG   PRO  52          2HG       PRO  52   3.363  -3.960  -8.827
  401   1HD   PRO  52          1HD       PRO  52   5.472  -3.825 -10.582
  402   2HD   PRO  52          2HD       PRO  52   4.137  -4.987 -10.713
  403    H    GLY  53           H        GLY  53   5.410  -1.675 -11.334
  404   1HA   GLY  53          1HA       GLY  53   6.339   0.562 -12.003
  405   2HA   GLY  53          2HA       GLY  53   4.998   1.232 -11.070
  406    H    SER  54           H        SER  54   6.279   2.258  -9.498
  407    HA   SER  54           HA       SER  54   7.374   0.346  -7.567
  408   1HB   SER  54          1HB       SER  54   8.708   2.946  -8.337
  409   2HB   SER  54          2HB       SER  54   9.255   1.849  -7.066
  410    HG   SER  54           HG       SER  54   8.949   0.416  -9.267
  411    H    ASP  55           H        ASP  55   4.958   2.105  -8.007
  412    HA   ASP  55           HA       ASP  55   4.985   3.501  -5.414
  413   1HB   ASP  55          1HB       ASP  55   3.063   4.769  -6.208
  414   2HB   ASP  55          2HB       ASP  55   4.371   4.889  -7.379
  415    H    ALA  56           H        ALA  56   4.629   0.634  -6.230
  416    HA   ALA  56           HA       ALA  56   1.999  -0.213  -5.814
  417   1HB   ALA  56          1HB       ALA  56   2.926  -2.434  -5.588
  418   2HB   ALA  56          2HB       ALA  56   4.540  -1.764  -5.352
  419   3HB   ALA  56          3HB       ALA  56   3.722  -1.571  -6.904
  420    H    VAL  57           H        VAL  57   0.836   0.064  -4.071
  421    HA   VAL  57           HA       VAL  57   2.079  -0.101  -1.421
  422    HB   VAL  57           HB       VAL  57   0.586   1.814  -1.942
  423   1HG1  VAL  57          1HG1      VAL  57  -1.587  -0.245  -1.964
  424   2HG1  VAL  57          2HG1      VAL  57  -1.050   0.726  -3.335
  425   3HG1  VAL  57          3HG1      VAL  57  -1.835   1.501  -1.960
  426   1HG2  VAL  57          1HG2      VAL  57  -0.657   1.805   0.153
  427   2HG2  VAL  57          2HG2      VAL  57   1.002   1.239   0.351
  428   3HG2  VAL  57          3HG2      VAL  57  -0.325   0.079   0.317
  429    H    VAL  58           H        VAL  58   0.359  -1.053   0.138
  430    HA   VAL  58           HA       VAL  58  -0.132  -3.790  -0.866
  431    HB   VAL  58           HB       VAL  58   0.884  -3.037   1.882
  432   1HG1  VAL  58          1HG1      VAL  58   0.491  -5.725   0.582
  433   2HG1  VAL  58          2HG1      VAL  58  -0.467  -5.054   1.903
  434   3HG1  VAL  58          3HG1      VAL  58   1.235  -5.445   2.156
  435   1HG2  VAL  58          1HG2      VAL  58   2.337  -4.312  -0.435
  436   2HG2  VAL  58          2HG2      VAL  58   2.999  -4.028   1.174
  437   3HG2  VAL  58          3HG2      VAL  58   2.569  -2.662   0.143
  438    H    VAL  59           H        VAL  59  -2.133  -4.510  -0.642
  439    HA   VAL  59           HA       VAL  59  -3.895  -3.309   1.370
  440    HB   VAL  59           HB       VAL  59  -5.643  -4.159  -0.420
  441   1HG1  VAL  59          1HG1      VAL  59  -5.515  -1.881   0.433
  442   2HG1  VAL  59          2HG1      VAL  59  -5.741  -1.873  -1.316
  443   3HG1  VAL  59          3HG1      VAL  59  -4.146  -1.556  -0.629
  444   1HG2  VAL  59          1HG2      VAL  59  -4.037  -5.040  -1.980
  445   2HG2  VAL  59          2HG2      VAL  59  -3.238  -3.470  -2.072
  446   3HG2  VAL  59          3HG2      VAL  59  -4.876  -3.662  -2.696
  447    H    THR  60           H        THR  60  -5.915  -4.780   1.594
  448    HA   THR  60           HA       THR  60  -4.967  -7.551   2.020
  449    HB   THR  60           HB       THR  60  -6.843  -7.379   3.900
  450    HG1  THR  60           HG1      THR  60  -5.962  -4.683   3.853
  451   1HG2  THR  60          1HG2      THR  60  -4.460  -7.785   4.305
  452   2HG2  THR  60          2HG2      THR  60  -5.137  -6.673   5.495
  453   3HG2  THR  60          3HG2      THR  60  -4.149  -6.054   4.173
  454    H    ALA  61           H        ALA  61  -7.460  -8.639   2.804
  455    HA   ALA  61           HA       ALA  61  -8.263  -9.596   0.325
  456   1HB   ALA  61          1HB       ALA  61  -8.384 -10.843   2.431
  457   2HB   ALA  61          2HB       ALA  61  -9.891 -10.893   1.515
  458   3HB   ALA  61          3HB       ALA  61  -9.749  -9.840   2.923
  459    H    THR  62           H        THR  62  -9.944  -7.187   2.372
  460    HA   THR  62           HA       THR  62 -12.312  -7.258   0.772
  461    HB   THR  62           HB       THR  62 -12.502  -4.852   1.943
  462    HG1  THR  62           HG1      THR  62 -11.521  -5.351   4.139
  463   1HG2  THR  62          1HG2      THR  62 -12.943  -7.520   3.278
  464   2HG2  THR  62          2HG2      THR  62 -14.066  -6.694   2.197
  465   3HG2  THR  62          3HG2      THR  62 -13.679  -5.995   3.767
  466    H    GLU  63           H        GLU  63  -9.611  -4.986   0.976
  467    HA   GLU  63           HA       GLU  63 -10.389  -3.312  -1.142
  468   1HB   GLU  63          1HB       GLU  63  -7.579  -4.010  -0.268
  469   2HB   GLU  63          2HB       GLU  63  -8.057  -2.601  -1.204
  470   1HG   GLU  63          1HG       GLU  63  -8.824  -3.201   1.643
  471   2HG   GLU  63          2HG       GLU  63  -7.657  -1.997   1.101
  472    H    HIS  64           H        HIS  64  -9.376  -6.508  -1.088
  473    HA   HIS  64           HA       HIS  64  -7.978  -6.598  -3.556
  474   1HB   HIS  64          1HB       HIS  64  -7.260  -8.416  -2.515
  475   2HB   HIS  64          2HB       HIS  64  -8.595  -8.374  -1.380
  476    HD1  HIS  64           HD1      HIS  64 -10.278 -10.213  -1.570
  477    HD2  HIS  64           HD2      HIS  64  -7.857  -9.934  -4.938
  478    HE1  HIS  64           HE1      HIS  64 -10.748 -12.279  -2.918
  479    HE2  HIS  64           HE2      HIS  64  -9.118 -12.178  -4.834
  480    H    ALA  65           H        ALA  65 -11.369  -7.262  -2.686
  481    HA   ALA  65           HA       ALA  65 -11.944  -8.889  -4.893
  482   1HB   ALA  65          1HB       ALA  65 -14.280  -8.497  -4.353
  483   2HB   ALA  65          2HB       ALA  65 -13.834  -7.116  -3.350
  484   3HB   ALA  65          3HB       ALA  65 -13.338  -8.743  -2.882
  485    H    GLU  66           H        GLU  66 -13.184  -5.621  -4.440
  486    HA   GLU  66           HA       GLU  66 -14.096  -5.357  -7.079
  487   1HB   GLU  66          1HB       GLU  66 -14.140  -2.828  -6.301
  488   2HB   GLU  66          2HB       GLU  66 -15.259  -4.008  -5.636
  489   1HG   GLU  66          1HG       GLU  66 -14.572  -3.065  -3.687
  490   2HG   GLU  66          2HG       GLU  66 -13.301  -4.277  -3.843
  491    H    ALA  67           H        ALA  67 -11.241  -4.041  -5.465
  492    HA   ALA  67           HA       ALA  67 -10.186  -2.606  -7.593
  493   1HB   ALA  67          1HB       ALA  67  -9.351  -2.458  -5.295
  494   2HB   ALA  67          2HB       ALA  67  -8.056  -2.743  -6.457
  495   3HB   ALA  67          3HB       ALA  67  -8.652  -4.069  -5.457
  496    H    GLU  68           H        GLU  68  -9.759  -6.059  -6.773
  497    HA   GLU  68           HA       GLU  68  -7.626  -6.397  -8.594
  498   1HB   GLU  68          1HB       GLU  68  -8.242  -7.887  -6.625
  499   2HB   GLU  68          2HB       GLU  68  -9.437  -8.615  -7.688
  500   1HG   GLU  68          1HG       GLU  68  -7.828  -9.529  -9.084
  501   2HG   GLU  68          2HG       GLU  68  -6.566  -8.441  -8.500
  502    H    LYS  69           H        LYS  69 -11.142  -6.953  -8.954
  503    HA   LYS  69           HA       LYS  69 -10.867  -8.100 -11.530
  504   1HB   LYS  69          1HB       LYS  69 -13.271  -7.492 -11.861
  505   2HB   LYS  69          2HB       LYS  69 -12.946  -8.402 -10.396
  506   1HG   LYS  69          1HG       LYS  69 -13.030  -6.308  -9.110
  507   2HG   LYS  69          2HG       LYS  69 -13.435  -5.443 -10.594
  508   1HD   LYS  69          1HD       LYS  69 -15.466  -6.801 -10.821
  509   2HD   LYS  69          2HD       LYS  69 -15.059  -7.651  -9.327
  510   1HE   LYS  69          1HE       LYS  69 -15.168  -5.537  -8.100
  511   2HE   LYS  69          2HE       LYS  69 -15.581  -4.692  -9.590
  512   1HZ   LYS  69          1HZ       LYS  69 -17.603  -6.047  -9.720
  513   2HZ   LYS  69          2HZ       LYS  69 -17.543  -5.115  -8.308
  514   3HZ   LYS  69          3HZ       LYS  69 -17.210  -6.775  -8.237
  515    H    ARG  70           H        ARG  70 -11.679  -4.703 -10.645
  516    HA   ARG  70           HA       ARG  70 -11.731  -3.756 -13.320
  517   1HB   ARG  70          1HB       ARG  70 -11.024  -2.234 -10.799
  518   2HB   ARG  70          2HB       ARG  70 -11.464  -1.509 -12.337
  519   1HG   ARG  70          1HG       ARG  70 -13.695  -2.304 -12.167
  520   2HG   ARG  70          2HG       ARG  70 -13.287  -3.322 -10.782
  521   1HD   ARG  70          1HD       ARG  70 -13.220  -0.303 -10.849
  522   2HD   ARG  70          2HD       ARG  70 -14.450  -1.297 -10.067
  523    HE   ARG  70           HE       ARG  70 -11.785  -1.856  -9.163
  524   1HH1  ARG  70          1HH1      ARG  70 -14.537   0.274  -8.714
  525   2HH1  ARG  70          2HH1      ARG  70 -14.158   0.593  -7.039
  526   1HH2  ARG  70          1HH2      ARG  70 -11.303  -1.421  -6.980
  527   2HH2  ARG  70          2HH2      ARG  70 -12.352  -0.397  -6.053
  528    H    ALA  71           H        ALA  71  -9.182  -3.941 -10.949
  529    HA   ALA  71           HA       ALA  71  -7.310  -2.452 -12.523
  530   1HB   ALA  71          1HB       ALA  71  -7.391  -2.222 -10.106
  531   2HB   ALA  71          2HB       ALA  71  -5.805  -2.772 -10.653
  532   3HB   ALA  71          3HB       ALA  71  -6.936  -3.915  -9.927
  533    H    ALA  72           H        ALA  72  -8.086  -5.834 -12.189
  534    HA   ALA  72           HA       ALA  72  -5.589  -6.726 -13.268
  535   1HB   ALA  72          1HB       ALA  72  -7.078  -8.305 -12.129
  536   2HB   ALA  72          2HB       ALA  72  -6.715  -8.824 -13.776
  537   3HB   ALA  72          3HB       ALA  72  -8.276  -8.092 -13.406
  538    H    ALA  73           H        ALA  73  -8.692  -5.687 -14.560
  539    HA   ALA  73           HA       ALA  73  -8.070  -6.113 -17.298
  540   1HB   ALA  73          1HB       ALA  73  -9.908  -4.054 -16.077
  541   2HB   ALA  73          2HB       ALA  73 -10.350  -5.703 -16.520
  542   3HB   ALA  73          3HB       ALA  73  -9.887  -4.549 -17.770
  543    H    ARG  74           H        ARG  74  -7.280  -3.562 -15.044
  544    HA   ARG  74           HA       ARG  74  -6.206  -1.809 -17.072
  545   1HB   ARG  74          1HB       ARG  74  -6.541  -1.749 -14.143
  546   2HB   ARG  74          2HB       ARG  74  -5.203  -0.804 -14.784
  547   1HG   ARG  74          1HG       ARG  74  -8.055  -0.570 -15.720
  548   2HG   ARG  74          2HG       ARG  74  -7.291   0.488 -14.529
  549   1HD   ARG  74          1HD       ARG  74  -5.669   1.222 -16.135
  550   2HD   ARG  74          2HD       ARG  74  -6.247   0.056 -17.318
  551    HE   ARG  74           HE       ARG  74  -8.434   1.591 -16.786
  552   1HH1  ARG  74          1HH1      ARG  74  -5.159   2.208 -17.828
  553   2HH1  ARG  74          2HH1      ARG  74  -5.563   3.631 -18.733
  554   1HH2  ARG  74          1HH2      ARG  74  -8.998   3.458 -17.991
  555   2HH2  ARG  74          2HH2      ARG  74  -7.760   4.352 -18.811
  556    H    ALA  75           H        ALA  75  -4.680  -3.637 -14.411
  557    HA   ALA  75           HA       ALA  75  -2.016  -2.880 -15.012
  558   1HB   ALA  75          1HB       ALA  75  -1.364  -4.647 -13.473
  559   2HB   ALA  75          2HB       ALA  75  -3.000  -5.305 -13.514
  560   3HB   ALA  75          3HB       ALA  75  -2.710  -3.710 -12.822
  561    H    GLY  76           H        GLY  76  -3.561  -6.071 -15.436
  562   1HA   GLY  76          1HA       GLY  76  -1.333  -6.885 -17.122
  563   2HA   GLY  76          2HA       GLY  76  -2.628  -7.917 -16.533
  564    H    HIS  77           H        HIS  77  -2.873  -4.861 -18.277
  565    HA   HIS  77           HA       HIS  77  -4.733  -5.999 -20.152
  566   1HB   HIS  77          1HB       HIS  77  -4.692  -3.584 -19.228
  567   2HB   HIS  77          2HB       HIS  77  -3.430  -3.295 -20.422
  568    HD1  HIS  77           HD1      HIS  77  -7.075  -3.749 -20.037
  569    HD2  HIS  77           HD2      HIS  77  -4.318  -3.405 -23.126
  570    HE1  HIS  77           HE1      HIS  77  -8.434  -3.323 -22.109
  571    HE2  HIS  77           HE2      HIS  77  -6.758  -3.365 -23.992
  572    H    ALA  78           H        ALA  78  -1.370  -5.107 -20.081
  573    HA   ALA  78           HA       ALA  78  -0.921  -6.715 -22.458
  574   1HB   ALA  78          1HB       ALA  78   0.484  -5.033 -23.533
  575   2HB   ALA  78          2HB       ALA  78   0.104  -3.882 -22.252
  576   3HB   ALA  78          3HB       ALA  78  -1.165  -4.440 -23.343
  577    H    ALA  79           H        ALA  79  -0.047  -8.141 -20.897
  578    HA   ALA  79           HA       ALA  79   2.703  -7.453 -20.134
  579   1HB   ALA  79          1HB       ALA  79   1.345  -7.022 -18.146
  580   2HB   ALA  79          2HB       ALA  79   2.413  -8.404 -17.901
  581   3HB   ALA  79          3HB       ALA  79   0.698  -8.660 -18.227
  582    H    THR  80           H        THR  80   0.213  -9.963 -20.289
  583    HA   THR  80           HA       THR  80   2.274 -11.929 -20.972
  584    HB   THR  80           HB       THR  80   0.184 -13.507 -20.745
  585    HG1  THR  80           HG1      THR  80  -1.546 -12.443 -20.147
  586   1HG2  THR  80          1HG2      THR  80   2.147 -13.584 -19.292
  587   2HG2  THR  80          2HG2      THR  80   0.667 -13.786 -18.354
  588   3HG2  THR  80          3HG2      THR  80   1.512 -12.238 -18.347
  Start of MODEL   19
    1    H    MET   1           H        MET   1   9.394   1.016  -1.491
    2    HA   MET   1           HA       MET   1   6.637   0.726  -0.460
    3   1HB   MET   1          1HB       MET   1   6.965   1.191  -2.944
    4   2HB   MET   1          2HB       MET   1   7.824  -0.337  -3.034
    5   1HG   MET   1          1HG       MET   1   5.038  -0.214  -1.954
    6   2HG   MET   1          2HG       MET   1   5.334  -0.239  -3.689
    7   1HE   MET   1          1HE       MET   1   4.110  -3.887  -2.934
    8   2HE   MET   1          2HE       MET   1   3.850  -2.440  -3.907
    9   3HE   MET   1          3HE       MET   1   3.553  -2.398  -2.169
   10    H    HIS   2           H        HIS   2   6.090  -1.359   0.198
   11    HA   HIS   2           HA       HIS   2   8.220  -3.340   0.374
   12   1HB   HIS   2          1HB       HIS   2   7.008  -1.924   2.685
   13   2HB   HIS   2          2HB       HIS   2   7.232  -3.663   2.854
   14    HD1  HIS   2           HD1      HIS   2   9.550  -4.468   3.383
   15    HD2  HIS   2           HD2      HIS   2   9.502  -0.508   2.133
   16    HE1  HIS   2           HE1      HIS   2  11.884  -3.620   3.746
   17    HE2  HIS   2           HE2      HIS   2  11.887  -1.349   2.661
   18    H    ALA   3           H        ALA   3   7.480  -5.484   0.566
   19    HA   ALA   3           HA       ALA   3   4.651  -5.797  -0.134
   20   1HB   ALA   3          1HB       ALA   3   6.939  -6.695  -1.882
   21   2HB   ALA   3          2HB       ALA   3   5.872  -5.330  -2.208
   22   3HB   ALA   3          3HB       ALA   3   5.222  -6.970  -2.188
   23    H    LYS   4           H        LYS   4   3.814  -7.812   0.161
   24    HA   LYS   4           HA       LYS   4   5.448  -9.809   1.556
   25   1HB   LYS   4          1HB       LYS   4   2.826  -8.773   2.654
   26   2HB   LYS   4          2HB       LYS   4   3.937  -9.892   3.425
   27   1HG   LYS   4          1HG       LYS   4   4.701  -7.063   2.798
   28   2HG   LYS   4          2HG       LYS   4   3.879  -7.511   4.291
   29   1HD   LYS   4          1HD       LYS   4   5.708  -9.049   4.831
   30   2HD   LYS   4          2HD       LYS   4   6.526  -8.593   3.333
   31   1HE   LYS   4          1HE       LYS   4   7.382  -7.419   5.362
   32   2HE   LYS   4          2HE       LYS   4   6.815  -6.346   4.085
   33   1HZ   LYS   4          1HZ       LYS   4   5.290  -7.094   6.532
   34   2HZ   LYS   4          2HZ       LYS   4   4.727  -6.082   5.296
   35   3HZ   LYS   4          3HZ       LYS   4   6.042  -5.603   6.243
   36    H    VAL   5           H        VAL   5   4.705 -11.890   1.230
   37    HA   VAL   5           HA       VAL   5   2.756 -12.340  -0.817
   38    HB   VAL   5           HB       VAL   5   4.271 -14.150   1.071
   39   1HG1  VAL   5          1HG1      VAL   5   3.374 -16.098  -0.106
   40   2HG1  VAL   5          2HG1      VAL   5   2.296 -15.053  -1.030
   41   3HG1  VAL   5          3HG1      VAL   5   2.090 -15.210   0.714
   42   1HG2  VAL   5          1HG2      VAL   5   4.339 -13.804  -1.911
   43   2HG2  VAL   5          2HG2      VAL   5   5.331 -14.926  -0.981
   44   3HG2  VAL   5          3HG2      VAL   5   5.519 -13.188  -0.755
   45    H    GLY   6           H        GLY   6   0.642 -12.980  -0.691
   46   1HA   GLY   6          1HA       GLY   6  -1.391 -13.558   0.387
   47   2HA   GLY   6          2HA       GLY   6  -0.593 -13.358   1.946
   48    H    ASP   7           H        ASP   7  -0.008 -11.107  -0.434
   49    HA   ASP   7           HA       ASP   7  -1.692  -8.991   0.825
   50   1HB   ASP   7          1HB       ASP   7   1.344  -9.060   0.793
   51   2HB   ASP   7          2HB       ASP   7   0.470  -7.533   0.779
   52    H    TYR   8           H        TYR   8  -1.699  -7.025  -0.573
   53    HA   TYR   8           HA       TYR   8  -2.055  -8.026  -3.334
   54   1HB   TYR   8          1HB       TYR   8  -4.104  -6.876  -1.392
   55   2HB   TYR   8          2HB       TYR   8  -4.370  -6.971  -3.115
   56    HD1  TYR   8           HD1      TYR   8  -4.374  -8.817   0.046
   57    HD2  TYR   8           HD2      TYR   8  -4.926  -9.060  -4.162
   58    HE1  TYR   8           HE1      TYR   8  -5.668 -10.901   0.323
   59    HE2  TYR   8           HE2      TYR   8  -6.201 -11.144  -3.891
   60    HH   TYR   8           HH       TYR   8  -6.271 -13.027  -2.027
   61    H    LEU   9           H        LEU   9  -2.402  -6.102  -4.754
   62    HA   LEU   9           HA       LEU   9  -0.988  -3.815  -3.543
   63   1HB   LEU   9          1HB       LEU   9   0.683  -5.443  -4.186
   64   2HB   LEU   9          2HB       LEU   9  -0.095  -5.721  -5.719
   65    HG   LEU   9           HG       LEU   9   1.405  -3.185  -4.987
   66   1HD1  LEU   9          1HD1      LEU   9   2.195  -5.521  -6.718
   67   2HD1  LEU   9          2HD1      LEU   9   2.852  -5.159  -5.122
   68   3HD1  LEU   9          3HD1      LEU   9   3.133  -4.051  -6.465
   69   1HD2  LEU   9          1HD2      LEU   9   1.346  -2.707  -7.379
   70   2HD2  LEU   9          2HD2      LEU   9  -0.294  -2.821  -6.738
   71   3HD2  LEU   9          3HD2      LEU   9   0.389  -4.160  -7.661
   72    H    VAL  10           H        VAL  10  -1.129  -1.998  -4.614
   73    HA   VAL  10           HA       VAL  10  -3.037  -1.696  -6.817
   74    HB   VAL  10           HB       VAL  10  -3.270  -0.041  -4.310
   75   1HG1  VAL  10          1HG1      VAL  10  -5.172  -0.630  -6.565
   76   2HG1  VAL  10          2HG1      VAL  10  -4.290   0.872  -6.284
   77   3HG1  VAL  10          3HG1      VAL  10  -5.542   0.361  -5.154
   78   1HG2  VAL  10          1HG2      VAL  10  -3.622  -2.329  -3.584
   79   2HG2  VAL  10          2HG2      VAL  10  -4.809  -2.570  -4.865
   80   3HG2  VAL  10          3HG2      VAL  10  -5.138  -1.426  -3.562
   81    H    VAL  11           H        VAL  11  -2.578   0.127  -8.058
   82    HA   VAL  11           HA       VAL  11  -0.732   2.121  -6.963
   83    HB   VAL  11           HB       VAL  11   0.637   2.230  -8.928
   84   1HG1  VAL  11          1HG1      VAL  11   0.396  -0.626  -8.002
   85   2HG1  VAL  11          2HG1      VAL  11   1.374   0.643  -7.262
   86   3HG1  VAL  11          3HG1      VAL  11   1.767   0.055  -8.877
   87   1HG2  VAL  11          1HG2      VAL  11  -1.004   1.689 -10.613
   88   2HG2  VAL  11          2HG2      VAL  11  -1.057   0.016 -10.055
   89   3HG2  VAL  11          3HG2      VAL  11   0.416   0.656 -10.786
   90    H    LYS  12           H        LYS  12  -1.120   4.176  -7.599
   91    HA   LYS  12           HA       LYS  12  -3.583   4.944  -8.682
   92   1HB   LYS  12          1HB       LYS  12  -2.224   6.463  -7.334
   93   2HB   LYS  12          2HB       LYS  12  -0.965   6.465  -8.559
   94   1HG   LYS  12          1HG       LYS  12  -2.619   7.493 -10.131
   95   2HG   LYS  12          2HG       LYS  12  -3.724   7.645  -8.767
   96   1HD   LYS  12          1HD       LYS  12  -0.947   8.778  -8.652
   97   2HD   LYS  12          2HD       LYS  12  -2.264   9.670  -9.406
   98   1HE   LYS  12          1HE       LYS  12  -2.120  10.443  -7.178
   99   2HE   LYS  12          2HE       LYS  12  -3.538   9.404  -7.254
  100   1HZ   LYS  12          1HZ       LYS  12  -2.223   9.026  -5.256
  101   2HZ   LYS  12          2HZ       LYS  12  -0.873   8.604  -6.196
  102   3HZ   LYS  12          3HZ       LYS  12  -2.262   7.638  -6.228
  103    H    GLY  13           H        GLY  13  -4.231   4.326 -10.664
  104   1HA   GLY  13          1HA       GLY  13  -2.323   3.889 -12.788
  105   2HA   GLY  13          2HA       GLY  13  -4.052   3.593 -12.859
  106    H    THR  14           H        THR  14  -1.875   6.384 -12.488
  107    HA   THR  14           HA       THR  14  -1.728   8.380 -13.563
  108    HB   THR  14           HB       THR  14  -3.430   7.300 -15.805
  109    HG1  THR  14           HG1      THR  14  -0.648   6.789 -15.345
  110   1HG2  THR  14          1HG2      THR  14  -1.887   8.633 -17.184
  111   2HG2  THR  14          2HG2      THR  14  -1.021   9.129 -15.729
  112   3HG2  THR  14          3HG2      THR  14  -2.695   9.630 -15.974
  113    H    THR  15           H        THR  15  -4.215   7.469 -11.993
  114    HA   THR  15           HA       THR  15  -5.552   9.997 -12.149
  115    HB   THR  15           HB       THR  15  -6.752   8.830 -13.943
  116    HG1  THR  15           HG1      THR  15  -7.848  10.106 -12.031
  117   1HG2  THR  15          1HG2      THR  15  -7.448   6.776 -11.841
  118   2HG2  THR  15          2HG2      THR  15  -6.403   6.523 -13.237
  119   3HG2  THR  15          3HG2      THR  15  -8.120   6.848 -13.472
  120    H    THR  16           H        THR  16  -6.568  10.485 -10.237
  121    HA   THR  16           HA       THR  16  -6.149   8.521  -8.105
  122    HB   THR  16           HB       THR  16  -4.993  10.605  -7.734
  123    HG1  THR  16           HG1      THR  16  -7.280  10.447  -6.035
  124   1HG2  THR  16          1HG2      THR  16  -6.192  12.734  -7.443
  125   2HG2  THR  16          2HG2      THR  16  -7.690  11.951  -7.947
  126   3HG2  THR  16          3HG2      THR  16  -6.348  12.106  -9.082
  127    H    GLU  17           H        GLU  17  -8.306   8.020  -9.688
  128    HA   GLU  17           HA       GLU  17 -10.543   8.630  -7.873
  129   1HB   GLU  17          1HB       GLU  17 -10.769   9.378 -10.291
  130   2HB   GLU  17          2HB       GLU  17 -10.764   7.679 -10.737
  131   1HG   GLU  17          1HG       GLU  17 -12.755   8.790  -8.791
  132   2HG   GLU  17          2HG       GLU  17 -13.013   8.876 -10.530
  133    H    ARG  18           H        ARG  18  -9.803   6.107 -10.267
  134    HA   ARG  18           HA       ARG  18 -10.632   4.096  -8.332
  135   1HB   ARG  18          1HB       ARG  18 -11.031   4.298 -11.032
  136   2HB   ARG  18          2HB       ARG  18  -9.660   3.201 -10.964
  137   1HG   ARG  18          1HG       ARG  18 -11.748   1.969 -11.020
  138   2HG   ARG  18          2HG       ARG  18 -10.922   1.720  -9.478
  139   1HD   ARG  18          1HD       ARG  18 -12.363   3.356  -8.416
  140   2HD   ARG  18          2HD       ARG  18 -13.147   3.696  -9.956
  141    HE   ARG  18           HE       ARG  18 -13.362   0.937  -9.329
  142   1HH1  ARG  18          1HH1      ARG  18 -14.619   4.076  -8.397
  143   2HH1  ARG  18          2HH1      ARG  18 -16.152   3.448  -7.880
  144   1HH2  ARG  18          1HH2      ARG  18 -15.409   0.119  -8.655
  145   2HH2  ARG  18          2HH2      ARG  18 -16.598   1.223  -8.021
  146    H    HIS  19           H        HIS  19  -9.071   3.588  -6.923
  147    HA   HIS  19           HA       HIS  19  -6.302   3.473  -7.487
  148   1HB   HIS  19          1HB       HIS  19  -7.966   2.052  -5.387
  149   2HB   HIS  19          2HB       HIS  19  -6.206   2.005  -5.437
  150    HD1  HIS  19           HD1      HIS  19  -9.032   4.017  -4.232
  151    HD2  HIS  19           HD2      HIS  19  -4.979   4.590  -4.990
  152    HE1  HIS  19           HE1      HIS  19  -8.414   6.153  -3.056
  153    HE2  HIS  19           HE2      HIS  19  -5.985   6.537  -3.624
  154    H    ASP  20           H        ASP  20  -5.269   2.057  -8.825
  155    HA   ASP  20           HA       ASP  20  -6.939  -0.195  -9.728
  156   1HB   ASP  20          1HB       ASP  20  -6.760   2.039 -11.120
  157   2HB   ASP  20          2HB       ASP  20  -5.239   1.328 -11.650
  158    H    GLN  21           H        GLN  21  -5.252  -1.170 -11.692
  159    HA   GLN  21           HA       GLN  21  -3.847  -2.954 -11.782
  160   1HB   GLN  21          1HB       GLN  21  -2.000  -0.864 -10.627
  161   2HB   GLN  21          2HB       GLN  21  -1.468  -2.377 -11.351
  162   1HG   GLN  21          1HG       GLN  21  -2.583  -1.685 -13.465
  163   2HG   GLN  21          2HG       GLN  21  -2.921  -0.125 -12.720
  164   1HE2  GLN  21          1HE2      GLN  21  -1.696   0.956 -14.277
  165   2HE2  GLN  21          2HE2      GLN  21   0.029   0.907 -14.279
  166    H    HIS  22           H        HIS  22  -4.600  -4.554 -10.417
  167    HA   HIS  22           HA       HIS  22  -3.547  -4.557  -7.684
  168   1HB   HIS  22          1HB       HIS  22  -5.782  -3.467  -7.653
  169   2HB   HIS  22          2HB       HIS  22  -6.479  -4.948  -8.294
  170    HD1  HIS  22           HD1      HIS  22  -5.640  -7.140  -6.605
  171    HD2  HIS  22           HD2      HIS  22  -6.182  -3.340  -5.012
  172    HE1  HIS  22           HE1      HIS  22  -5.959  -7.477  -4.149
  173    HE2  HIS  22           HE2      HIS  22  -6.185  -5.165  -3.189
  174    H    ALA  23           H        ALA  23  -2.608  -6.308  -7.359
  175    HA   ALA  23           HA       ALA  23  -3.824  -8.948  -8.003
  176   1HB   ALA  23          1HB       ALA  23  -2.274  -8.503  -9.879
  177   2HB   ALA  23          2HB       ALA  23  -1.746  -9.850  -8.873
  178   3HB   ALA  23          3HB       ALA  23  -0.956  -8.280  -8.729
  179    H    GLU  24           H        GLU  24  -2.206 -10.616  -6.982
  180    HA   GLU  24           HA       GLU  24  -1.447  -9.594  -4.320
  181   1HB   GLU  24          1HB       GLU  24  -3.728 -10.617  -4.257
  182   2HB   GLU  24          2HB       GLU  24  -3.022 -12.127  -4.804
  183   1HG   GLU  24          1HG       GLU  24  -1.776 -10.972  -2.410
  184   2HG   GLU  24          2HG       GLU  24  -3.454 -11.465  -2.215
  185    H    ILE  25           H        ILE  25   0.419 -10.194  -3.735
  186    HA   ILE  25           HA       ILE  25   1.951 -11.924  -5.439
  187    HB   ILE  25           HB       ILE  25   3.699 -11.284  -3.497
  188   1HG1  ILE  25          1HG1      ILE  25   1.608  -9.104  -3.505
  189   2HG1  ILE  25          2HG1      ILE  25   2.170 -10.038  -2.124
  190   1HG2  ILE  25          1HG2      ILE  25   4.392  -9.416  -4.937
  191   2HG2  ILE  25          2HG2      ILE  25   2.861  -9.548  -5.807
  192   3HG2  ILE  25          3HG2      ILE  25   4.017 -10.880  -5.847
  193   1HD1  ILE  25          1HD1      ILE  25   3.075  -7.796  -2.091
  194   2HD1  ILE  25          2HD1      ILE  25   3.784  -8.041  -3.687
  195   3HD1  ILE  25          3HD1      ILE  25   4.362  -8.981  -2.310
  196    H    ILE  26           H        ILE  26   1.811 -13.968  -5.207
  197    HA   ILE  26           HA       ILE  26   1.906 -15.191  -2.552
  198    HB   ILE  26           HB       ILE  26   1.467 -17.312  -3.590
  199   1HG1  ILE  26          1HG1      ILE  26   2.901 -16.827  -5.661
  200   2HG1  ILE  26          2HG1      ILE  26   1.423 -17.733  -5.942
  201   1HG2  ILE  26          1HG2      ILE  26  -0.492 -15.881  -3.262
  202   2HG2  ILE  26          2HG2      ILE  26  -0.701 -16.882  -4.699
  203   3HG2  ILE  26          3HG2      ILE  26  -0.276 -15.179  -4.866
  204   1HD1  ILE  26          1HD1      ILE  26   1.825 -14.801  -6.471
  205   2HD1  ILE  26          2HD1      ILE  26   0.337 -15.706  -6.753
  206   3HD1  ILE  26          3HD1      ILE  26   1.792 -16.090  -7.674
  207    H    GLU  27           H        GLU  27   3.833 -14.036  -4.971
  208    HA   GLU  27           HA       GLU  27   6.170 -15.392  -3.870
  209   1HB   GLU  27          1HB       GLU  27   5.229 -16.182  -6.276
  210   2HB   GLU  27          2HB       GLU  27   6.216 -14.820  -6.787
  211   1HG   GLU  27          1HG       GLU  27   7.139 -17.232  -5.241
  212   2HG   GLU  27          2HG       GLU  27   7.472 -16.874  -6.932
  213    H    VAL  28           H        VAL  28   7.740 -13.999  -3.413
  214    HA   VAL  28           HA       VAL  28   7.516 -11.241  -4.357
  215    HB   VAL  28           HB       VAL  28   7.504 -12.105  -1.460
  216   1HG1  VAL  28          1HG1      VAL  28   9.099 -10.276  -1.733
  217   2HG1  VAL  28          2HG1      VAL  28   7.660  -9.740  -0.867
  218   3HG1  VAL  28          3HG1      VAL  28   7.873  -9.322  -2.567
  219   1HG2  VAL  28          1HG2      VAL  28   5.624 -10.379  -3.061
  220   2HG2  VAL  28          2HG2      VAL  28   5.482 -10.737  -1.338
  221   3HG2  VAL  28          3HG2      VAL  28   5.322 -12.032  -2.525
  222    H    ARG  29           H        ARG  29   9.434 -11.193  -5.359
  223    HA   ARG  29           HA       ARG  29  11.799 -12.287  -4.020
  224   1HB   ARG  29          1HB       ARG  29  12.814 -12.123  -6.333
  225   2HB   ARG  29          2HB       ARG  29  11.510 -13.285  -6.149
  226   1HG   ARG  29          1HG       ARG  29   9.975 -11.468  -7.059
  227   2HG   ARG  29          2HG       ARG  29  11.453 -10.619  -7.523
  228   1HD   ARG  29          1HD       ARG  29  10.571 -11.954  -9.376
  229   2HD   ARG  29          2HD       ARG  29  12.151 -12.539  -8.854
  230    HE   ARG  29           HE       ARG  29  10.172 -13.970  -7.465
  231   1HH1  ARG  29          1HH1      ARG  29  11.333 -13.635 -10.769
  232   2HH1  ARG  29          2HH1      ARG  29  10.958 -15.284 -11.185
  233   1HH2  ARG  29          1HH2      ARG  29   9.673 -16.077  -8.007
  234   2HH2  ARG  29          2HH2      ARG  29  10.009 -16.687  -9.606
  235    H    SER  30           H        SER  30  10.389  -9.660  -3.672
  236    HA   SER  30           HA       SER  30  12.647  -7.869  -4.215
  237   1HB   SER  30          1HB       SER  30   9.864  -7.049  -3.375
  238   2HB   SER  30          2HB       SER  30  11.102  -6.063  -4.159
  239    HG   SER  30           HG       SER  30  10.416  -6.744  -6.026
  240    H    ALA  31           H        ALA  31  13.975  -7.753  -2.498
  241    HA   ALA  31           HA       ALA  31  13.259  -8.563   0.115
  242   1HB   ALA  31          1HB       ALA  31  15.562  -8.618  -0.668
  243   2HB   ALA  31          2HB       ALA  31  15.429  -7.629   0.785
  244   3HB   ALA  31          3HB       ALA  31  15.577  -6.860  -0.793
  245    H    ASP  32           H        ASP  32  13.453  -5.427  -1.445
  246    HA   ASP  32           HA       ASP  32  12.517  -4.103   0.982
  247   1HB   ASP  32          1HB       ASP  32  14.362  -3.037  -0.259
  248   2HB   ASP  32          2HB       ASP  32  13.341  -2.937  -1.690
  249    H    GLY  33           H        GLY  33  11.659  -4.310  -2.461
  250   1HA   GLY  33          1HA       GLY  33   9.127  -4.775  -2.674
  251   2HA   GLY  33          2HA       GLY  33   8.999  -3.262  -1.783
  252    H    SER  34           H        SER  34  10.523  -4.634  -4.669
  253    HA   SER  34           HA       SER  34   9.615  -2.376  -6.240
  254   1HB   SER  34          1HB       SER  34  11.863  -1.727  -5.310
  255   2HB   SER  34          2HB       SER  34  12.553  -3.114  -6.147
  256    HG   SER  34           HG       SER  34  12.306  -0.752  -7.126
  257    HA   PRO  35           HA       PRO  35   8.743  -5.529  -9.184
  258   1HB   PRO  35          1HB       PRO  35   9.550  -4.128 -11.479
  259   2HB   PRO  35          2HB       PRO  35   7.940  -4.120 -10.757
  260   1HG   PRO  35          1HG       PRO  35  10.159  -2.151 -10.463
  261   2HG   PRO  35          2HG       PRO  35   8.408  -1.875 -10.533
  262   1HD   PRO  35          1HD       PRO  35   9.726  -1.741  -8.217
  263   2HD   PRO  35          2HD       PRO  35   8.104  -2.462  -8.301
  264    HA   PRO  36           HA       PRO  36   8.644  -6.646 -11.012
  265   1HB   PRO  36          1HB       PRO  36   8.996  -9.196 -11.689
  266   2HB   PRO  36          2HB       PRO  36   9.650  -7.893 -12.692
  267   1HG   PRO  36          1HG       PRO  36  11.044  -9.645 -10.713
  268   2HG   PRO  36          2HG       PRO  36  11.597  -9.095 -12.305
  269   1HD   PRO  36          1HD       PRO  36  12.318  -7.956  -9.885
  270   2HD   PRO  36          2HD       PRO  36  12.415  -7.149 -11.461
  271    H    TYR  37           H        TYR  37   7.217  -8.605 -10.559
  272    HA   TYR  37           HA       TYR  37   7.605  -9.807  -7.912
  273   1HB   TYR  37          1HB       TYR  37   5.159  -8.318  -8.868
  274   2HB   TYR  37          2HB       TYR  37   5.138  -9.438  -7.512
  275    HD1  TYR  37           HD1      TYR  37   5.758  -6.075  -8.562
  276    HD2  TYR  37           HD2      TYR  37   6.630  -8.913  -5.521
  277    HE1  TYR  37           HE1      TYR  37   6.407  -4.245  -7.049
  278    HE2  TYR  37           HE2      TYR  37   7.277  -7.097  -4.001
  279    HH   TYR  37           HH       TYR  37   6.564  -3.874  -4.564
  280    H    VAL  38           H        VAL  38   5.916 -11.617  -7.633
  281    HA   VAL  38           HA       VAL  38   4.867 -12.512 -10.222
  282    HB   VAL  38           HB       VAL  38   6.362 -14.336  -8.314
  283   1HG1  VAL  38          1HG1      VAL  38   4.690 -15.036 -10.741
  284   2HG1  VAL  38          2HG1      VAL  38   4.244 -15.357  -9.065
  285   3HG1  VAL  38          3HG1      VAL  38   5.637 -16.172  -9.780
  286   1HG2  VAL  38          1HG2      VAL  38   6.752 -13.700 -11.243
  287   2HG2  VAL  38          2HG2      VAL  38   7.691 -14.871 -10.316
  288   3HG2  VAL  38          3HG2      VAL  38   7.783 -13.154  -9.920
  289    H    VAL  39           H        VAL  39   2.857 -12.962 -10.059
  290    HA   VAL  39           HA       VAL  39   1.726 -12.463  -7.421
  291    HB   VAL  39           HB       VAL  39   2.628 -10.441  -8.994
  292   1HG1  VAL  39          1HG1      VAL  39   0.752  -9.339 -10.084
  293   2HG1  VAL  39          2HG1      VAL  39  -0.254 -10.751  -9.766
  294   3HG1  VAL  39          3HG1      VAL  39   1.149 -10.888 -10.825
  295   1HG2  VAL  39          1HG2      VAL  39   0.233 -10.311  -7.198
  296   2HG2  VAL  39          2HG2      VAL  39   1.185  -8.931  -7.748
  297   3HG2  VAL  39          3HG2      VAL  39   1.926 -10.164  -6.728
  298    H    ARG  40           H        ARG  40  -0.718 -12.348  -7.701
  299    HA   ARG  40           HA       ARG  40  -1.531 -14.051  -9.933
  300   1HB   ARG  40          1HB       ARG  40  -0.845 -15.419  -7.951
  301   2HB   ARG  40          2HB       ARG  40  -2.119 -14.642  -7.030
  302   1HG   ARG  40          1HG       ARG  40  -3.801 -15.635  -8.430
  303   2HG   ARG  40          2HG       ARG  40  -2.562 -16.299  -9.499
  304   1HD   ARG  40          1HD       ARG  40  -1.723 -17.705  -7.730
  305   2HD   ARG  40          2HD       ARG  40  -2.830 -16.971  -6.572
  306    HE   ARG  40           HE       ARG  40  -4.604 -17.924  -8.186
  307   1HH1  ARG  40          1HH1      ARG  40  -1.553 -19.446  -7.381
  308   2HH1  ARG  40          2HH1      ARG  40  -2.144 -21.062  -7.633
  309   1HH2  ARG  40          1HH2      ARG  40  -5.400 -20.013  -8.478
  310   2HH2  ARG  40          2HH2      ARG  40  -4.356 -21.389  -8.246
  311    H    TRP  41           H        TRP  41  -3.346 -13.388 -10.784
  312    HA   TRP  41           HA       TRP  41  -4.906 -11.384  -9.397
  313   1HB   TRP  41          1HB       TRP  41  -4.814 -12.382 -12.225
  314   2HB   TRP  41          2HB       TRP  41  -6.228 -11.494 -11.652
  315    HD1  TRP  41           HD1      TRP  41  -5.156  -9.234 -10.048
  316    HE1  TRP  41           HE1      TRP  41  -3.674  -7.384 -11.008
  317    HE3  TRP  41           HE3      TRP  41  -3.286 -11.745 -14.050
  318    HZ2  TRP  41           HZ2      TRP  41  -1.901  -7.043 -13.162
  319    HZ3  TRP  41           HZ3      TRP  41  -1.670 -10.585 -15.474
  320    HH2  TRP  41           HH2      TRP  41  -0.997  -8.290 -15.066
  321    H    LEU  42           H        LEU  42  -5.766 -12.471  -7.791
  322    HA   LEU  42           HA       LEU  42  -6.501 -15.186  -7.889
  323   1HB   LEU  42          1HB       LEU  42  -7.646 -13.292  -5.881
  324   2HB   LEU  42          2HB       LEU  42  -7.168 -14.965  -5.672
  325    HG   LEU  42           HG       LEU  42  -5.349 -12.579  -5.937
  326   1HD1  LEU  42          1HD1      LEU  42  -4.656 -13.255  -3.703
  327   2HD1  LEU  42          2HD1      LEU  42  -5.889 -14.516  -3.717
  328   3HD1  LEU  42          3HD1      LEU  42  -6.361 -12.818  -3.783
  329   1HD2  LEU  42          1HD2      LEU  42  -4.373 -14.473  -7.114
  330   2HD2  LEU  42          2HD2      LEU  42  -4.619 -15.489  -5.693
  331   3HD2  LEU  42          3HD2      LEU  42  -3.503 -14.124  -5.620
  332    H    VAL  43           H        VAL  43  -8.629 -12.381  -7.401
  333    HA   VAL  43           HA       VAL  43 -10.984 -13.867  -7.592
  334    HB   VAL  43           HB       VAL  43 -11.947 -11.470  -8.139
  335   1HG1  VAL  43          1HG1      VAL  43 -11.967 -11.043  -5.729
  336   2HG1  VAL  43          2HG1      VAL  43 -10.679 -12.230  -5.520
  337   3HG1  VAL  43          3HG1      VAL  43 -12.270 -12.746  -6.079
  338   1HG2  VAL  43          1HG2      VAL  43 -10.552  -9.708  -7.197
  339   2HG2  VAL  43          2HG2      VAL  43  -9.757 -10.446  -8.587
  340   3HG2  VAL  43          3HG2      VAL  43  -9.247 -10.866  -6.953
  341    H    ASN  44           H        ASN  44  -9.103 -12.187 -10.043
  342    HA   ASN  44           HA       ASN  44 -10.810 -12.690 -12.203
  343   1HB   ASN  44          1HB       ASN  44  -7.828 -12.389 -12.011
  344   2HB   ASN  44          2HB       ASN  44  -8.590 -12.809 -13.540
  345   1HD2  ASN  44          1HD2      ASN  44 -10.047 -10.713 -11.145
  346   2HD2  ASN  44          2HD2      ASN  44  -9.936  -9.267 -12.072
  347    H    GLY  45           H        GLY  45  -7.925 -14.565 -11.273
  348   1HA   GLY  45          1HA       GLY  45  -8.242 -16.994 -10.904
  349   2HA   GLY  45          2HA       GLY  45  -9.258 -16.979 -12.337
  350    H    HIS  46           H        HIS  46  -6.132 -15.339 -11.893
  351    HA   HIS  46           HA       HIS  46  -4.890 -17.243 -13.745
  352   1HB   HIS  46          1HB       HIS  46  -5.862 -15.176 -14.941
  353   2HB   HIS  46          2HB       HIS  46  -4.566 -14.276 -14.166
  354    HD1  HIS  46           HD1      HIS  46  -4.984 -17.265 -16.486
  355    HD2  HIS  46           HD2      HIS  46  -2.254 -14.252 -15.593
  356    HE1  HIS  46           HE1      HIS  46  -3.137 -17.495 -18.179
  357    HE2  HIS  46           HE2      HIS  46  -1.655 -15.494 -17.784
  358    H    GLU  47           H        GLU  47  -2.446 -16.728 -13.930
  359    HA   GLU  47           HA       GLU  47  -1.355 -15.611 -11.437
  360   1HB   GLU  47          1HB       GLU  47  -0.351 -18.209 -12.612
  361   2HB   GLU  47          2HB       GLU  47   0.108 -17.480 -11.084
  362   1HG   GLU  47          1HG       GLU  47  -1.277 -19.058 -10.282
  363   2HG   GLU  47          2HG       GLU  47  -2.494 -17.824 -10.612
  364    H    THR  48           H        THR  48   0.467 -14.435 -11.761
  365    HA   THR  48           HA       THR  48   1.531 -14.336 -14.481
  366    HB   THR  48           HB       THR  48  -0.390 -12.940 -14.518
  367    HG1  THR  48           HG1      THR  48   1.218 -10.796 -14.463
  368   1HG2  THR  48          1HG2      THR  48  -0.659 -10.960 -13.088
  369   2HG2  THR  48          2HG2      THR  48   0.773 -11.444 -12.181
  370   3HG2  THR  48          3HG2      THR  48  -0.667 -12.462 -12.159
  371    H    THR  49           H        THR  49   3.064 -12.370 -14.620
  372    HA   THR  49           HA       THR  49   4.618 -11.883 -12.183
  373    HB   THR  49           HB       THR  49   5.805 -12.639 -14.877
  374    HG1  THR  49           HG1      THR  49   5.054 -14.141 -12.762
  375   1HG2  THR  49          1HG2      THR  49   7.978 -12.515 -13.757
  376   2HG2  THR  49          2HG2      THR  49   7.189 -12.004 -12.265
  377   3HG2  THR  49          3HG2      THR  49   7.150 -10.959 -13.685
  378    H    VAL  50           H        VAL  50   4.973  -9.651 -12.041
  379    HA   VAL  50           HA       VAL  50   4.154  -8.117 -14.419
  380    HB   VAL  50           HB       VAL  50   2.163  -8.848 -13.002
  381   1HG1  VAL  50          1HG1      VAL  50   1.656  -7.483 -11.029
  382   2HG1  VAL  50          2HG1      VAL  50   3.259  -6.752 -11.137
  383   3HG1  VAL  50          3HG1      VAL  50   3.096  -8.477 -10.805
  384   1HG2  VAL  50          1HG2      VAL  50   1.006  -6.702 -13.257
  385   2HG2  VAL  50          2HG2      VAL  50   1.980  -7.095 -14.674
  386   3HG2  VAL  50          3HG2      VAL  50   2.556  -5.900 -13.512
  387    H    TYR  51           H        TYR  51   4.063  -5.724 -13.884
  388    HA   TYR  51           HA       TYR  51   6.093  -4.855 -11.958
  389   1HB   TYR  51          1HB       TYR  51   5.978  -3.911 -14.843
  390   2HB   TYR  51          2HB       TYR  51   7.138  -3.408 -13.625
  391    HD1  TYR  51           HD1      TYR  51   9.142  -4.611 -13.296
  392    HD2  TYR  51           HD2      TYR  51   6.061  -6.283 -15.708
  393    HE1  TYR  51           HE1      TYR  51  10.697  -6.350 -14.076
  394    HE2  TYR  51           HE2      TYR  51   7.603  -8.026 -16.485
  395    HH   TYR  51           HH       TYR  51  10.747  -8.477 -15.065
  396    HA   PRO  52           HA       PRO  52   2.251  -2.404 -11.388
  397   1HB   PRO  52          1HB       PRO  52   3.826  -1.460  -9.068
  398   2HB   PRO  52          2HB       PRO  52   2.198  -2.141  -9.125
  399   1HG   PRO  52          1HG       PRO  52   4.238  -3.556  -8.157
  400   2HG   PRO  52          2HG       PRO  52   2.972  -4.328  -9.130
  401   1HD   PRO  52          1HD       PRO  52   5.739  -3.506  -9.927
  402   2HD   PRO  52          2HD       PRO  52   4.833  -4.975 -10.351
  403    H    GLY  53           H        GLY  53   1.806  -0.115 -11.202
  404   1HA   GLY  53          1HA       GLY  53   3.751   1.465 -12.660
  405   2HA   GLY  53          2HA       GLY  53   2.101   1.931 -12.276
  406    H    SER  54           H        SER  54   2.254   3.816 -11.261
  407    HA   SER  54           HA       SER  54   4.353   4.212  -9.261
  408   1HB   SER  54          1HB       SER  54   4.180   5.929 -11.013
  409   2HB   SER  54          2HB       SER  54   2.492   6.208 -10.586
  410    HG   SER  54           HG       SER  54   3.078   7.193  -8.754
  411    H    ASP  55           H        ASP  55   3.753   5.322  -7.251
  412    HA   ASP  55           HA       ASP  55   2.566   5.529  -5.322
  413   1HB   ASP  55          1HB       ASP  55   0.193   5.467  -7.204
  414   2HB   ASP  55          2HB       ASP  55   0.112   5.901  -5.500
  415    H    ALA  56           H        ALA  56   3.490   3.093  -5.765
  416    HA   ALA  56           HA       ALA  56   1.517   1.042  -5.760
  417   1HB   ALA  56          1HB       ALA  56   3.350  -0.498  -5.416
  418   2HB   ALA  56          2HB       ALA  56   4.434   0.835  -5.021
  419   3HB   ALA  56          3HB       ALA  56   3.780   0.684  -6.652
  420    H    VAL  57           H        VAL  57   0.492   0.124  -4.129
  421    HA   VAL  57           HA       VAL  57   1.356   0.578  -1.354
  422    HB   VAL  57           HB       VAL  57  -0.954   1.074  -0.665
  423   1HG1  VAL  57          1HG1      VAL  57   0.589   2.920  -0.993
  424   2HG1  VAL  57          2HG1      VAL  57  -1.047   3.394  -1.458
  425   3HG1  VAL  57          3HG1      VAL  57   0.148   3.010  -2.699
  426   1HG2  VAL  57          1HG2      VAL  57  -1.521   1.274  -3.620
  427   2HG2  VAL  57          2HG2      VAL  57  -2.627   1.737  -2.328
  428   3HG2  VAL  57          3HG2      VAL  57  -2.150   0.049  -2.518
  429    H    VAL  58           H        VAL  58  -0.386  -0.615   0.044
  430    HA   VAL  58           HA       VAL  58  -0.786  -3.298  -1.083
  431    HB   VAL  58           HB       VAL  58   0.644  -2.753   1.532
  432   1HG1  VAL  58          1HG1      VAL  58  -0.725  -4.742   1.693
  433   2HG1  VAL  58          2HG1      VAL  58   0.978  -5.194   1.604
  434   3HG1  VAL  58          3HG1      VAL  58  -0.055  -5.358   0.183
  435   1HG2  VAL  58          1HG2      VAL  58   2.080  -2.326  -0.391
  436   2HG2  VAL  58          2HG2      VAL  58   1.695  -3.918  -1.042
  437   3HG2  VAL  58          3HG2      VAL  58   2.592  -3.778   0.470
  438    H    VAL  59           H        VAL  59  -2.519  -4.315  -0.380
  439    HA   VAL  59           HA       VAL  59  -4.121  -3.326   1.809
  440    HB   VAL  59           HB       VAL  59  -6.003  -3.792   0.259
  441   1HG1  VAL  59          1HG1      VAL  59  -4.156  -1.599  -0.590
  442   2HG1  VAL  59          2HG1      VAL  59  -5.362  -1.497   0.694
  443   3HG1  VAL  59          3HG1      VAL  59  -5.872  -1.681  -0.984
  444   1HG2  VAL  59          1HG2      VAL  59  -4.885  -5.186  -1.348
  445   2HG2  VAL  59          2HG2      VAL  59  -3.896  -3.812  -1.845
  446   3HG2  VAL  59          3HG2      VAL  59  -5.633  -3.799  -2.140
  447    H    THR  60           H        THR  60  -5.989  -4.986   2.015
  448    HA   THR  60           HA       THR  60  -4.802  -7.704   2.037
  449    HB   THR  60           HB       THR  60  -6.938  -7.802   3.770
  450    HG1  THR  60           HG1      THR  60  -6.514  -5.172   3.337
  451   1HG2  THR  60          1HG2      THR  60  -5.327  -7.523   5.572
  452   2HG2  THR  60          2HG2      THR  60  -4.172  -6.832   4.431
  453   3HG2  THR  60          3HG2      THR  60  -4.673  -8.516   4.269
  454    H    ALA  61           H        ALA  61  -7.141  -9.121   2.594
  455    HA   ALA  61           HA       ALA  61  -8.012  -9.820   0.079
  456   1HB   ALA  61          1HB       ALA  61  -9.427 -10.339   2.682
  457   2HB   ALA  61          2HB       ALA  61  -8.062 -11.267   2.057
  458   3HB   ALA  61          3HB       ALA  61  -9.597 -11.259   1.186
  459    H    THR  62           H        THR  62  -9.806  -7.810   2.461
  460    HA   THR  62           HA       THR  62 -12.212  -7.725   0.998
  461    HB   THR  62           HB       THR  62 -12.189  -5.267   2.096
  462    HG1  THR  62           HG1      THR  62 -11.155  -5.816   4.268
  463   1HG2  THR  62          1HG2      THR  62 -13.387  -6.296   3.982
  464   2HG2  THR  62          2HG2      THR  62 -12.795  -7.879   3.478
  465   3HG2  THR  62          3HG2      THR  62 -13.883  -6.969   2.430
  466    H    GLU  63           H        GLU  63  -9.662  -5.321   1.190
  467    HA   GLU  63           HA       GLU  63 -10.631  -3.539  -0.728
  468   1HB   GLU  63          1HB       GLU  63  -7.731  -4.103  -0.063
  469   2HB   GLU  63          2HB       GLU  63  -8.399  -2.596  -0.673
  470   1HG   GLU  63          1HG       GLU  63  -9.420  -2.081   1.367
  471   2HG   GLU  63          2HG       GLU  63  -9.295  -3.738   1.952
  472    H    HIS  64           H        HIS  64  -8.898  -6.491  -0.947
  473    HA   HIS  64           HA       HIS  64  -7.900  -6.409  -3.520
  474   1HB   HIS  64          1HB       HIS  64  -7.053  -8.276  -2.726
  475   2HB   HIS  64          2HB       HIS  64  -8.243  -8.330  -1.442
  476    HD1  HIS  64           HD1      HIS  64  -7.558  -9.658  -4.914
  477    HD2  HIS  64           HD2      HIS  64 -10.189 -10.301  -1.745
  478    HE1  HIS  64           HE1      HIS  64  -8.714 -11.829  -5.409
  479    HE2  HIS  64           HE2      HIS  64 -10.190 -12.267  -3.421
  480    H    ALA  65           H        ALA  65 -11.251  -7.329  -2.571
  481    HA   ALA  65           HA       ALA  65 -11.678  -8.957  -4.806
  482   1HB   ALA  65          1HB       ALA  65 -14.041  -8.826  -4.239
  483   2HB   ALA  65          2HB       ALA  65 -13.725  -7.443  -3.191
  484   3HB   ALA  65          3HB       ALA  65 -13.056  -9.025  -2.789
  485    H    GLU  66           H        GLU  66 -13.265  -5.863  -4.284
  486    HA   GLU  66           HA       GLU  66 -14.256  -5.554  -6.881
  487   1HB   GLU  66          1HB       GLU  66 -14.093  -2.987  -5.930
  488   2HB   GLU  66          2HB       GLU  66 -15.396  -4.116  -5.598
  489   1HG   GLU  66          1HG       GLU  66 -14.275  -4.788  -3.495
  490   2HG   GLU  66          2HG       GLU  66 -12.984  -3.627  -3.821
  491    H    ALA  67           H        ALA  67 -11.517  -3.938  -5.375
  492    HA   ALA  67           HA       ALA  67 -10.704  -2.400  -7.529
  493   1HB   ALA  67          1HB       ALA  67  -9.893  -2.044  -5.251
  494   2HB   ALA  67          2HB       ALA  67  -8.554  -2.214  -6.387
  495   3HB   ALA  67          3HB       ALA  67  -8.993  -3.557  -5.331
  496    H    GLU  68           H        GLU  68  -9.578  -5.618  -6.507
  497    HA   GLU  68           HA       GLU  68  -7.644  -5.948  -8.489
  498   1HB   GLU  68          1HB       GLU  68  -7.968  -7.375  -6.449
  499   2HB   GLU  68          2HB       GLU  68  -9.278  -8.175  -7.301
  500   1HG   GLU  68          1HG       GLU  68  -7.819  -9.105  -8.886
  501   2HG   GLU  68          2HG       GLU  68  -6.498  -8.033  -8.411
  502    H    LYS  69           H        LYS  69 -11.145  -6.507  -8.667
  503    HA   LYS  69           HA       LYS  69 -11.176  -7.797 -11.152
  504   1HB   LYS  69          1HB       LYS  69 -13.091  -5.674 -10.157
  505   2HB   LYS  69          2HB       LYS  69 -13.390  -6.767 -11.499
  506   1HG   LYS  69          1HG       LYS  69 -13.373  -8.663 -10.002
  507   2HG   LYS  69          2HG       LYS  69 -12.979  -7.607  -8.639
  508   1HD   LYS  69          1HD       LYS  69 -15.088  -6.366  -9.069
  509   2HD   LYS  69          2HD       LYS  69 -15.489  -7.553 -10.311
  510   1HE   LYS  69          1HE       LYS  69 -15.501  -9.319  -8.644
  511   2HE   LYS  69          2HE       LYS  69 -15.023  -8.166  -7.398
  512   1HZ   LYS  69          1HZ       LYS  69 -17.101  -6.949  -7.839
  513   2HZ   LYS  69          2HZ       LYS  69 -17.378  -8.527  -7.283
  514   3HZ   LYS  69          3HZ       LYS  69 -17.569  -8.163  -8.927
  515    H    ARG  70           H        ARG  70 -11.750  -4.325 -10.612
  516    HA   ARG  70           HA       ARG  70 -11.534  -3.625 -13.362
  517   1HB   ARG  70          1HB       ARG  70 -12.586  -2.166 -11.720
  518   2HB   ARG  70          2HB       ARG  70 -11.056  -1.949 -10.891
  519   1HG   ARG  70          1HG       ARG  70 -11.436   0.023 -12.120
  520   2HG   ARG  70          2HG       ARG  70 -10.186  -0.869 -12.988
  521   1HD   ARG  70          1HD       ARG  70 -13.082  -1.133 -13.726
  522   2HD   ARG  70          2HD       ARG  70 -12.110   0.203 -14.333
  523    HE   ARG  70           HE       ARG  70 -10.585  -1.721 -15.148
  524   1HH1  ARG  70          1HH1      ARG  70 -14.079  -1.857 -14.967
  525   2HH1  ARG  70          2HH1      ARG  70 -14.242  -2.868 -16.376
  526   1HH2  ARG  70          1HH2      ARG  70 -10.786  -3.007 -17.021
  527   2HH2  ARG  70          2HH2      ARG  70 -12.357  -3.519 -17.547
  528    H    ALA  71           H        ALA  71  -9.257  -3.246 -10.785
  529    HA   ALA  71           HA       ALA  71  -7.084  -2.197 -12.101
  530   1HB   ALA  71          1HB       ALA  71  -5.850  -2.868 -10.138
  531   2HB   ALA  71          2HB       ALA  71  -7.171  -3.936  -9.663
  532   3HB   ALA  71          3HB       ALA  71  -7.419  -2.192  -9.709
  533    H    ALA  72           H        ALA  72  -7.830  -5.672 -11.519
  534    HA   ALA  72           HA       ALA  72  -5.384  -6.692 -12.435
  535   1HB   ALA  72          1HB       ALA  72  -7.041  -8.116 -11.346
  536   2HB   ALA  72          2HB       ALA  72  -6.540  -8.783 -12.900
  537   3HB   ALA  72          3HB       ALA  72  -8.096  -7.966 -12.750
  538    H    ALA  73           H        ALA  73  -8.320  -5.761 -14.138
  539    HA   ALA  73           HA       ALA  73  -7.532  -6.517 -16.714
  540   1HB   ALA  73          1HB       ALA  73  -9.041  -4.798 -17.531
  541   2HB   ALA  73          2HB       ALA  73  -9.082  -4.053 -15.933
  542   3HB   ALA  73          3HB       ALA  73  -9.758  -5.664 -16.174
  543    H    ARG  74           H        ARG  74  -7.165  -3.252 -15.293
  544    HA   ARG  74           HA       ARG  74  -5.557  -2.243 -17.365
  545   1HB   ARG  74          1HB       ARG  74  -6.730  -0.777 -15.895
  546   2HB   ARG  74          2HB       ARG  74  -5.801  -1.337 -14.515
  547   1HG   ARG  74          1HG       ARG  74  -4.064   0.006 -14.973
  548   2HG   ARG  74          2HG       ARG  74  -4.205  -0.228 -16.718
  549   1HD   ARG  74          1HD       ARG  74  -4.692   2.106 -15.815
  550   2HD   ARG  74          2HD       ARG  74  -5.881   1.407 -16.914
  551    HE   ARG  74           HE       ARG  74  -6.622   0.772 -14.287
  552   1HH1  ARG  74          1HH1      ARG  74  -6.270   3.648 -16.271
  553   2HH1  ARG  74          2HH1      ARG  74  -7.611   4.463 -15.535
  554   1HH2  ARG  74          1HH2      ARG  74  -8.367   1.852 -13.305
  555   2HH2  ARG  74          2HH2      ARG  74  -8.802   3.451 -13.844
  556    H    ALA  75           H        ALA  75  -4.453  -3.690 -14.291
  557    HA   ALA  75           HA       ALA  75  -1.750  -2.959 -14.384
  558   1HB   ALA  75          1HB       ALA  75  -2.820  -3.967 -12.411
  559   2HB   ALA  75          2HB       ALA  75  -1.315  -4.773 -12.844
  560   3HB   ALA  75          3HB       ALA  75  -2.860  -5.525 -13.236
  561    H    GLY  76           H        GLY  76  -3.404  -5.647 -15.995
  562   1HA   GLY  76          1HA       GLY  76  -1.042  -5.938 -17.672
  563   2HA   GLY  76          2HA       GLY  76  -1.556  -7.360 -16.775
  564    H    HIS  77           H        HIS  77  -2.828  -8.652 -17.751
  565    HA   HIS  77           HA       HIS  77  -4.024  -9.643 -19.416
  566   1HB   HIS  77          1HB       HIS  77  -5.680  -7.173 -18.890
  567   2HB   HIS  77          2HB       HIS  77  -6.223  -8.502 -19.905
  568    HD1  HIS  77           HD1      HIS  77  -4.582 -10.382 -17.545
  569    HD2  HIS  77           HD2      HIS  77  -8.000  -8.015 -17.320
  570    HE1  HIS  77           HE1      HIS  77  -5.861 -11.221 -15.550
  571    HE2  HIS  77           HE2      HIS  77  -7.901  -9.749 -15.396
  572    H    ALA  78           H        ALA  78  -1.925  -7.620 -20.277
  573    HA   ALA  78           HA       ALA  78  -2.574  -7.639 -23.083
  574   1HB   ALA  78          1HB       ALA  78  -3.749  -5.623 -22.323
  575   2HB   ALA  78          2HB       ALA  78  -2.424  -5.239 -23.423
  576   3HB   ALA  78          3HB       ALA  78  -2.231  -4.988 -21.687
  577    H    ALA  79           H        ALA  79  -0.442  -8.376 -20.956
  578    HA   ALA  79           HA       ALA  79   1.891  -6.962 -21.914
  579   1HB   ALA  79          1HB       ALA  79   3.152  -8.400 -20.402
  580   2HB   ALA  79          2HB       ALA  79   1.708  -9.362 -20.091
  581   3HB   ALA  79          3HB       ALA  79   1.776  -7.678 -19.572
  582    H    THR  80           H        THR  80   3.777  -8.226 -22.744
  583    HA   THR  80           HA       THR  80   2.957 -10.542 -24.352
  584    HB   THR  80           HB       THR  80   4.551  -8.223 -25.468
  585    HG1  THR  80           HG1      THR  80   1.898  -8.513 -25.136
  586   1HG2  THR  80          1HG2      THR  80   3.342 -10.646 -26.813
  587   2HG2  THR  80          2HG2      THR  80   5.057 -10.399 -26.494
  588   3HG2  THR  80          3HG2      THR  80   4.211  -9.339 -27.621
  Start of MODEL   20
    1    H    MET   1           H        MET   1   5.841   1.206   3.808
    2    HA   MET   1           HA       MET   1   4.717   0.629   1.743
    3   1HB   MET   1          1HB       MET   1   5.725   2.235   0.250
    4   2HB   MET   1          2HB       MET   1   7.332   1.598   0.564
    5   1HG   MET   1          1HG       MET   1   6.683  -0.510  -0.529
    6   2HG   MET   1          2HG       MET   1   5.105   0.186  -0.889
    7   1HE   MET   1          1HE       MET   1   5.568  -0.532  -3.440
    8   2HE   MET   1          2HE       MET   1   7.188  -1.100  -3.036
    9   3HE   MET   1          3HE       MET   1   6.958   0.030  -4.370
   10    H    HIS   2           H        HIS   2   4.671  -1.546   1.628
   11    HA   HIS   2           HA       HIS   2   7.198  -3.005   1.807
   12   1HB   HIS   2          1HB       HIS   2   6.671  -4.292   3.641
   13   2HB   HIS   2          2HB       HIS   2   5.853  -2.808   4.097
   14    HD1  HIS   2           HD1      HIS   2   3.376  -2.973   4.566
   15    HD2  HIS   2           HD2      HIS   2   4.879  -6.371   2.683
   16    HE1  HIS   2           HE1      HIS   2   1.519  -4.675   4.630
   17    HE2  HIS   2           HE2      HIS   2   2.425  -6.708   3.441
   18    H    ALA   3           H        ALA   3   7.108  -5.079   0.837
   19    HA   ALA   3           HA       ALA   3   4.563  -5.803  -0.416
   20   1HB   ALA   3          1HB       ALA   3   5.627  -6.278  -2.540
   21   2HB   ALA   3          2HB       ALA   3   7.186  -5.759  -1.901
   22   3HB   ALA   3          3HB       ALA   3   5.882  -4.589  -2.104
   23    H    LYS   4           H        LYS   4   4.141  -7.627   0.592
   24    HA   LYS   4           HA       LYS   4   6.132  -9.754   0.506
   25   1HB   LYS   4          1HB       LYS   4   4.777  -8.710   2.978
   26   2HB   LYS   4          2HB       LYS   4   5.314 -10.382   2.884
   27   1HG   LYS   4          1HG       LYS   4   7.596  -9.663   2.521
   28   2HG   LYS   4          2HG       LYS   4   7.085  -7.976   2.497
   29   1HD   LYS   4          1HD       LYS   4   6.510  -8.024   4.797
   30   2HD   LYS   4          2HD       LYS   4   6.630  -9.784   4.861
   31   1HE   LYS   4          1HE       LYS   4   8.563  -8.676   5.909
   32   2HE   LYS   4          2HE       LYS   4   9.026  -9.669   4.529
   33   1HZ   LYS   4          1HZ       LYS   4  10.169  -7.529   4.550
   34   2HZ   LYS   4          2HZ       LYS   4   8.684  -6.714   4.479
   35   3HZ   LYS   4          3HZ       LYS   4   9.184  -7.681   3.178
   36    H    VAL   5           H        VAL   5   5.131 -11.884   1.042
   37    HA   VAL   5           HA       VAL   5   2.803 -12.209  -0.568
   38    HB   VAL   5           HB       VAL   5   4.545 -13.941  -0.490
   39   1HG1  VAL   5          1HG1      VAL   5   3.712 -14.338   2.377
   40   2HG1  VAL   5          2HG1      VAL   5   5.256 -13.704   1.809
   41   3HG1  VAL   5          3HG1      VAL   5   4.817 -15.379   1.476
   42   1HG2  VAL   5          1HG2      VAL   5   3.143 -15.923  -0.221
   43   2HG2  VAL   5          2HG2      VAL   5   2.278 -14.642  -1.070
   44   3HG2  VAL   5          3HG2      VAL   5   1.934 -14.961   0.631
   45    H    GLY   6           H        GLY   6   0.763 -13.082   0.099
   46   1HA   GLY   6          1HA       GLY   6  -0.970 -13.470   1.634
   47   2HA   GLY   6          2HA       GLY   6   0.082 -12.912   2.932
   48    H    ASP   7           H        ASP   7   0.116 -11.010   0.168
   49    HA   ASP   7           HA       ASP   7  -1.902  -9.057   1.212
   50   1HB   ASP   7          1HB       ASP   7   1.030  -8.477   0.612
   51   2HB   ASP   7          2HB       ASP   7  -0.204  -7.232   0.724
   52    H    TYR   8           H        TYR   8  -1.715  -7.153  -0.433
   53    HA   TYR   8           HA       TYR   8  -1.788  -8.244  -3.164
   54   1HB   TYR   8          1HB       TYR   8  -3.989  -6.639  -1.829
   55   2HB   TYR   8          2HB       TYR   8  -3.942  -7.060  -3.531
   56    HD1  TYR   8           HD1      TYR   8  -4.634  -8.265  -0.144
   57    HD2  TYR   8           HD2      TYR   8  -4.475  -9.313  -4.263
   58    HE1  TYR   8           HE1      TYR   8  -5.989 -10.272   0.307
   59    HE2  TYR   8           HE2      TYR   8  -5.821 -11.325  -3.813
   60    HH   TYR   8           HH       TYR   8  -6.197 -12.822  -1.688
   61    H    LEU   9           H        LEU   9  -2.379  -6.279  -4.619
   62    HA   LEU   9           HA       LEU   9  -0.618  -4.074  -3.824
   63   1HB   LEU   9          1HB       LEU   9   0.769  -5.804  -4.847
   64   2HB   LEU   9          2HB       LEU   9  -0.300  -5.881  -6.227
   65    HG   LEU   9           HG       LEU   9   1.168  -3.332  -5.606
   66   1HD1  LEU   9          1HD1      LEU   9   2.840  -5.117  -5.612
   67   2HD1  LEU   9          2HD1      LEU   9   2.984  -4.097  -7.045
   68   3HD1  LEU   9          3HD1      LEU   9   2.227  -5.685  -7.166
   69   1HD2  LEU   9          1HD2      LEU   9   0.208  -4.606  -8.170
   70   2HD2  LEU   9          2HD2      LEU   9   1.007  -3.040  -8.030
   71   3HD2  LEU   9          3HD2      LEU   9  -0.587  -3.284  -7.316
   72    H    VAL  10           H        VAL  10  -1.140  -2.204  -4.577
   73    HA   VAL  10           HA       VAL  10  -2.873  -1.872  -6.923
   74    HB   VAL  10           HB       VAL  10  -3.240  -0.369  -4.312
   75   1HG1  VAL  10          1HG1      VAL  10  -5.204   0.611  -5.410
   76   2HG1  VAL  10          2HG1      VAL  10  -4.766  -0.220  -6.903
   77   3HG1  VAL  10          3HG1      VAL  10  -3.701   1.018  -6.238
   78   1HG2  VAL  10          1HG2      VAL  10  -4.098  -2.646  -4.146
   79   2HG2  VAL  10          2HG2      VAL  10  -5.051  -2.395  -5.608
   80   3HG2  VAL  10          3HG2      VAL  10  -5.408  -1.467  -4.152
   81    H    VAL  11           H        VAL  11  -2.339  -0.037  -8.124
   82    HA   VAL  11           HA       VAL  11  -0.154   1.640  -7.074
   83    HB   VAL  11           HB       VAL  11  -0.563   0.674  -9.907
   84   1HG1  VAL  11          1HG1      VAL  11   0.147   3.008  -9.933
   85   2HG1  VAL  11          2HG1      VAL  11   1.450   1.952 -10.478
   86   3HG1  VAL  11          3HG1      VAL  11   1.483   2.625  -8.848
   87   1HG2  VAL  11          1HG2      VAL  11   0.484  -0.965  -8.470
   88   2HG2  VAL  11          2HG2      VAL  11   1.654   0.233  -7.916
   89   3HG2  VAL  11          3HG2      VAL  11   1.673  -0.307  -9.594
   90    H    LYS  12           H        LYS  12  -0.548   3.756  -7.020
   91    HA   LYS  12           HA       LYS  12  -3.010   4.806  -8.150
   92   1HB   LYS  12          1HB       LYS  12  -0.821   6.200  -6.587
   93   2HB   LYS  12          2HB       LYS  12  -2.375   6.896  -7.012
   94   1HG   LYS  12          1HG       LYS  12  -3.523   5.338  -5.583
   95   2HG   LYS  12          2HG       LYS  12  -2.015   4.483  -5.247
   96   1HD   LYS  12          1HD       LYS  12  -1.108   6.472  -4.181
   97   2HD   LYS  12          2HD       LYS  12  -2.584   7.363  -4.551
   98   1HE   LYS  12          1HE       LYS  12  -3.868   5.907  -3.107
   99   2HE   LYS  12          2HE       LYS  12  -2.452   4.896  -2.819
  100   1HZ   LYS  12          1HZ       LYS  12  -1.387   6.666  -1.665
  101   2HZ   LYS  12          2HZ       LYS  12  -2.946   6.506  -1.017
  102   3HZ   LYS  12          3HZ       LYS  12  -2.604   7.766  -2.092
  103    H    GLY  13           H        GLY  13  -2.727   4.864 -10.382
  104   1HA   GLY  13          1HA       GLY  13  -0.509   6.571 -11.323
  105   2HA   GLY  13          2HA       GLY  13  -0.811   5.012 -12.068
  106    H    THR  14           H        THR  14  -3.321   4.828 -12.674
  107    HA   THR  14           HA       THR  14  -3.526   6.402 -14.961
  108    HB   THR  14           HB       THR  14  -6.005   5.212 -13.805
  109    HG1  THR  14           HG1      THR  14  -5.168   3.286 -13.639
  110   1HG2  THR  14          1HG2      THR  14  -6.256   4.406 -16.121
  111   2HG2  THR  14          2HG2      THR  14  -4.692   5.115 -16.525
  112   3HG2  THR  14          3HG2      THR  14  -6.036   6.156 -16.056
  113    H    THR  15           H        THR  15  -4.543   8.258 -15.469
  114    HA   THR  15           HA       THR  15  -5.449  10.308 -15.212
  115    HB   THR  15           HB       THR  15  -7.765  10.329 -14.176
  116    HG1  THR  15           HG1      THR  15  -6.914   7.924 -13.283
  117   1HG2  THR  15          1HG2      THR  15  -7.155   8.301 -16.328
  118   2HG2  THR  15          2HG2      THR  15  -7.408  10.031 -16.561
  119   3HG2  THR  15          3HG2      THR  15  -8.738   9.012 -16.011
  120    H    THR  16           H        THR  16  -7.011   9.607 -12.194
  121    HA   THR  16           HA       THR  16  -4.937  10.868 -10.624
  122    HB   THR  16           HB       THR  16  -5.962  12.854 -11.486
  123    HG1  THR  16           HG1      THR  16  -7.300  13.155  -9.181
  124   1HG2  THR  16          1HG2      THR  16  -8.358  13.339 -11.223
  125   2HG2  THR  16          2HG2      THR  16  -8.609  11.718 -10.574
  126   3HG2  THR  16          3HG2      THR  16  -8.085  11.929 -12.246
  127    H    GLU  17           H        GLU  17  -4.869   9.922  -8.724
  128    HA   GLU  17           HA       GLU  17  -5.407   8.794  -6.827
  129   1HB   GLU  17          1HB       GLU  17  -8.104  10.043  -7.351
  130   2HB   GLU  17          2HB       GLU  17  -7.685   9.190  -5.873
  131   1HG   GLU  17          1HG       GLU  17  -5.967  10.824  -5.388
  132   2HG   GLU  17          2HG       GLU  17  -6.309  11.658  -6.905
  133    H    ARG  18           H        ARG  18  -5.981   7.591  -9.581
  134    HA   ARG  18           HA       ARG  18  -8.222   5.841  -9.071
  135   1HB   ARG  18          1HB       ARG  18  -7.372   6.909 -11.339
  136   2HB   ARG  18          2HB       ARG  18  -6.392   5.451 -11.389
  137   1HG   ARG  18          1HG       ARG  18  -8.357   4.067 -11.318
  138   2HG   ARG  18          2HG       ARG  18  -9.388   5.487 -11.106
  139   1HD   ARG  18          1HD       ARG  18  -8.411   6.317 -13.305
  140   2HD   ARG  18          2HD       ARG  18  -7.783   4.684 -13.515
  141    HE   ARG  18           HE       ARG  18 -10.187   3.970 -13.318
  142   1HH1  ARG  18          1HH1      ARG  18  -9.301   7.164 -14.424
  143   2HH1  ARG  18          2HH1      ARG  18 -10.706   7.355 -15.437
  144   1HH2  ARG  18          1HH2      ARG  18 -12.044   4.195 -14.647
  145   2HH2  ARG  18          2HH2      ARG  18 -12.274   5.665 -15.554
  146    H    HIS  19           H        HIS  19  -8.117   3.901  -8.237
  147    HA   HIS  19           HA       HIS  19  -5.513   2.801  -7.554
  148   1HB   HIS  19          1HB       HIS  19  -8.318   2.016  -6.739
  149   2HB   HIS  19          2HB       HIS  19  -6.872   1.166  -6.209
  150    HD1  HIS  19           HD1      HIS  19  -8.593   4.509  -5.883
  151    HD2  HIS  19           HD2      HIS  19  -5.555   2.311  -4.085
  152    HE1  HIS  19           HE1      HIS  19  -7.976   5.780  -3.798
  153    HE2  HIS  19           HE2      HIS  19  -6.211   4.373  -2.667
  154    H    ASP  20           H        ASP  20  -4.798   2.073  -9.568
  155    HA   ASP  20           HA       ASP  20  -6.309  -0.206 -10.661
  156   1HB   ASP  20          1HB       ASP  20  -4.444   1.724 -12.045
  157   2HB   ASP  20          2HB       ASP  20  -4.976   0.212 -12.774
  158    H    GLN  21           H        GLN  21  -4.435  -1.495 -12.116
  159    HA   GLN  21           HA       GLN  21  -2.970  -3.210 -11.852
  160   1HB   GLN  21          1HB       GLN  21  -1.497  -0.965 -10.491
  161   2HB   GLN  21          2HB       GLN  21  -0.790  -2.563 -10.664
  162   1HG   GLN  21          1HG       GLN  21   0.011  -1.131 -12.412
  163   2HG   GLN  21          2HG       GLN  21  -1.020  -2.381 -13.104
  164   1HE2  GLN  21          1HE2      GLN  21  -0.701   0.993 -12.371
  165   2HE2  GLN  21          2HE2      GLN  21  -2.003   1.541 -13.366
  166    H    HIS  22           H        HIS  22  -4.310  -4.569 -10.587
  167    HA   HIS  22           HA       HIS  22  -3.599  -4.621  -7.739
  168   1HB   HIS  22          1HB       HIS  22  -5.791  -3.439  -8.136
  169   2HB   HIS  22          2HB       HIS  22  -6.425  -4.968  -8.729
  170    HD1  HIS  22           HD1      HIS  22  -5.417  -6.911  -6.593
  171    HD2  HIS  22           HD2      HIS  22  -6.996  -3.165  -5.754
  172    HE1  HIS  22           HE1      HIS  22  -6.231  -7.039  -4.226
  173    HE2  HIS  22           HE2      HIS  22  -7.418  -4.845  -3.845
  174    H    ALA  23           H        ALA  23  -3.166  -6.523  -6.947
  175    HA   ALA  23           HA       ALA  23  -4.556  -8.960  -7.470
  176   1HB   ALA  23          1HB       ALA  23  -3.463  -8.850  -9.672
  177   2HB   ALA  23          2HB       ALA  23  -2.921 -10.236  -8.727
  178   3HB   ALA  23          3HB       ALA  23  -1.887  -8.815  -8.879
  179    H    GLU  24           H        GLU  24  -3.067 -10.864  -6.699
  180    HA   GLU  24           HA       GLU  24  -2.176  -9.931  -4.060
  181   1HB   GLU  24          1HB       GLU  24  -3.905 -11.653  -4.048
  182   2HB   GLU  24          2HB       GLU  24  -2.882 -12.719  -5.005
  183   1HG   GLU  24          1HG       GLU  24  -1.288 -12.880  -3.200
  184   2HG   GLU  24          2HG       GLU  24  -2.199 -11.711  -2.249
  185    H    ILE  25           H        ILE  25  -0.182 -10.070  -3.352
  186    HA   ILE  25           HA       ILE  25   1.860 -11.131  -5.121
  187    HB   ILE  25           HB       ILE  25   2.273  -9.860  -2.409
  188   1HG1  ILE  25          1HG1      ILE  25   2.255  -8.491  -5.112
  189   2HG1  ILE  25          2HG1      ILE  25   0.977  -8.350  -3.910
  190   1HG2  ILE  25          1HG2      ILE  25   4.074 -10.197  -4.807
  191   2HG2  ILE  25          2HG2      ILE  25   4.175 -11.090  -3.289
  192   3HG2  ILE  25          3HG2      ILE  25   4.502  -9.357  -3.315
  193   1HD1  ILE  25          1HD1      ILE  25   3.831  -7.460  -3.561
  194   2HD1  ILE  25          2HD1      ILE  25   2.547  -7.310  -2.362
  195   3HD1  ILE  25          3HD1      ILE  25   2.446  -6.416  -3.880
  196    H    ILE  26           H        ILE  26   2.087 -13.268  -5.039
  197    HA   ILE  26           HA       ILE  26   2.178 -14.557  -2.400
  198    HB   ILE  26           HB       ILE  26   1.684 -16.672  -3.364
  199   1HG1  ILE  26          1HG1      ILE  26   3.023 -16.361  -5.479
  200   2HG1  ILE  26          2HG1      ILE  26   1.458 -17.124  -5.729
  201   1HG2  ILE  26          1HG2      ILE  26  -0.255 -15.239  -2.990
  202   2HG2  ILE  26          2HG2      ILE  26  -0.528 -16.270  -4.396
  203   3HG2  ILE  26          3HG2      ILE  26  -0.107 -14.571  -4.616
  204   1HD1  ILE  26          1HD1      ILE  26   2.151 -14.253  -6.293
  205   2HD1  ILE  26          2HD1      ILE  26   0.561 -14.986  -6.511
  206   3HD1  ILE  26          3HD1      ILE  26   1.928 -15.538  -7.480
  207    H    GLU  27           H        GLU  27   3.958 -13.930  -5.327
  208    HA   GLU  27           HA       GLU  27   6.305 -15.117  -4.015
  209   1HB   GLU  27          1HB       GLU  27   5.770 -14.870  -6.981
  210   2HB   GLU  27          2HB       GLU  27   7.317 -15.335  -6.287
  211   1HG   GLU  27          1HG       GLU  27   5.839 -17.166  -5.101
  212   2HG   GLU  27          2HG       GLU  27   4.787 -16.867  -6.484
  213    H    VAL  28           H        VAL  28   7.524 -13.593  -3.215
  214    HA   VAL  28           HA       VAL  28   7.327 -10.915  -4.349
  215    HB   VAL  28           HB       VAL  28   8.524 -11.789  -1.720
  216   1HG1  VAL  28          1HG1      VAL  28   7.847  -9.044  -2.775
  217   2HG1  VAL  28          2HG1      VAL  28   9.471  -9.702  -2.581
  218   3HG1  VAL  28          3HG1      VAL  28   8.463  -9.410  -1.163
  219   1HG2  VAL  28          1HG2      VAL  28   6.495 -10.888  -0.729
  220   2HG2  VAL  28          2HG2      VAL  28   6.116 -12.190  -1.858
  221   3HG2  VAL  28          3HG2      VAL  28   5.867 -10.512  -2.334
  222    H    ARG  29           H        ARG  29   8.927 -10.350  -5.752
  223    HA   ARG  29           HA       ARG  29  11.263 -11.879  -6.134
  224   1HB   ARG  29          1HB       ARG  29  10.149 -10.480  -7.879
  225   2HB   ARG  29          2HB       ARG  29  10.750  -9.051  -7.057
  226   1HG   ARG  29          1HG       ARG  29  12.661 -11.155  -7.971
  227   2HG   ARG  29          2HG       ARG  29  12.005  -9.995  -9.125
  228   1HD   ARG  29          1HD       ARG  29  12.814  -8.165  -7.643
  229   2HD   ARG  29          2HD       ARG  29  13.575  -9.384  -6.625
  230    HE   ARG  29           HE       ARG  29  14.688  -9.972  -8.951
  231   1HH1  ARG  29          1HH1      ARG  29  14.117  -6.843  -7.481
  232   2HH1  ARG  29          2HH1      ARG  29  15.484  -6.095  -8.241
  233   1HH2  ARG  29          1HH2      ARG  29  16.517  -8.989  -9.931
  234   2HH2  ARG  29          2HH2      ARG  29  16.835  -7.303  -9.637
  235    H    SER  30           H        SER  30  10.842  -8.645  -4.813
  236    HA   SER  30           HA       SER  30  13.279  -9.071  -3.220
  237   1HB   SER  30          1HB       SER  30  12.107  -6.433  -4.147
  238   2HB   SER  30          2HB       SER  30  13.570  -6.632  -3.183
  239    HG   SER  30           HG       SER  30  14.471  -7.809  -4.963
  240    H    ALA  31           H        ALA  31  12.795  -9.504  -1.182
  241    HA   ALA  31           HA       ALA  31  10.134  -9.465  -0.242
  242   1HB   ALA  31          1HB       ALA  31  12.659  -9.865   1.352
  243   2HB   ALA  31          2HB       ALA  31  11.817 -11.119   0.443
  244   3HB   ALA  31          3HB       ALA  31  11.029 -10.350   1.821
  245    H    ASP  32           H        ASP  32  12.599  -7.098  -0.121
  246    HA   ASP  32           HA       ASP  32  11.819  -5.664   2.180
  247   1HB   ASP  32          1HB       ASP  32  12.983  -4.474  -0.346
  248   2HB   ASP  32          2HB       ASP  32  13.097  -3.829   1.287
  249    H    GLY  33           H        GLY  33  10.743  -5.641  -1.148
  250   1HA   GLY  33          1HA       GLY  33   8.323  -4.974  -1.383
  251   2HA   GLY  33          2HA       GLY  33   8.794  -3.524  -0.503
  252    H    SER  34           H        SER  34  10.154  -5.370  -3.230
  253    HA   SER  34           HA       SER  34  10.191  -2.884  -4.792
  254   1HB   SER  34          1HB       SER  34  12.522  -4.809  -4.662
  255   2HB   SER  34          2HB       SER  34  12.474  -3.238  -5.462
  256    HG   SER  34           HG       SER  34  12.143  -2.325  -3.332
  257    HA   PRO  35           HA       PRO  35   8.618  -5.558  -8.002
  258   1HB   PRO  35          1HB       PRO  35   9.590  -3.575  -9.923
  259   2HB   PRO  35          2HB       PRO  35   7.930  -4.031  -9.535
  260   1HG   PRO  35          1HG       PRO  35   8.957  -1.634  -8.844
  261   2HG   PRO  35          2HG       PRO  35   7.756  -2.473  -7.846
  262   1HD   PRO  35          1HD       PRO  35  10.726  -2.300  -7.491
  263   2HD   PRO  35          2HD       PRO  35   9.436  -2.171  -6.274
  264    HA   PRO  36           HA       PRO  36   8.369  -6.033 -10.410
  265   1HB   PRO  36          1HB       PRO  36   8.483  -8.438 -11.600
  266   2HB   PRO  36          2HB       PRO  36   9.206  -6.999 -12.331
  267   1HG   PRO  36          1HG       PRO  36  10.522  -9.198 -10.779
  268   2HG   PRO  36          2HG       PRO  36  11.059  -8.408 -12.273
  269   1HD   PRO  36          1HD       PRO  36  12.039  -7.764  -9.812
  270   2HD   PRO  36          2HD       PRO  36  11.940  -6.608 -11.154
  271    H    TYR  37           H        TYR  37   6.663  -7.869 -10.350
  272    HA   TYR  37           HA       TYR  37   6.951  -9.433  -7.859
  273   1HB   TYR  37          1HB       TYR  37   4.499  -7.886  -8.724
  274   2HB   TYR  37          2HB       TYR  37   4.607  -8.934  -7.314
  275    HD1  TYR  37           HD1      TYR  37   6.137  -8.279  -5.426
  276    HD2  TYR  37           HD2      TYR  37   5.234  -5.644  -8.639
  277    HE1  TYR  37           HE1      TYR  37   6.903  -6.373  -4.073
  278    HE2  TYR  37           HE2      TYR  37   5.995  -3.734  -7.296
  279    HH   TYR  37           HH       TYR  37   7.721  -4.097  -4.382
  280    H    VAL  38           H        VAL  38   6.139 -11.483  -7.939
  281    HA   VAL  38           HA       VAL  38   4.832 -12.298 -10.436
  282    HB   VAL  38           HB       VAL  38   5.831 -14.041  -8.165
  283   1HG1  VAL  38          1HG1      VAL  38   5.478 -15.892  -9.728
  284   2HG1  VAL  38          2HG1      VAL  38   4.818 -14.765 -10.915
  285   3HG1  VAL  38          3HG1      VAL  38   3.974 -15.037  -9.389
  286   1HG2  VAL  38          1HG2      VAL  38   7.630 -14.681  -9.700
  287   2HG2  VAL  38          2HG2      VAL  38   7.674 -12.958  -9.330
  288   3HG2  VAL  38          3HG2      VAL  38   7.037 -13.510 -10.879
  289    H    VAL  39           H        VAL  39   2.733 -12.021 -10.380
  290    HA   VAL  39           HA       VAL  39   1.486 -11.883  -7.731
  291    HB   VAL  39           HB       VAL  39   1.930  -9.816  -9.435
  292   1HG1  VAL  39          1HG1      VAL  39  -0.892 -10.694  -9.971
  293   2HG1  VAL  39          2HG1      VAL  39   0.424 -10.571 -11.140
  294   3HG1  VAL  39          3HG1      VAL  39  -0.219  -9.116 -10.380
  295   1HG2  VAL  39          1HG2      VAL  39   1.338  -9.616  -7.110
  296   2HG2  VAL  39          2HG2      VAL  39  -0.331 -10.062  -7.472
  297   3HG2  VAL  39          3HG2      VAL  39   0.335  -8.551  -8.094
  298    H    ARG  40           H        ARG  40  -0.459 -12.780  -7.421
  299    HA   ARG  40           HA       ARG  40  -1.452 -14.524  -9.560
  300   1HB   ARG  40          1HB       ARG  40  -0.689 -15.405  -7.247
  301   2HB   ARG  40          2HB       ARG  40  -2.195 -14.719  -6.653
  302   1HG   ARG  40          1HG       ARG  40  -3.466 -16.140  -8.140
  303   2HG   ARG  40          2HG       ARG  40  -1.974 -16.782  -8.834
  304   1HD   ARG  40          1HD       ARG  40  -1.366 -17.501  -6.479
  305   2HD   ARG  40          2HD       ARG  40  -3.036 -17.143  -6.046
  306    HE   ARG  40           HE       ARG  40  -2.998 -18.831  -8.293
  307   1HH1  ARG  40          1HH1      ARG  40  -2.400 -18.853  -4.849
  308   2HH1  ARG  40          2HH1      ARG  40  -2.619 -20.571  -4.692
  309   1HH2  ARG  40          1HH2      ARG  40  -3.300 -21.078  -8.105
  310   2HH2  ARG  40          2HH2      ARG  40  -3.175 -21.839  -6.544
  311    H    TRP  41           H        TRP  41  -3.396 -14.175 -10.389
  312    HA   TRP  41           HA       TRP  41  -4.887 -11.869  -9.389
  313   1HB   TRP  41          1HB       TRP  41  -5.296 -13.404 -11.971
  314   2HB   TRP  41          2HB       TRP  41  -5.925 -11.810 -11.572
  315    HD1  TRP  41           HD1      TRP  41  -2.223 -12.932 -11.198
  316    HE1  TRP  41           HE1      TRP  41  -0.778 -11.397 -12.655
  317    HE3  TRP  41           HE3      TRP  41  -5.918 -10.259 -13.464
  318    HZ2  TRP  41           HZ2      TRP  41  -1.142  -9.338 -14.533
  319    HZ3  TRP  41           HZ3      TRP  41  -5.279  -8.529 -15.063
  320    HH2  TRP  41           HH2      TRP  41  -2.951  -8.074 -15.608
  321    H    LEU  42           H        LEU  42  -6.064 -12.674  -7.693
  322    HA   LEU  42           HA       LEU  42  -6.861 -15.425  -7.651
  323   1HB   LEU  42          1HB       LEU  42  -7.852 -13.297  -5.780
  324   2HB   LEU  42          2HB       LEU  42  -7.688 -15.014  -5.475
  325    HG   LEU  42           HG       LEU  42  -5.498 -12.962  -5.667
  326   1HD1  LEU  42          1HD1      LEU  42  -5.032 -13.733  -3.397
  327   2HD1  LEU  42          2HD1      LEU  42  -6.407 -14.832  -3.494
  328   3HD1  LEU  42          3HD1      LEU  42  -6.666 -13.088  -3.555
  329   1HD2  LEU  42          1HD2      LEU  42  -3.923 -14.798  -5.292
  330   2HD2  LEU  42          2HD2      LEU  42  -4.748 -14.951  -6.843
  331   3HD2  LEU  42          3HD2      LEU  42  -5.236 -15.959  -5.481
  332    H    VAL  43           H        VAL  43  -8.746 -12.439  -7.431
  333    HA   VAL  43           HA       VAL  43 -11.211 -13.827  -7.856
  334    HB   VAL  43           HB       VAL  43 -12.074 -11.421  -7.947
  335   1HG1  VAL  43          1HG1      VAL  43 -11.884 -11.203  -5.498
  336   2HG1  VAL  43          2HG1      VAL  43 -10.619 -12.432  -5.509
  337   3HG1  VAL  43          3HG1      VAL  43 -12.266 -12.855  -5.980
  338   1HG2  VAL  43          1HG2      VAL  43  -9.283 -10.896  -6.957
  339   2HG2  VAL  43          2HG2      VAL  43 -10.608  -9.734  -6.970
  340   3HG2  VAL  43          3HG2      VAL  43  -9.952 -10.337  -8.492
  341    H    ASN  44           H        ASN  44  -8.814 -12.814  -9.845
  342    HA   ASN  44           HA       ASN  44 -10.544 -12.216 -12.093
  343   1HB   ASN  44          1HB       ASN  44  -7.547 -12.155 -11.779
  344   2HB   ASN  44          2HB       ASN  44  -8.336 -11.962 -13.340
  345   1HD2  ASN  44          1HD2      ASN  44  -7.640 -10.505 -10.285
  346   2HD2  ASN  44          2HD2      ASN  44  -8.222  -8.926 -10.679
  347    H    GLY  45           H        GLY  45  -7.774 -14.463 -11.560
  348   1HA   GLY  45          1HA       GLY  45  -9.030 -16.793 -12.280
  349   2HA   GLY  45          2HA       GLY  45  -8.568 -16.060 -13.804
  350    H    HIS  46           H        HIS  46  -6.222 -15.534 -14.063
  351    HA   HIS  46           HA       HIS  46  -4.738 -17.885 -13.111
  352   1HB   HIS  46          1HB       HIS  46  -4.443 -16.128 -15.539
  353   2HB   HIS  46          2HB       HIS  46  -3.178 -17.248 -15.045
  354    HD1  HIS  46           HD1      HIS  46  -3.287 -19.394 -16.226
  355    HD2  HIS  46           HD2      HIS  46  -7.050 -17.669 -15.826
  356    HE1  HIS  46           HE1      HIS  46  -4.882 -20.969 -17.369
  357    HE2  HIS  46           HE2      HIS  46  -7.101 -19.781 -17.319
  358    H    GLU  47           H        GLU  47  -2.262 -17.498 -13.145
  359    HA   GLU  47           HA       GLU  47  -1.671 -14.957 -11.763
  360   1HB   GLU  47          1HB       GLU  47   0.072 -16.187 -10.501
  361   2HB   GLU  47          2HB       GLU  47  -1.549 -16.784 -10.181
  362   1HG   GLU  47          1HG       GLU  47  -1.112 -18.615 -11.822
  363   2HG   GLU  47          2HG       GLU  47   0.559 -18.056 -11.907
  364    H    THR  48           H        THR  48   0.455 -14.060 -12.105
  365    HA   THR  48           HA       THR  48   2.210 -15.084 -14.107
  366    HB   THR  48           HB       THR  48   0.389 -14.422 -15.596
  367    HG1  THR  48           HG1      THR  48   1.655 -13.259 -17.010
  368   1HG2  THR  48          1HG2      THR  48  -0.628 -12.659 -14.252
  369   2HG2  THR  48          2HG2      THR  48  -0.233 -12.060 -15.863
  370   3HG2  THR  48          3HG2      THR  48   0.793 -11.645 -14.489
  371    H    THR  49           H        THR  49   3.598 -13.157 -14.938
  372    HA   THR  49           HA       THR  49   4.570 -11.837 -12.496
  373    HB   THR  49           HB       THR  49   6.008 -12.160 -15.139
  374    HG1  THR  49           HG1      THR  49   5.506 -14.204 -14.168
  375   1HG2  THR  49          1HG2      THR  49   8.021 -11.764 -13.789
  376   2HG2  THR  49          2HG2      THR  49   7.016 -11.527 -12.359
  377   3HG2  THR  49          3HG2      THR  49   6.913 -10.396 -13.709
  378    H    VAL  50           H        VAL  50   4.213  -9.729 -12.232
  379    HA   VAL  50           HA       VAL  50   3.452  -8.138 -14.604
  380    HB   VAL  50           HB       VAL  50   2.243  -7.972 -11.834
  381   1HG1  VAL  50          1HG1      VAL  50   0.637  -6.412 -12.864
  382   2HG1  VAL  50          2HG1      VAL  50   1.564  -6.467 -14.363
  383   3HG1  VAL  50          3HG1      VAL  50   2.286  -5.790 -12.904
  384   1HG2  VAL  50          1HG2      VAL  50   1.537  -9.971 -13.028
  385   2HG2  VAL  50          2HG2      VAL  50   1.070  -8.988 -14.418
  386   3HG2  VAL  50          3HG2      VAL  50   0.211  -8.817 -12.887
  387    H    TYR  51           H        TYR  51   4.146  -6.051 -14.704
  388    HA   TYR  51           HA       TYR  51   5.903  -5.076 -12.561
  389   1HB   TYR  51          1HB       TYR  51   5.768  -4.362 -15.501
  390   2HB   TYR  51          2HB       TYR  51   6.731  -3.472 -14.329
  391    HD1  TYR  51           HD1      TYR  51   6.327  -6.780 -15.962
  392    HD2  TYR  51           HD2      TYR  51   8.859  -4.247 -13.664
  393    HE1  TYR  51           HE1      TYR  51   8.195  -8.343 -16.303
  394    HE2  TYR  51           HE2      TYR  51  10.731  -5.802 -13.999
  395    HH   TYR  51           HH       TYR  51  11.108  -8.138 -14.522
  396    HA   PRO  52           HA       PRO  52   2.180  -2.528 -11.978
  397   1HB   PRO  52          1HB       PRO  52   2.704  -1.829  -9.436
  398   2HB   PRO  52          2HB       PRO  52   2.110  -3.441  -9.857
  399   1HG   PRO  52          1HG       PRO  52   4.912  -2.545  -9.287
  400   2HG   PRO  52          2HG       PRO  52   4.059  -3.986  -8.700
  401   1HD   PRO  52          1HD       PRO  52   5.804  -4.048 -10.781
  402   2HD   PRO  52          2HD       PRO  52   4.412  -5.145 -10.657
  403    H    GLY  53           H        GLY  53   5.479  -1.699 -12.019
  404   1HA   GLY  53          1HA       GLY  53   6.327   0.366 -12.789
  405   2HA   GLY  53          2HA       GLY  53   4.815   1.132 -12.315
  406    H    SER  54           H        SER  54   4.671   2.094 -10.357
  407    HA   SER  54           HA       SER  54   6.519   1.428  -8.230
  408   1HB   SER  54          1HB       SER  54   6.508   4.198  -9.468
  409   2HB   SER  54          2HB       SER  54   7.355   3.749  -7.988
  410    HG   SER  54           HG       SER  54   7.968   2.055 -10.013
  411    H    ASP  55           H        ASP  55   6.052   2.964  -6.290
  412    HA   ASP  55           HA       ASP  55   4.583   3.591  -4.691
  413   1HB   ASP  55          1HB       ASP  55   3.128   4.626  -7.118
  414   2HB   ASP  55          2HB       ASP  55   2.494   4.837  -5.490
  415    H    ALA  56           H        ALA  56   4.541   0.960  -5.426
  416    HA   ALA  56           HA       ALA  56   1.842   0.018  -5.684
  417   1HB   ALA  56          1HB       ALA  56   4.366  -1.498  -5.014
  418   2HB   ALA  56          2HB       ALA  56   3.695  -1.259  -6.628
  419   3HB   ALA  56          3HB       ALA  56   2.808  -2.208  -5.436
  420    H    VAL  57           H        VAL  57   0.459   0.131  -4.077
  421    HA   VAL  57           HA       VAL  57   1.419   0.081  -1.302
  422    HB   VAL  57           HB       VAL  57  -1.405   0.645  -2.153
  423   1HG1  VAL  57          1HG1      VAL  57   0.200   1.453   0.258
  424   2HG1  VAL  57          2HG1      VAL  57  -1.099   0.262   0.199
  425   3HG1  VAL  57          3HG1      VAL  57  -1.454   1.968  -0.075
  426   1HG2  VAL  57          1HG2      VAL  57  -0.869   3.050  -2.157
  427   2HG2  VAL  57          2HG2      VAL  57  -0.043   2.174  -3.445
  428   3HG2  VAL  57          3HG2      VAL  57   0.841   2.649  -1.994
  429    H    VAL  58           H        VAL  58   0.327  -1.265   0.234
  430    HA   VAL  58           HA       VAL  58  -0.465  -3.803  -0.967
  431    HB   VAL  58           HB       VAL  58  -0.080  -4.496   1.564
  432   1HG1  VAL  58          1HG1      VAL  58   2.224  -5.107   0.940
  433   2HG1  VAL  58          2HG1      VAL  58   2.107  -4.039  -0.460
  434   3HG1  VAL  58          3HG1      VAL  58   1.068  -5.460  -0.344
  435   1HG2  VAL  58          1HG2      VAL  58   1.700  -2.094   1.206
  436   2HG2  VAL  58          2HG2      VAL  58   1.832  -3.274   2.510
  437   3HG2  VAL  58          3HG2      VAL  58   0.392  -2.263   2.376
  438    H    VAL  59           H        VAL  59  -2.557  -4.107  -1.089
  439    HA   VAL  59           HA       VAL  59  -4.291  -3.181   1.045
  440    HB   VAL  59           HB       VAL  59  -6.063  -3.908  -0.621
  441   1HG1  VAL  59          1HG1      VAL  59  -4.207  -1.671  -1.388
  442   2HG1  VAL  59          2HG1      VAL  59  -5.504  -1.569  -0.198
  443   3HG1  VAL  59          3HG1      VAL  59  -5.887  -1.832  -1.900
  444   1HG2  VAL  59          1HG2      VAL  59  -3.694  -3.920  -2.459
  445   2HG2  VAL  59          2HG2      VAL  59  -5.381  -3.990  -2.967
  446   3HG2  VAL  59          3HG2      VAL  59  -4.688  -5.312  -2.028
  447    H    THR  60           H        THR  60  -6.160  -4.747   1.465
  448    HA   THR  60           HA       THR  60  -4.986  -7.437   1.903
  449    HB   THR  60           HB       THR  60  -6.490  -7.448   3.953
  450    HG1  THR  60           HG1      THR  60  -6.736  -4.669   3.304
  451   1HG2  THR  60          1HG2      THR  60  -4.428  -5.246   3.823
  452   2HG2  THR  60          2HG2      THR  60  -4.096  -6.951   4.126
  453   3HG2  THR  60          3HG2      THR  60  -5.029  -6.014   5.293
  454    H    ALA  61           H        ALA  61  -7.398  -8.590   2.921
  455    HA   ALA  61           HA       ALA  61  -8.329  -9.800   0.643
  456   1HB   ALA  61          1HB       ALA  61  -9.767  -9.614   3.279
  457   2HB   ALA  61          2HB       ALA  61  -8.475 -10.750   2.891
  458   3HB   ALA  61          3HB       ALA  61 -10.014 -10.839   2.034
  459    H    THR  62           H        THR  62  -9.973  -7.147   2.409
  460    HA   THR  62           HA       THR  62 -12.338  -7.391   0.780
  461    HB   THR  62           HB       THR  62 -12.669  -4.978   1.830
  462    HG1  THR  62           HG1      THR  62 -11.579  -5.299   4.044
  463   1HG2  THR  62          1HG2      THR  62 -13.719  -6.056   3.770
  464   2HG2  THR  62          2HG2      THR  62 -12.866  -7.553   3.391
  465   3HG2  THR  62          3HG2      THR  62 -14.075  -6.919   2.275
  466    H    GLU  63           H        GLU  63  -9.745  -5.051   1.064
  467    HA   GLU  63           HA       GLU  63 -10.401  -3.352  -1.051
  468   1HB   GLU  63          1HB       GLU  63  -7.611  -4.077  -0.143
  469   2HB   GLU  63          2HB       GLU  63  -8.135  -2.570  -0.882
  470   1HG   GLU  63          1HG       GLU  63  -9.364  -1.954   1.068
  471   2HG   GLU  63          2HG       GLU  63  -9.111  -3.537   1.796
  472    H    HIS  64           H        HIS  64  -9.342  -6.551  -1.024
  473    HA   HIS  64           HA       HIS  64  -7.919  -6.561  -3.489
  474   1HB   HIS  64          1HB       HIS  64  -7.129  -8.382  -2.505
  475   2HB   HIS  64          2HB       HIS  64  -8.419  -8.368  -1.319
  476    HD1  HIS  64           HD1      HIS  64  -7.523  -9.859  -4.686
  477    HD2  HIS  64           HD2      HIS  64 -10.302 -10.343  -1.616
  478    HE1  HIS  64           HE1      HIS  64  -8.686 -12.038  -5.144
  479    HE2  HIS  64           HE2      HIS  64 -10.274 -12.373  -3.210
  480    H    ALA  65           H        ALA  65 -11.280  -7.480  -2.616
  481    HA   ALA  65           HA       ALA  65 -11.644  -9.178  -4.810
  482   1HB   ALA  65          1HB       ALA  65 -13.749  -7.617  -3.325
  483   2HB   ALA  65          2HB       ALA  65 -13.068  -9.161  -2.814
  484   3HB   ALA  65          3HB       ALA  65 -14.009  -9.062  -4.302
  485    H    GLU  66           H        GLU  66 -13.212  -6.040  -4.426
  486    HA   GLU  66           HA       GLU  66 -14.138  -6.021  -7.100
  487   1HB   GLU  66          1HB       GLU  66 -14.593  -3.502  -6.372
  488   2HB   GLU  66          2HB       GLU  66 -15.567  -4.838  -5.784
  489   1HG   GLU  66          1HG       GLU  66 -15.133  -3.577  -3.869
  490   2HG   GLU  66          2HG       GLU  66 -13.957  -4.887  -3.781
  491    H    ALA  67           H        ALA  67 -11.571  -4.213  -5.465
  492    HA   ALA  67           HA       ALA  67 -10.865  -2.678  -7.720
  493   1HB   ALA  67          1HB       ALA  67 -10.296  -2.010  -5.445
  494   2HB   ALA  67          2HB       ALA  67  -8.862  -2.088  -6.469
  495   3HB   ALA  67          3HB       ALA  67  -9.193  -3.379  -5.315
  496    H    GLU  68           H        GLU  68 -10.022  -5.936  -6.769
  497    HA   GLU  68           HA       GLU  68  -7.634  -6.007  -8.340
  498   1HB   GLU  68          1HB       GLU  68  -8.145  -7.552  -6.413
  499   2HB   GLU  68          2HB       GLU  68  -9.254  -8.392  -7.485
  500   1HG   GLU  68          1HG       GLU  68  -7.486  -9.077  -8.914
  501   2HG   GLU  68          2HG       GLU  68  -6.333  -8.024  -8.088
  502    H    LYS  69           H        LYS  69 -10.985  -7.143  -8.862
  503    HA   LYS  69           HA       LYS  69 -10.401  -8.234 -11.388
  504   1HB   LYS  69          1HB       LYS  69 -12.796  -8.129 -11.867
  505   2HB   LYS  69          2HB       LYS  69 -12.483  -8.763 -10.261
  506   1HG   LYS  69          1HG       LYS  69 -12.983  -6.454  -9.385
  507   2HG   LYS  69          2HG       LYS  69 -13.549  -6.060 -11.012
  508   1HD   LYS  69          1HD       LYS  69 -15.123  -7.971 -10.874
  509   2HD   LYS  69          2HD       LYS  69 -14.610  -8.233  -9.207
  510   1HE   LYS  69          1HE       LYS  69 -16.634  -6.996  -9.132
  511   2HE   LYS  69          2HE       LYS  69 -15.330  -5.885  -8.716
  512   1HZ   LYS  69          1HZ       LYS  69 -16.979  -4.955 -10.283
  513   2HZ   LYS  69          2HZ       LYS  69 -16.515  -6.116 -11.429
  514   3HZ   LYS  69          3HZ       LYS  69 -15.400  -4.955 -10.900
  515    H    ARG  70           H        ARG  70 -11.516  -4.931 -10.539
  516    HA   ARG  70           HA       ARG  70 -11.510  -4.055 -13.255
  517   1HB   ARG  70          1HB       ARG  70 -11.634  -1.772 -12.331
  518   2HB   ARG  70          2HB       ARG  70 -12.797  -2.858 -11.587
  519   1HG   ARG  70          1HG       ARG  70 -11.443  -3.041  -9.611
  520   2HG   ARG  70          2HG       ARG  70 -10.155  -2.099 -10.361
  521   1HD   ARG  70          1HD       ARG  70 -11.370  -0.683  -8.857
  522   2HD   ARG  70          2HD       ARG  70 -11.721  -0.181 -10.511
  523    HE   ARG  70           HE       ARG  70 -13.887  -1.175 -10.306
  524   1HH1  ARG  70          1HH1      ARG  70 -12.053  -1.019  -7.328
  525   2HH1  ARG  70          2HH1      ARG  70 -13.446  -1.132  -6.298
  526   1HH2  ARG  70          1HH2      ARG  70 -15.741  -1.299  -8.956
  527   2HH2  ARG  70          2HH2      ARG  70 -15.545  -1.267  -7.227
  528    H    ALA  71           H        ALA  71  -9.120  -3.679 -10.659
  529    HA   ALA  71           HA       ALA  71  -7.459  -2.018 -12.290
  530   1HB   ALA  71          1HB       ALA  71  -7.692  -1.668  -9.877
  531   2HB   ALA  71          2HB       ALA  71  -6.012  -1.889 -10.368
  532   3HB   ALA  71          3HB       ALA  71  -6.886  -3.209  -9.591
  533    H    ALA  72           H        ALA  72  -7.640  -5.438 -11.713
  534    HA   ALA  72           HA       ALA  72  -4.941  -5.881 -12.641
  535   1HB   ALA  72          1HB       ALA  72  -7.203  -7.862 -12.399
  536   2HB   ALA  72          2HB       ALA  72  -5.975  -7.542 -11.173
  537   3HB   ALA  72          3HB       ALA  72  -5.514  -8.247 -12.722
  538    H    ALA  73           H        ALA  73  -8.226  -5.951 -13.995
  539    HA   ALA  73           HA       ALA  73  -7.593  -6.657 -16.613
  540   1HB   ALA  73          1HB       ALA  73  -9.558  -5.355 -17.288
  541   2HB   ALA  73          2HB       ALA  73  -9.591  -4.586 -15.702
  542   3HB   ALA  73          3HB       ALA  73  -9.887  -6.318 -15.848
  543    H    ARG  74           H        ARG  74  -7.125  -3.627 -14.901
  544    HA   ARG  74           HA       ARG  74  -6.077  -2.230 -17.207
  545   1HB   ARG  74          1HB       ARG  74  -7.206  -1.180 -15.183
  546   2HB   ARG  74          2HB       ARG  74  -5.711  -1.485 -14.310
  547   1HG   ARG  74          1HG       ARG  74  -5.117   0.553 -14.986
  548   2HG   ARG  74          2HG       ARG  74  -4.820  -0.201 -16.555
  549   1HD   ARG  74          1HD       ARG  74  -6.226   1.797 -16.768
  550   2HD   ARG  74          2HD       ARG  74  -7.092   0.337 -17.257
  551    HE   ARG  74           HE       ARG  74  -7.474   1.045 -14.486
  552   1HH1  ARG  74          1HH1      ARG  74  -8.633   1.626 -17.744
  553   2HH1  ARG  74          2HH1      ARG  74 -10.235   2.056 -17.231
  554   1HH2  ARG  74          1HH2      ARG  74  -9.526   1.603 -13.815
  555   2HH2  ARG  74          2HH2      ARG  74 -10.754   2.042 -14.972
  556    H    ALA  75           H        ALA  75  -4.759  -4.020 -14.493
  557    HA   ALA  75           HA       ALA  75  -2.140  -3.046 -14.463
  558   1HB   ALA  75          1HB       ALA  75  -1.579  -5.017 -13.162
  559   2HB   ALA  75          2HB       ALA  75  -3.089  -5.789 -13.644
  560   3HB   ALA  75          3HB       ALA  75  -3.122  -4.343 -12.636
  561    H    GLY  76           H        GLY  76  -3.447  -5.917 -16.132
  562   1HA   GLY  76          1HA       GLY  76  -0.826  -6.568 -17.160
  563   2HA   GLY  76          2HA       GLY  76  -2.323  -7.412 -17.520
  564    H    HIS  77           H        HIS  77  -3.240  -7.079 -19.437
  565    HA   HIS  77           HA       HIS  77  -3.648  -6.294 -21.526
  566   1HB   HIS  77          1HB       HIS  77  -4.461  -4.283 -20.498
  567   2HB   HIS  77          2HB       HIS  77  -2.829  -3.687 -20.230
  568    HD1  HIS  77           HD1      HIS  77  -2.016  -2.057 -21.895
  569    HD2  HIS  77           HD2      HIS  77  -5.087  -4.425 -23.411
  570    HE1  HIS  77           HE1      HIS  77  -2.540  -1.123 -24.178
  571    HE2  HIS  77           HE2      HIS  77  -4.527  -2.448 -24.987
  572    H    ALA  78           H        ALA  78  -0.890  -4.222 -20.705
  573    HA   ALA  78           HA       ALA  78   0.890  -5.740 -22.417
  574   1HB   ALA  78          1HB       ALA  78   0.225  -2.856 -23.023
  575   2HB   ALA  78          2HB       ALA  78  -0.200  -4.249 -24.017
  576   3HB   ALA  78          3HB       ALA  78   1.492  -3.806 -23.800
  577    H    ALA  79           H        ALA  79   1.053  -5.575 -19.760
  578    HA   ALA  79           HA       ALA  79   2.488  -3.325 -18.779
  579   1HB   ALA  79          1HB       ALA  79   1.128  -4.746 -17.319
  580   2HB   ALA  79          2HB       ALA  79   2.794  -4.632 -16.751
  581   3HB   ALA  79          3HB       ALA  79   2.244  -6.085 -17.586
  582    H    THR  80           H        THR  80   4.230  -3.034 -20.160
  583    HA   THR  80           HA       THR  80   6.639  -4.259 -19.383
  584    HB   THR  80           HB       THR  80   5.769  -6.094 -20.833
  585    HG1  THR  80           HG1      THR  80   8.028  -4.789 -21.997
  586   1HG2  THR  80          1HG2      THR  80   5.705  -5.777 -23.274
  587   2HG2  THR  80          2HG2      THR  80   5.979  -4.049 -23.049
  588   3HG2  THR  80          3HG2      THR  80   4.496  -4.793 -22.451
  Start of MODEL   21
    1    H    MET   1           H        MET   1   9.524  -0.655   0.172
    2    HA   MET   1           HA       MET   1   8.034   0.047   1.969
    3   1HB   MET   1          1HB       MET   1   5.689  -0.148   1.768
    4   2HB   MET   1          2HB       MET   1   6.196   0.691   0.311
    5   1HG   MET   1          1HG       MET   1   5.534  -2.238   0.524
    6   2HG   MET   1          2HG       MET   1   4.496  -0.989  -0.156
    7   1HE   MET   1          1HE       MET   1   4.208  -2.445  -2.376
    8   2HE   MET   1          2HE       MET   1   5.228  -3.687  -1.650
    9   3HE   MET   1          3HE       MET   1   5.570  -3.107  -3.281
   10    H    HIS   2           H        HIS   2   6.863  -1.673   3.295
   11    HA   HIS   2           HA       HIS   2   8.171  -4.235   2.708
   12   1HB   HIS   2          1HB       HIS   2   7.018  -3.101   5.260
   13   2HB   HIS   2          2HB       HIS   2   7.608  -4.754   5.113
   14    HD1  HIS   2           HD1      HIS   2   8.820  -2.434   6.974
   15    HD2  HIS   2           HD2      HIS   2  10.357  -3.815   3.363
   16    HE1  HIS   2           HE1      HIS   2  11.273  -1.880   7.025
   17    HE2  HIS   2           HE2      HIS   2  12.212  -2.930   4.931
   18    H    ALA   3           H        ALA   3   7.010  -5.708   1.744
   19    HA   ALA   3           HA       ALA   3   4.158  -5.958   2.436
   20   1HB   ALA   3          1HB       ALA   3   5.362  -6.272  -0.317
   21   2HB   ALA   3          2HB       ALA   3   4.364  -4.922   0.223
   22   3HB   ALA   3          3HB       ALA   3   3.672  -6.540   0.109
   23    H    LYS   4           H        LYS   4   3.303  -8.110   2.249
   24    HA   LYS   4           HA       LYS   4   5.385 -10.192   2.301
   25   1HB   LYS   4          1HB       LYS   4   2.922  -9.957   4.043
   26   2HB   LYS   4          2HB       LYS   4   3.955 -11.379   3.974
   27   1HG   LYS   4          1HG       LYS   4   4.806  -8.626   4.852
   28   2HG   LYS   4          2HG       LYS   4   4.465  -9.995   5.915
   29   1HD   LYS   4          1HD       LYS   4   6.292 -11.246   4.946
   30   2HD   LYS   4          2HD       LYS   4   6.587  -9.964   3.773
   31   1HE   LYS   4          1HE       LYS   4   7.140  -8.437   5.614
   32   2HE   LYS   4          2HE       LYS   4   6.890  -9.753   6.763
   33   1HZ   LYS   4          1HZ       LYS   4   8.886  -9.788   4.567
   34   2HZ   LYS   4          2HZ       LYS   4   8.693 -10.959   5.776
   35   3HZ   LYS   4          3HZ       LYS   4   9.240  -9.409   6.182
   36    H    VAL   5           H        VAL   5   4.332 -12.423   2.043
   37    HA   VAL   5           HA       VAL   5   2.790 -12.453  -0.364
   38    HB   VAL   5           HB       VAL   5   4.326 -14.244  -0.149
   39   1HG1  VAL   5          1HG1      VAL   5   3.113 -14.854   2.543
   40   2HG1  VAL   5          2HG1      VAL   5   4.692 -14.123   2.253
   41   3HG1  VAL   5          3HG1      VAL   5   4.383 -15.786   1.752
   42   1HG2  VAL   5          1HG2      VAL   5   1.609 -15.363   0.535
   43   2HG2  VAL   5          2HG2      VAL   5   2.950 -16.272  -0.164
   44   3HG2  VAL   5          3HG2      VAL   5   2.196 -14.968  -1.080
   45    H    GLY   6           H        GLY   6   0.664 -12.849  -0.645
   46   1HA   GLY   6          1HA       GLY   6  -1.535 -13.399   0.030
   47   2HA   GLY   6          2HA       GLY   6  -0.999 -13.369   1.709
   48    H    ASP   7           H        ASP   7   0.297 -10.802   0.051
   49    HA   ASP   7           HA       ASP   7  -1.850  -8.980   1.025
   50   1HB   ASP   7          1HB       ASP   7   1.120  -8.532   0.589
   51   2HB   ASP   7          2HB       ASP   7  -0.017  -7.204   0.783
   52    H    TYR   8           H        TYR   8  -2.160  -7.033  -0.384
   53    HA   TYR   8           HA       TYR   8  -2.172  -7.946  -3.178
   54   1HB   TYR   8          1HB       TYR   8  -4.058  -6.501  -1.473
   55   2HB   TYR   8          2HB       TYR   8  -3.807  -5.712  -3.022
   56    HD1  TYR   8           HD1      TYR   8  -4.250  -9.248  -1.860
   57    HD2  TYR   8           HD2      TYR   8  -5.432  -6.174  -4.549
   58    HE1  TYR   8           HE1      TYR   8  -5.896 -10.771  -2.876
   59    HE2  TYR   8           HE2      TYR   8  -7.077  -7.691  -5.574
   60    HH   TYR   8           HH       TYR   8  -7.282 -10.297  -5.792
   61    H    LEU   9           H        LEU   9  -1.551  -6.676  -4.826
   62    HA   LEU   9           HA       LEU   9   0.132  -4.373  -4.188
   63   1HB   LEU   9          1HB       LEU   9   1.077  -6.249  -5.521
   64   2HB   LEU   9          2HB       LEU   9  -0.139  -5.961  -6.746
   65    HG   LEU   9           HG       LEU   9   1.762  -3.760  -6.005
   66   1HD1  LEU   9          1HD1      LEU   9   3.291  -4.563  -7.743
   67   2HD1  LEU   9          2HD1      LEU   9   2.320  -6.026  -7.914
   68   3HD1  LEU   9          3HD1      LEU   9   3.169  -5.703  -6.403
   69   1HD2  LEU   9          1HD2      LEU   9  -0.108  -3.231  -7.482
   70   2HD2  LEU   9          2HD2      LEU   9   0.367  -4.535  -8.568
   71   3HD2  LEU   9          3HD2      LEU   9   1.423  -3.140  -8.353
   72    H    VAL  10           H        VAL  10  -0.433  -2.409  -4.697
   73    HA   VAL  10           HA       VAL  10  -2.571  -1.893  -6.665
   74    HB   VAL  10           HB       VAL  10  -2.073  -0.492  -4.023
   75   1HG1  VAL  10          1HG1      VAL  10  -3.842   1.079  -4.634
   76   2HG1  VAL  10          2HG1      VAL  10  -3.965   0.330  -6.226
   77   3HG1  VAL  10          3HG1      VAL  10  -2.490   1.177  -5.764
   78   1HG2  VAL  10          1HG2      VAL  10  -4.511  -1.888  -5.107
   79   2HG2  VAL  10          2HG2      VAL  10  -4.402  -1.056  -3.555
   80   3HG2  VAL  10          3HG2      VAL  10  -3.430  -2.498  -3.854
   81    H    VAL  11           H        VAL  11  -2.153  -0.130  -8.053
   82    HA   VAL  11           HA       VAL  11   0.473   1.147  -7.741
   83    HB   VAL  11           HB       VAL  11  -1.340   1.135 -10.162
   84   1HG1  VAL  11          1HG1      VAL  11   1.498   2.102  -9.829
   85   2HG1  VAL  11          2HG1      VAL  11   0.074   3.116 -10.064
   86   3HG1  VAL  11          3HG1      VAL  11   0.608   2.033 -11.351
   87   1HG2  VAL  11          1HG2      VAL  11  -0.461  -1.083  -9.699
   88   2HG2  VAL  11          2HG2      VAL  11   1.174  -0.428  -9.602
   89   3HG2  VAL  11          3HG2      VAL  11   0.301  -0.398 -11.134
   90    H    LYS  12           H        LYS  12   0.172   2.811  -6.383
   91    HA   LYS  12           HA       LYS  12  -2.117   4.485  -6.349
   92   1HB   LYS  12          1HB       LYS  12  -0.743   4.357  -4.382
   93   2HB   LYS  12          2HB       LYS  12   0.687   4.834  -5.281
   94   1HG   LYS  12          1HG       LYS  12  -1.389   6.842  -5.451
   95   2HG   LYS  12          2HG       LYS  12  -0.953   6.478  -3.779
   96   1HD   LYS  12          1HD       LYS  12   1.391   6.879  -4.282
   97   2HD   LYS  12          2HD       LYS  12   0.997   7.173  -5.977
   98   1HE   LYS  12          1HE       LYS  12  -0.334   9.118  -5.328
   99   2HE   LYS  12          2HE       LYS  12   0.045   8.816  -3.632
  100   1HZ   LYS  12          1HZ       LYS  12   2.385   9.166  -4.127
  101   2HZ   LYS  12          2HZ       LYS  12   1.475  10.528  -4.559
  102   3HZ   LYS  12          3HZ       LYS  12   2.019   9.461  -5.754
  103    H    GLY  13           H        GLY  13   1.022   4.615  -7.915
  104   1HA   GLY  13          1HA       GLY  13   1.547   5.558  -9.951
  105   2HA   GLY  13          2HA       GLY  13  -0.086   6.196 -10.044
  106    H    THR  14           H        THR  14   2.327   7.542 -10.744
  107    HA   THR  14           HA       THR  14   2.679   9.511  -8.618
  108    HB   THR  14           HB       THR  14   4.134   9.386 -11.262
  109    HG1  THR  14           HG1      THR  14   4.573   7.990  -8.814
  110   1HG2  THR  14          1HG2      THR  14   5.865  10.618 -10.038
  111   2HG2  THR  14          2HG2      THR  14   4.850  10.610  -8.595
  112   3HG2  THR  14          3HG2      THR  14   4.332  11.489 -10.034
  113    H    THR  15           H        THR  15   1.346   9.126 -11.843
  114    HA   THR  15           HA       THR  15   0.309  11.880 -11.676
  115    HB   THR  15           HB       THR  15   1.159  10.767 -14.328
  116    HG1  THR  15           HG1      THR  15   2.884  12.274 -12.615
  117   1HG2  THR  15          1HG2      THR  15   1.007  13.566 -13.199
  118   2HG2  THR  15          2HG2      THR  15  -0.174  12.818 -14.276
  119   3HG2  THR  15          3HG2      THR  15   1.463  13.147 -14.849
  120    H    THR  16           H        THR  16  -0.575   8.776 -11.713
  121    HA   THR  16           HA       THR  16  -2.408   8.764 -13.941
  122    HB   THR  16           HB       THR  16  -1.258   6.698 -13.350
  123    HG1  THR  16           HG1      THR  16  -3.714   5.797 -12.640
  124   1HG2  THR  16          1HG2      THR  16  -1.074   7.036 -10.934
  125   2HG2  THR  16          2HG2      THR  16  -1.804   5.475 -11.307
  126   3HG2  THR  16          3HG2      THR  16  -2.817   6.813 -10.768
  127    H    GLU  17           H        GLU  17  -2.541   9.436 -10.555
  128    HA   GLU  17           HA       GLU  17  -4.098  10.051  -9.083
  129   1HB   GLU  17          1HB       GLU  17  -5.833  11.476  -9.688
  130   2HB   GLU  17          2HB       GLU  17  -4.638  11.706 -10.946
  131   1HG   GLU  17          1HG       GLU  17  -6.572  11.670 -12.151
  132   2HG   GLU  17          2HG       GLU  17  -6.087   9.981 -12.251
  133    H    ARG  18           H        ARG  18  -5.586   8.047 -11.615
  134    HA   ARG  18           HA       ARG  18  -7.345   6.712  -9.808
  135   1HB   ARG  18          1HB       ARG  18  -6.439   6.329 -12.606
  136   2HB   ARG  18          2HB       ARG  18  -6.971   4.882 -11.766
  137   1HG   ARG  18          1HG       ARG  18  -8.664   7.352 -11.859
  138   2HG   ARG  18          2HG       ARG  18  -8.678   6.164 -13.162
  139   1HD   ARG  18          1HD       ARG  18 -10.469   5.593 -11.732
  140   2HD   ARG  18          2HD       ARG  18  -9.192   4.424 -11.407
  141    HE   ARG  18           HE       ARG  18  -9.353   6.758  -9.657
  142   1HH1  ARG  18          1HH1      ARG  18  -9.998   3.337 -10.142
  143   2HH1  ARG  18          2HH1      ARG  18 -10.256   3.032  -8.450
  144   1HH2  ARG  18          1HH2      ARG  18  -9.707   6.331  -7.434
  145   2HH2  ARG  18          2HH2      ARG  18 -10.109   4.713  -6.930
  146    H    HIS  19           H        HIS  19  -6.426   5.793  -8.059
  147    HA   HIS  19           HA       HIS  19  -3.904   4.414  -8.205
  148   1HB   HIS  19          1HB       HIS  19  -5.874   4.201  -5.922
  149   2HB   HIS  19          2HB       HIS  19  -4.123   4.029  -5.875
  150    HD1  HIS  19           HD1      HIS  19  -2.916   6.459  -6.811
  151    HD2  HIS  19           HD2      HIS  19  -6.613   6.596  -4.916
  152    HE1  HIS  19           HE1      HIS  19  -3.188   8.829  -6.033
  153    HE2  HIS  19           HE2      HIS  19  -5.552   8.943  -5.172
  154    H    ASP  20           H        ASP  20  -4.107   2.809  -9.652
  155    HA   ASP  20           HA       ASP  20  -6.355   0.937  -9.340
  156   1HB   ASP  20          1HB       ASP  20  -6.439   2.700 -11.245
  157   2HB   ASP  20          2HB       ASP  20  -5.192   1.721 -12.007
  158    H    GLN  21           H        GLN  21  -5.561  -0.735 -11.483
  159    HA   GLN  21           HA       GLN  21  -4.374  -2.626 -11.835
  160   1HB   GLN  21          1HB       GLN  21  -2.036  -0.932 -10.936
  161   2HB   GLN  21          2HB       GLN  21  -1.929  -2.437 -11.842
  162   1HG   GLN  21          1HG       GLN  21  -3.113  -1.412 -13.710
  163   2HG   GLN  21          2HG       GLN  21  -3.257   0.091 -12.801
  164   1HE2  GLN  21          1HE2      GLN  21  -0.400  -1.920 -12.756
  165   2HE2  GLN  21          2HE2      GLN  21   0.621  -0.816 -13.608
  166    H    HIS  22           H        HIS  22  -5.165  -4.081 -10.365
  167    HA   HIS  22           HA       HIS  22  -3.772  -4.264  -7.773
  168   1HB   HIS  22          1HB       HIS  22  -6.761  -4.582  -8.125
  169   2HB   HIS  22          2HB       HIS  22  -5.870  -4.761  -6.625
  170    HD1  HIS  22           HD1      HIS  22  -4.305  -1.906  -7.785
  171    HD2  HIS  22           HD2      HIS  22  -8.198  -2.641  -6.535
  172    HE1  HIS  22           HE1      HIS  22  -5.252   0.332  -7.136
  173    HE2  HIS  22           HE2      HIS  22  -7.573  -0.144  -6.290
  174    H    ALA  23           H        ALA  23  -3.435  -6.270  -6.987
  175    HA   ALA  23           HA       ALA  23  -4.968  -8.618  -7.472
  176   1HB   ALA  23          1HB       ALA  23  -2.423  -8.548  -9.100
  177   2HB   ALA  23          2HB       ALA  23  -4.062  -8.546  -9.754
  178   3HB   ALA  23          3HB       ALA  23  -3.473  -9.945  -8.857
  179    H    GLU  24           H        GLU  24  -3.529 -10.590  -6.755
  180    HA   GLU  24           HA       GLU  24  -2.369  -9.586  -4.247
  181   1HB   GLU  24          1HB       GLU  24  -4.160 -11.244  -4.013
  182   2HB   GLU  24          2HB       GLU  24  -3.238 -12.393  -4.977
  183   1HG   GLU  24          1HG       GLU  24  -1.464 -12.357  -3.251
  184   2HG   GLU  24          2HG       GLU  24  -2.473 -11.297  -2.274
  185    H    ILE  25           H        ILE  25  -0.400 -10.201  -3.456
  186    HA   ILE  25           HA       ILE  25   1.483 -11.252  -5.448
  187    HB   ILE  25           HB       ILE  25   2.503 -10.125  -2.906
  188   1HG1  ILE  25          1HG1      ILE  25   1.336  -8.313  -5.040
  189   2HG1  ILE  25          2HG1      ILE  25   0.613  -8.585  -3.457
  190   1HG2  ILE  25          1HG2      ILE  25   3.985 -10.863  -4.672
  191   2HG2  ILE  25          2HG2      ILE  25   4.128  -9.119  -4.455
  192   3HG2  ILE  25          3HG2      ILE  25   3.206  -9.766  -5.812
  193   1HD1  ILE  25          1HD1      ILE  25   2.581  -7.614  -2.391
  194   2HD1  ILE  25          2HD1      ILE  25   1.845  -6.488  -3.532
  195   3HD1  ILE  25          3HD1      ILE  25   3.314  -7.359  -3.975
  196    H    ILE  26           H        ILE  26   1.864 -13.377  -5.225
  197    HA   ILE  26           HA       ILE  26   1.694 -14.527  -2.527
  198    HB   ILE  26           HB       ILE  26   1.188 -16.643  -3.406
  199   1HG1  ILE  26          1HG1      ILE  26   2.881 -16.539  -5.302
  200   2HG1  ILE  26          2HG1      ILE  26   1.360 -17.324  -5.701
  201   1HG2  ILE  26          1HG2      ILE  26  -0.238 -14.565  -5.095
  202   2HG2  ILE  26          2HG2      ILE  26  -0.697 -15.104  -3.479
  203   3HG2  ILE  26          3HG2      ILE  26  -0.793 -16.220  -4.841
  204   1HD1  ILE  26          1HD1      ILE  26   2.115 -15.940  -7.517
  205   2HD1  ILE  26          2HD1      ILE  26   2.165 -14.531  -6.458
  206   3HD1  ILE  26          3HD1      ILE  26   0.621 -15.294  -6.839
  207    H    GLU  27           H        GLU  27   3.877 -13.761  -5.024
  208    HA   GLU  27           HA       GLU  27   5.972 -15.052  -3.434
  209   1HB   GLU  27          1HB       GLU  27   5.917 -14.964  -6.458
  210   2HB   GLU  27          2HB       GLU  27   7.258 -15.544  -5.481
  211   1HG   GLU  27          1HG       GLU  27   5.689 -17.256  -4.522
  212   2HG   GLU  27          2HG       GLU  27   4.519 -16.758  -5.740
  213    H    VAL  28           H        VAL  28   6.861 -13.446  -2.451
  214    HA   VAL  28           HA       VAL  28   7.396 -10.946  -3.918
  215    HB   VAL  28           HB       VAL  28   7.146 -11.236  -0.924
  216   1HG1  VAL  28          1HG1      VAL  28   7.152  -8.816  -2.723
  217   2HG1  VAL  28          2HG1      VAL  28   8.451  -9.324  -1.646
  218   3HG1  VAL  28          3HG1      VAL  28   6.910  -8.790  -0.975
  219   1HG2  VAL  28          1HG2      VAL  28   4.923 -10.234  -1.120
  220   2HG2  VAL  28          2HG2      VAL  28   5.006 -11.799  -1.931
  221   3HG2  VAL  28          3HG2      VAL  28   5.043 -10.311  -2.879
  222    H    ARG  29           H        ARG  29   9.488 -11.268  -4.595
  223    HA   ARG  29           HA       ARG  29  11.429 -12.136  -2.571
  224   1HB   ARG  29          1HB       ARG  29  11.266 -13.392  -4.770
  225   2HB   ARG  29          2HB       ARG  29  11.905 -11.951  -5.549
  226   1HG   ARG  29          1HG       ARG  29  13.963 -12.129  -4.314
  227   2HG   ARG  29          2HG       ARG  29  13.314 -13.455  -3.352
  228   1HD   ARG  29          1HD       ARG  29  14.808 -14.291  -5.077
  229   2HD   ARG  29          2HD       ARG  29  13.157 -14.839  -5.360
  230    HE   ARG  29           HE       ARG  29  13.427 -12.527  -6.840
  231   1HH1  ARG  29          1HH1      ARG  29  15.055 -15.629  -6.689
  232   2HH1  ARG  29          2HH1      ARG  29  15.448 -15.652  -8.385
  233   1HH2  ARG  29          1HH2      ARG  29  13.950 -12.537  -9.068
  234   2HH2  ARG  29          2HH2      ARG  29  14.840 -13.881  -9.736
  235    H    SER  30           H        SER  30  10.640  -9.725  -2.049
  236    HA   SER  30           HA       SER  30  13.007  -8.142  -2.536
  237   1HB   SER  30          1HB       SER  30  11.538  -7.446  -4.398
  238   2HB   SER  30          2HB       SER  30  10.256  -7.072  -3.246
  239    HG   SER  30           HG       SER  30  12.671  -5.721  -3.748
  240    H    ALA  31           H        ALA  31  13.596  -7.335  -0.638
  241    HA   ALA  31           HA       ALA  31  11.691  -7.345   1.561
  242   1HB   ALA  31          1HB       ALA  31  13.905  -8.336   1.903
  243   2HB   ALA  31          2HB       ALA  31  13.625  -6.975   2.991
  244   3HB   ALA  31          3HB       ALA  31  14.652  -6.773   1.571
  245    H    ASP  32           H        ASP  32  13.327  -5.118  -0.528
  246    HA   ASP  32           HA       ASP  32  12.694  -2.835   1.162
  247   1HB   ASP  32          1HB       ASP  32  14.852  -2.931  -0.057
  248   2HB   ASP  32          2HB       ASP  32  13.968  -2.904  -1.580
  249    H    GLY  33           H        GLY  33  11.450  -4.499  -1.613
  250   1HA   GLY  33          1HA       GLY  33   9.152  -4.311  -2.201
  251   2HA   GLY  33          2HA       GLY  33   9.162  -2.661  -1.591
  252    H    SER  34           H        SER  34  10.566  -4.687  -4.150
  253    HA   SER  34           HA       SER  34   9.985  -2.574  -6.068
  254   1HB   SER  34          1HB       SER  34  12.743  -3.766  -5.686
  255   2HB   SER  34          2HB       SER  34  12.269  -2.758  -7.054
  256    HG   SER  34           HG       SER  34  11.599  -1.587  -4.703
  257    HA   PRO  35           HA       PRO  35   8.815  -5.975  -8.654
  258   1HB   PRO  35          1HB       PRO  35   9.706  -4.375 -10.963
  259   2HB   PRO  35          2HB       PRO  35   8.085  -4.936 -10.548
  260   1HG   PRO  35          1HG       PRO  35   8.767  -2.351 -10.353
  261   2HG   PRO  35          2HG       PRO  35   7.653  -3.113  -9.202
  262   1HD   PRO  35          1HD       PRO  35  10.565  -2.476  -8.883
  263   2HD   PRO  35          2HD       PRO  35   9.233  -2.267  -7.726
  264    HA   PRO  36           HA       PRO  36   8.682  -6.869 -10.979
  265   1HB   PRO  36          1HB       PRO  36   9.335  -9.639 -11.452
  266   2HB   PRO  36          2HB       PRO  36   9.097  -8.351 -12.634
  267   1HG   PRO  36          1HG       PRO  36  11.508  -9.558 -12.140
  268   2HG   PRO  36          2HG       PRO  36  11.334  -7.920 -12.791
  269   1HD   PRO  36          1HD       PRO  36  11.920  -8.800  -9.993
  270   2HD   PRO  36          2HD       PRO  36  12.590  -7.432 -10.909
  271    H    TYR  37           H        TYR  37   6.814  -7.994 -10.302
  272    HA   TYR  37           HA       TYR  37   7.175  -9.427  -7.739
  273   1HB   TYR  37          1HB       TYR  37   4.851  -7.796  -8.770
  274   2HB   TYR  37          2HB       TYR  37   4.741  -8.838  -7.359
  275    HD1  TYR  37           HD1      TYR  37   5.954  -5.673  -8.670
  276    HD2  TYR  37           HD2      TYR  37   5.976  -8.273  -5.304
  277    HE1  TYR  37           HE1      TYR  37   6.727  -3.820  -7.249
  278    HE2  TYR  37           HE2      TYR  37   6.756  -6.431  -3.874
  279    HH   TYR  37           HH       TYR  37   6.738  -3.180  -4.901
  280    H    VAL  38           H        VAL  38   6.107 -11.420  -7.432
  281    HA   VAL  38           HA       VAL  38   4.959 -12.540  -9.892
  282    HB   VAL  38           HB       VAL  38   5.654 -13.968  -7.319
  283   1HG1  VAL  38          1HG1      VAL  38   5.363 -16.003  -8.679
  284   2HG1  VAL  38          2HG1      VAL  38   4.817 -15.002 -10.025
  285   3HG1  VAL  38          3HG1      VAL  38   3.875 -15.068  -8.535
  286   1HG2  VAL  38          1HG2      VAL  38   7.136 -13.862  -9.947
  287   2HG2  VAL  38          2HG2      VAL  38   7.548 -14.898  -8.581
  288   3HG2  VAL  38          3HG2      VAL  38   7.659 -13.144  -8.424
  289    H    VAL  39           H        VAL  39   2.896 -12.166 -10.097
  290    HA   VAL  39           HA       VAL  39   1.322 -11.770  -7.653
  291    HB   VAL  39           HB       VAL  39   1.322 -10.209 -10.231
  292   1HG1  VAL  39          1HG1      VAL  39  -0.994 -10.592  -9.632
  293   2HG1  VAL  39          2HG1      VAL  39  -0.552  -8.916  -9.303
  294   3HG1  VAL  39          3HG1      VAL  39  -0.675 -10.074  -7.978
  295   1HG2  VAL  39          1HG2      VAL  39   1.738  -9.436  -7.344
  296   2HG2  VAL  39          2HG2      VAL  39   1.716  -8.317  -8.708
  297   3HG2  VAL  39          3HG2      VAL  39   2.981  -9.542  -8.592
  298    H    ARG  40           H        ARG  40  -0.262 -13.039  -7.391
  299    HA   ARG  40           HA       ARG  40  -1.477 -14.484  -9.629
  300   1HB   ARG  40          1HB       ARG  40  -0.567 -15.829  -7.785
  301   2HB   ARG  40          2HB       ARG  40  -1.566 -14.950  -6.640
  302   1HG   ARG  40          1HG       ARG  40  -3.570 -15.839  -7.735
  303   2HG   ARG  40          2HG       ARG  40  -2.536 -16.765  -8.829
  304   1HD   ARG  40          1HD       ARG  40  -1.556 -17.938  -6.934
  305   2HD   ARG  40          2HD       ARG  40  -2.547 -16.993  -5.823
  306    HE   ARG  40           HE       ARG  40  -3.833 -18.675  -7.852
  307   1HH1  ARG  40          1HH1      ARG  40  -3.121 -17.961  -4.499
  308   2HH1  ARG  40          2HH1      ARG  40  -4.348 -19.013  -3.864
  309   1HH2  ARG  40          1HH2      ARG  40  -5.495 -20.057  -7.016
  310   2HH2  ARG  40          2HH2      ARG  40  -5.682 -20.211  -5.295
  311    H    TRP  41           H        TRP  41  -3.567 -14.153 -10.114
  312    HA   TRP  41           HA       TRP  41  -4.884 -11.868  -8.814
  313   1HB   TRP  41          1HB       TRP  41  -5.550 -13.252 -11.438
  314   2HB   TRP  41          2HB       TRP  41  -6.191 -11.718 -10.868
  315    HD1  TRP  41           HD1      TRP  41  -2.445 -12.194 -10.468
  316    HE1  TRP  41           HE1      TRP  41  -1.217 -10.725 -12.180
  317    HE3  TRP  41           HE3      TRP  41  -6.434 -10.735 -13.275
  318    HZ2  TRP  41           HZ2      TRP  41  -1.852  -9.150 -14.414
  319    HZ3  TRP  41           HZ3      TRP  41  -6.036  -9.239 -15.165
  320    HH2  TRP  41           HH2      TRP  41  -3.799  -8.466 -15.741
  321    H    LEU  42           H        LEU  42  -6.452 -12.335  -7.394
  322    HA   LEU  42           HA       LEU  42  -7.018 -15.116  -6.928
  323   1HB   LEU  42          1HB       LEU  42  -8.244 -12.770  -5.506
  324   2HB   LEU  42          2HB       LEU  42  -8.068 -14.411  -4.915
  325    HG   LEU  42           HG       LEU  42  -5.957 -12.303  -5.222
  326   1HD1  LEU  42          1HD1      LEU  42  -5.551 -12.811  -2.881
  327   2HD1  LEU  42          2HD1      LEU  42  -6.817 -14.038  -2.920
  328   3HD1  LEU  42          3HD1      LEU  42  -7.227 -12.339  -3.153
  329   1HD2  LEU  42          1HD2      LEU  42  -5.513 -15.247  -4.772
  330   2HD2  LEU  42          2HD2      LEU  42  -4.285 -13.987  -4.646
  331   3HD2  LEU  42          3HD2      LEU  42  -5.044 -14.328  -6.202
  332    H    VAL  43           H        VAL  43  -8.994 -12.274  -7.743
  333    HA   VAL  43           HA       VAL  43 -11.286 -14.024  -8.040
  334    HB   VAL  43           HB       VAL  43 -12.381 -11.678  -8.506
  335   1HG1  VAL  43          1HG1      VAL  43 -12.822 -11.468  -6.099
  336   2HG1  VAL  43          2HG1      VAL  43 -11.504 -12.593  -5.771
  337   3HG1  VAL  43          3HG1      VAL  43 -12.938 -13.144  -6.638
  338   1HG2  VAL  43          1HG2      VAL  43 -11.327  -9.900  -7.200
  339   2HG2  VAL  43          2HG2      VAL  43 -10.303 -10.412  -8.542
  340   3HG2  VAL  43          3HG2      VAL  43  -9.943 -10.950  -6.901
  341    H    ASN  44           H        ASN  44  -8.918 -12.490  -9.949
  342    HA   ASN  44           HA       ASN  44 -10.521 -12.575 -12.361
  343   1HB   ASN  44          1HB       ASN  44  -7.638 -11.928 -11.806
  344   2HB   ASN  44          2HB       ASN  44  -8.230 -12.128 -13.452
  345   1HD2  ASN  44          1HD2      ASN  44  -8.408 -10.214 -10.551
  346   2HD2  ASN  44          2HD2      ASN  44  -9.128  -8.824 -11.297
  347    H    GLY  45           H        GLY  45  -8.047 -14.549 -10.805
  348   1HA   GLY  45          1HA       GLY  45  -7.877 -16.873 -11.016
  349   2HA   GLY  45          2HA       GLY  45  -8.927 -16.802 -12.422
  350    H    HIS  46           H        HIS  46  -6.019 -14.876 -11.968
  351    HA   HIS  46           HA       HIS  46  -4.735 -16.457 -14.093
  352   1HB   HIS  46          1HB       HIS  46  -5.129 -13.513 -13.895
  353   2HB   HIS  46          2HB       HIS  46  -3.579 -14.073 -14.514
  354    HD1  HIS  46           HD1      HIS  46  -4.511 -12.806 -16.735
  355    HD2  HIS  46           HD2      HIS  46  -6.353 -16.389 -15.686
  356    HE1  HIS  46           HE1      HIS  46  -5.709 -13.588 -18.798
  357    HE2  HIS  46           HE2      HIS  46  -6.627 -15.850 -18.204
  358    H    GLU  47           H        GLU  47  -2.335 -16.153 -14.129
  359    HA   GLU  47           HA       GLU  47  -1.199 -15.369 -11.549
  360   1HB   GLU  47          1HB       GLU  47  -1.704 -17.937 -11.850
  361   2HB   GLU  47          2HB       GLU  47  -0.245 -17.903 -12.827
  362   1HG   GLU  47          1HG       GLU  47   1.069 -17.183 -10.984
  363   2HG   GLU  47          2HG       GLU  47  -0.368 -16.903 -10.000
  364    H    THR  48           H        THR  48   0.429 -14.006 -11.928
  365    HA   THR  48           HA       THR  48   1.712 -14.049 -14.580
  366    HB   THR  48           HB       THR  48   1.372 -11.598 -14.741
  367    HG1  THR  48           HG1      THR  48   0.419 -12.015 -12.213
  368   1HG2  THR  48          1HG2      THR  48  -1.207 -13.151 -14.437
  369   2HG2  THR  48          2HG2      THR  48  -0.216 -13.078 -15.894
  370   3HG2  THR  48          3HG2      THR  48  -1.020 -11.623 -15.302
  371    H    THR  49           H        THR  49   3.554 -12.536 -14.721
  372    HA   THR  49           HA       THR  49   4.664 -11.708 -12.112
  373    HB   THR  49           HB       THR  49   6.210 -12.175 -14.679
  374    HG1  THR  49           HG1      THR  49   5.279 -13.931 -12.836
  375   1HG2  THR  49          1HG2      THR  49   8.179 -12.053 -13.244
  376   2HG2  THR  49          2HG2      THR  49   7.154 -11.790 -11.833
  377   3HG2  THR  49          3HG2      THR  49   7.231 -10.571 -13.105
  378    H    VAL  50           H        VAL  50   4.010  -9.607 -11.904
  379    HA   VAL  50           HA       VAL  50   3.581  -8.083 -14.371
  380    HB   VAL  50           HB       VAL  50   2.138  -6.615 -13.082
  381   1HG1  VAL  50          1HG1      VAL  50   0.335  -8.188 -12.598
  382   2HG1  VAL  50          2HG1      VAL  50   1.483  -9.524 -12.662
  383   3HG1  VAL  50          3HG1      VAL  50   1.148  -8.577 -14.113
  384   1HG2  VAL  50          1HG2      VAL  50   3.260  -6.709 -10.933
  385   2HG2  VAL  50          2HG2      VAL  50   2.789  -8.397 -10.738
  386   3HG2  VAL  50          3HG2      VAL  50   1.557  -7.134 -10.754
  387    H    TYR  51           H        TYR  51   4.128  -5.946 -14.572
  388    HA   TYR  51           HA       TYR  51   5.967  -4.805 -12.568
  389   1HB   TYR  51          1HB       TYR  51   5.836  -4.174 -15.533
  390   2HB   TYR  51          2HB       TYR  51   6.946  -3.454 -14.373
  391    HD1  TYR  51           HD1      TYR  51   6.153  -6.463 -16.317
  392    HD2  TYR  51           HD2      TYR  51   8.891  -4.678 -13.590
  393    HE1  TYR  51           HE1      TYR  51   7.784  -8.237 -16.803
  394    HE2  TYR  51           HE2      TYR  51  10.528  -6.451 -14.068
  395    HH   TYR  51           HH       TYR  51  10.187  -8.613 -16.682
  396    HA   PRO  52           HA       PRO  52   2.065  -2.526 -12.159
  397   1HB   PRO  52          1HB       PRO  52   2.866  -1.176  -9.898
  398   2HB   PRO  52          2HB       PRO  52   2.174  -2.801  -9.895
  399   1HG   PRO  52          1HG       PRO  52   5.035  -1.957  -9.715
  400   2HG   PRO  52          2HG       PRO  52   4.189  -3.256  -8.854
  401   1HD   PRO  52          1HD       PRO  52   5.795  -3.735 -10.964
  402   2HD   PRO  52          2HD       PRO  52   4.348  -4.711 -10.633
  403    H    GLY  53           H        GLY  53   5.191  -0.897 -11.534
  404   1HA   GLY  53          1HA       GLY  53   5.579   0.985 -13.224
  405   2HA   GLY  53          2HA       GLY  53   4.028   1.572 -12.634
  406    H    SER  54           H        SER  54   4.159   3.083 -11.127
  407    HA   SER  54           HA       SER  54   6.383   2.968  -9.213
  408   1HB   SER  54          1HB       SER  54   5.298   5.463 -10.547
  409   2HB   SER  54          2HB       SER  54   6.528   5.431  -9.284
  410    HG   SER  54           HG       SER  54   7.270   5.555 -11.551
  411    H    ASP  55           H        ASP  55   5.960   3.901  -7.168
  412    HA   ASP  55           HA       ASP  55   4.737   4.269  -5.296
  413   1HB   ASP  55          1HB       ASP  55   2.831   5.416  -7.333
  414   2HB   ASP  55          2HB       ASP  55   2.461   5.404  -5.614
  415    H    ALA  56           H        ALA  56   4.789   1.744  -5.747
  416    HA   ALA  56           HA       ALA  56   2.118   0.651  -6.033
  417   1HB   ALA  56          1HB       ALA  56   3.180  -1.530  -5.887
  418   2HB   ALA  56          2HB       ALA  56   4.717  -0.773  -5.471
  419   3HB   ALA  56          3HB       ALA  56   4.009  -0.513  -7.065
  420    H    VAL  57           H        VAL  57   0.776   0.417  -4.428
  421    HA   VAL  57           HA       VAL  57   1.745   0.568  -1.656
  422    HB   VAL  57           HB       VAL  57  -1.108   0.823  -2.619
  423   1HG1  VAL  57          1HG1      VAL  57   0.206   1.731  -0.066
  424   2HG1  VAL  57          2HG1      VAL  57  -0.865   0.341  -0.244
  425   3HG1  VAL  57          3HG1      VAL  57  -1.484   1.971  -0.504
  426   1HG2  VAL  57          1HG2      VAL  57  -0.833   3.254  -2.494
  427   2HG2  VAL  57          2HG2      VAL  57   0.218   2.536  -3.718
  428   3HG2  VAL  57          3HG2      VAL  57   0.885   3.033  -2.162
  429    H    VAL  58           H        VAL  58   0.642  -0.845  -0.079
  430    HA   VAL  58           HA       VAL  58  -0.133  -3.409  -1.294
  431    HB   VAL  58           HB       VAL  58   2.070  -3.685  -0.421
  432   1HG1  VAL  58          1HG1      VAL  58   2.189  -1.802   1.088
  433   2HG1  VAL  58          2HG1      VAL  58   2.642  -3.285   1.928
  434   3HG1  VAL  58          3HG1      VAL  58   1.046  -2.579   2.185
  435   1HG2  VAL  58          1HG2      VAL  58   1.735  -5.429   1.254
  436   2HG2  VAL  58          2HG2      VAL  58   0.566  -5.551  -0.061
  437   3HG2  VAL  58          3HG2      VAL  58   0.079  -4.877   1.495
  438    H    VAL  59           H        VAL  59  -2.133  -3.973  -0.848
  439    HA   VAL  59           HA       VAL  59  -3.428  -3.030   1.600
  440    HB   VAL  59           HB       VAL  59  -5.497  -3.477   0.181
  441   1HG1  VAL  59          1HG1      VAL  59  -3.701  -1.182  -0.526
  442   2HG1  VAL  59          2HG1      VAL  59  -4.806  -1.245   0.848
  443   3HG1  VAL  59          3HG1      VAL  59  -5.442  -1.240  -0.796
  444   1HG2  VAL  59          1HG2      VAL  59  -5.220  -3.204  -2.224
  445   2HG2  VAL  59          2HG2      VAL  59  -4.446  -4.671  -1.623
  446   3HG2  VAL  59          3HG2      VAL  59  -3.471  -3.252  -2.006
  447    H    THR  60           H        THR  60  -5.457  -4.462   1.982
  448    HA   THR  60           HA       THR  60  -4.618  -7.218   2.310
  449    HB   THR  60           HB       THR  60  -7.075  -7.361   3.193
  450    HG1  THR  60           HG1      THR  60  -7.094  -4.795   3.945
  451   1HG2  THR  60          1HG2      THR  60  -6.351  -6.442   5.361
  452   2HG2  THR  60          2HG2      THR  60  -4.965  -5.693   4.567
  453   3HG2  THR  60          3HG2      THR  60  -5.105  -7.448   4.623
  454    H    ALA  61           H        ALA  61  -6.261  -8.949   1.835
  455    HA   ALA  61           HA       ALA  61  -6.155  -9.152  -0.986
  456   1HB   ALA  61          1HB       ALA  61  -5.709 -11.041   0.494
  457   2HB   ALA  61          2HB       ALA  61  -6.989 -11.411  -0.661
  458   3HB   ALA  61          3HB       ALA  61  -7.394 -11.033   1.013
  459    H    THR  62           H        THR  62  -8.985  -9.451   1.191
  460    HA   THR  62           HA       THR  62 -10.646  -9.661  -1.154
  461    HB   THR  62           HB       THR  62 -12.461  -9.779   0.670
  462    HG1  THR  62           HG1      THR  62 -11.435  -9.194   2.507
  463   1HG2  THR  62          1HG2      THR  62 -12.017 -12.173   0.987
  464   2HG2  THR  62          2HG2      THR  62 -10.370 -11.935   0.400
  465   3HG2  THR  62          3HG2      THR  62 -11.737 -11.678  -0.683
  466    H    GLU  63           H        GLU  63  -9.837  -7.271   1.208
  467    HA   GLU  63           HA       GLU  63 -11.940  -5.481   0.985
  468   1HB   GLU  63          1HB       GLU  63 -10.020  -5.203   2.520
  469   2HB   GLU  63          2HB       GLU  63  -8.978  -4.868   1.145
  470   1HG   GLU  63          1HG       GLU  63 -10.285  -2.864   0.648
  471   2HG   GLU  63          2HG       GLU  63 -11.306  -3.190   2.050
  472    H    HIS  64           H        HIS  64  -8.947  -5.528  -0.891
  473    HA   HIS  64           HA       HIS  64 -10.044  -3.712  -2.824
  474   1HB   HIS  64          1HB       HIS  64  -7.327  -4.816  -2.340
  475   2HB   HIS  64          2HB       HIS  64  -7.710  -4.101  -3.909
  476    HD1  HIS  64           HD1      HIS  64  -7.092  -1.694  -3.967
  477    HD2  HIS  64           HD2      HIS  64  -8.374  -2.860  -0.198
  478    HE1  HIS  64           HE1      HIS  64  -7.017   0.381  -2.560
  479    HE2  HIS  64           HE2      HIS  64  -8.047  -0.303  -0.370
  480    H    ALA  65           H        ALA  65 -10.078  -7.084  -2.561
  481    HA   ALA  65           HA       ALA  65  -9.364  -8.139  -4.961
  482   1HB   ALA  65          1HB       ALA  65 -10.086  -9.431  -3.006
  483   2HB   ALA  65          2HB       ALA  65 -10.850  -9.977  -4.499
  484   3HB   ALA  65          3HB       ALA  65 -11.759  -8.993  -3.352
  485    H    GLU  66           H        GLU  66 -12.492  -6.577  -4.291
  486    HA   GLU  66           HA       GLU  66 -13.708  -7.230  -6.769
  487   1HB   GLU  66          1HB       GLU  66 -14.175  -4.667  -5.245
  488   2HB   GLU  66          2HB       GLU  66 -15.321  -5.558  -6.236
  489   1HG   GLU  66          1HG       GLU  66 -15.372  -7.360  -4.589
  490   2HG   GLU  66          2HG       GLU  66 -14.184  -6.503  -3.606
  491    H    ALA  67           H        ALA  67 -11.873  -4.484  -5.668
  492    HA   ALA  67           HA       ALA  67 -11.643  -3.149  -8.131
  493   1HB   ALA  67          1HB       ALA  67  -9.875  -1.869  -7.067
  494   2HB   ALA  67          2HB       ALA  67  -9.816  -3.025  -5.737
  495   3HB   ALA  67          3HB       ALA  67 -11.255  -2.039  -5.983
  496    H    GLU  68           H        GLU  68 -10.109  -6.024  -6.895
  497    HA   GLU  68           HA       GLU  68  -7.886  -5.950  -8.686
  498   1HB   GLU  68          1HB       GLU  68  -7.952  -7.572  -6.795
  499   2HB   GLU  68          2HB       GLU  68  -9.255  -8.433  -7.611
  500   1HG   GLU  68          1HG       GLU  68  -7.543  -8.495  -9.601
  501   2HG   GLU  68          2HG       GLU  68  -6.363  -8.247  -8.320
  502    H    LYS  69           H        LYS  69 -11.203  -7.220  -8.921
  503    HA   LYS  69           HA       LYS  69 -11.114  -8.321 -11.464
  504   1HB   LYS  69          1HB       LYS  69 -13.292  -6.571 -10.290
  505   2HB   LYS  69          2HB       LYS  69 -13.472  -7.556 -11.732
  506   1HG   LYS  69          1HG       LYS  69 -12.739  -8.755  -9.082
  507   2HG   LYS  69          2HG       LYS  69 -14.415  -8.454  -9.545
  508   1HD   LYS  69          1HD       LYS  69 -13.888  -9.782 -11.663
  509   2HD   LYS  69          2HD       LYS  69 -12.419 -10.299 -10.828
  510   1HE   LYS  69          1HE       LYS  69 -13.781 -11.170  -8.989
  511   2HE   LYS  69          2HE       LYS  69 -15.244 -10.668  -9.832
  512   1HZ   LYS  69          1HZ       LYS  69 -13.291 -12.700 -10.766
  513   2HZ   LYS  69          2HZ       LYS  69 -14.650 -12.194 -11.637
  514   3HZ   LYS  69          3HZ       LYS  69 -14.843 -13.003 -10.160
  515    H    ARG  70           H        ARG  70 -12.004  -4.997 -10.634
  516    HA   ARG  70           HA       ARG  70 -11.998  -3.923 -13.228
  517   1HB   ARG  70          1HB       ARG  70 -12.958  -2.779 -11.305
  518   2HB   ARG  70          2HB       ARG  70 -11.369  -2.617 -10.577
  519   1HG   ARG  70          1HG       ARG  70 -11.622  -0.535 -11.449
  520   2HG   ARG  70          2HG       ARG  70 -10.833  -1.339 -12.807
  521   1HD   ARG  70          1HD       ARG  70 -12.546  -0.725 -14.071
  522   2HD   ARG  70          2HD       ARG  70 -13.560  -1.824 -13.135
  523    HE   ARG  70           HE       ARG  70 -13.374   0.527 -11.679
  524   1HH1  ARG  70          1HH1      ARG  70 -14.615  -0.474 -14.786
  525   2HH1  ARG  70          2HH1      ARG  70 -15.855   0.739 -14.827
  526   1HH2  ARG  70          1HH2      ARG  70 -14.983   2.128 -11.714
  527   2HH2  ARG  70          2HH2      ARG  70 -16.073   2.232 -13.070
  528    H    ALA  71           H        ALA  71  -9.463  -3.649 -10.786
  529    HA   ALA  71           HA       ALA  71  -7.838  -2.071 -12.522
  530   1HB   ALA  71          1HB       ALA  71  -6.398  -1.833 -10.601
  531   2HB   ALA  71          2HB       ALA  71  -7.290  -3.096  -9.755
  532   3HB   ALA  71          3HB       ALA  71  -8.084  -1.573 -10.154
  533    H    ALA  72           H        ALA  72  -7.938  -5.473 -11.777
  534    HA   ALA  72           HA       ALA  72  -5.212  -5.865 -12.672
  535   1HB   ALA  72          1HB       ALA  72  -5.689  -8.252 -12.614
  536   2HB   ALA  72          2HB       ALA  72  -7.393  -7.915 -12.306
  537   3HB   ALA  72          3HB       ALA  72  -6.175  -7.474 -11.109
  538    H    ALA  73           H        ALA  73  -8.490  -6.079 -14.018
  539    HA   ALA  73           HA       ALA  73  -7.841  -6.891 -16.600
  540   1HB   ALA  73          1HB       ALA  73 -10.139  -6.510 -15.849
  541   2HB   ALA  73          2HB       ALA  73  -9.800  -5.627 -17.337
  542   3HB   ALA  73          3HB       ALA  73  -9.836  -4.773 -15.793
  543    H    ARG  74           H        ARG  74  -7.512  -3.738 -15.046
  544    HA   ARG  74           HA       ARG  74  -6.382  -2.442 -17.341
  545   1HB   ARG  74          1HB       ARG  74  -7.446  -1.315 -15.338
  546   2HB   ARG  74          2HB       ARG  74  -5.960  -1.660 -14.463
  547   1HG   ARG  74          1HG       ARG  74  -5.763   0.553 -15.216
  548   2HG   ARG  74          2HG       ARG  74  -4.749  -0.405 -16.298
  549   1HD   ARG  74          1HD       ARG  74  -6.657  -0.484 -17.901
  550   2HD   ARG  74          2HD       ARG  74  -7.529   0.622 -16.842
  551    HE   ARG  74           HE       ARG  74  -5.253   1.246 -18.548
  552   1HH1  ARG  74          1HH1      ARG  74  -7.420   2.342 -16.009
  553   2HH1  ARG  74          2HH1      ARG  74  -7.164   4.030 -16.360
  554   1HH2  ARG  74          1HH2      ARG  74  -4.941   3.430 -19.012
  555   2HH2  ARG  74          2HH2      ARG  74  -5.775   4.650 -18.093
  556    H    ALA  75           H        ALA  75  -4.886  -3.661 -14.336
  557    HA   ALA  75           HA       ALA  75  -2.230  -3.007 -14.724
  558   1HB   ALA  75          1HB       ALA  75  -3.126  -3.965 -12.665
  559   2HB   ALA  75          2HB       ALA  75  -1.699  -4.844 -13.217
  560   3HB   ALA  75          3HB       ALA  75  -3.307  -5.529 -13.462
  561    H    GLY  76           H        GLY  76  -3.736  -6.131 -15.597
  562   1HA   GLY  76          1HA       GLY  76  -1.320  -6.734 -17.156
  563   2HA   GLY  76          2HA       GLY  76  -2.520  -7.909 -16.642
  564    H    HIS  77           H        HIS  77  -2.922  -4.794 -18.277
  565    HA   HIS  77           HA       HIS  77  -4.506  -6.012 -20.373
  566   1HB   HIS  77          1HB       HIS  77  -4.960  -3.718 -19.418
  567   2HB   HIS  77          2HB       HIS  77  -3.483  -3.166 -20.196
  568    HD1  HIS  77           HD1      HIS  77  -3.523  -2.954 -22.799
  569    HD2  HIS  77           HD2      HIS  77  -7.151  -4.049 -21.099
  570    HE1  HIS  77           HE1      HIS  77  -5.240  -2.599 -24.595
  571    HE2  HIS  77           HE2      HIS  77  -7.450  -3.099 -23.490
  572    H    ALA  78           H        ALA  78  -1.258  -5.158 -19.764
  573    HA   ALA  78           HA       ALA  78  -0.308  -6.428 -22.122
  574   1HB   ALA  78          1HB       ALA  78   0.068  -3.436 -21.935
  575   2HB   ALA  78          2HB       ALA  78  -0.893  -4.288 -23.144
  576   3HB   ALA  78          3HB       ALA  78   0.857  -4.499 -23.099
  577    H    ALA  79           H        ALA  79   2.090  -6.418 -22.163
  578    HA   ALA  79           HA       ALA  79   3.292  -5.663 -19.588
  579   1HB   ALA  79          1HB       ALA  79   2.827  -8.063 -19.505
  580   2HB   ALA  79          2HB       ALA  79   4.563  -7.752 -19.540
  581   3HB   ALA  79          3HB       ALA  79   3.734  -8.297 -21.000
  582    H    THR  80           H        THR  80   3.957  -6.841 -22.866
  583    HA   THR  80           HA       THR  80   5.829  -4.698 -23.327
  584    HB   THR  80           HB       THR  80   6.850  -7.550 -23.493
  585    HG1  THR  80           HG1      THR  80   6.802  -5.751 -21.406
  586   1HG2  THR  80          1HG2      THR  80   7.855  -6.011 -25.116
  587   2HG2  THR  80          2HG2      THR  80   9.023  -6.483 -23.883
  588   3HG2  THR  80          3HG2      THR  80   8.260  -4.895 -23.813
  Start of MODEL   22
    1    H    MET   1           H        MET   1   9.373   0.211   0.527
    2    HA   MET   1           HA       MET   1   7.777   1.266   2.779
    3   1HB   MET   1          1HB       MET   1   5.793   0.358   1.655
    4   2HB   MET   1          2HB       MET   1   6.537   1.632   0.702
    5   1HG   MET   1          1HG       MET   1   7.545  -0.032  -0.761
    6   2HG   MET   1          2HG       MET   1   6.840  -1.324   0.212
    7   1HE   MET   1          1HE       MET   1   5.674  -2.444  -1.878
    8   2HE   MET   1          2HE       MET   1   6.455  -1.232  -2.892
    9   3HE   MET   1          3HE       MET   1   4.727  -1.543  -3.062
   10    H    HIS   2           H        HIS   2   6.114  -1.008   2.861
   11    HA   HIS   2           HA       HIS   2   7.945  -3.287   3.158
   12   1HB   HIS   2          1HB       HIS   2   6.302  -2.019   5.322
   13   2HB   HIS   2          2HB       HIS   2   6.531  -3.762   5.337
   14    HD1  HIS   2           HD1      HIS   2   9.502  -1.997   4.106
   15    HD2  HIS   2           HD2      HIS   2   7.965  -3.149   7.794
   16    HE1  HIS   2           HE1      HIS   2  11.426  -1.851   5.720
   17    HE2  HIS   2           HE2      HIS   2  10.515  -2.693   7.906
   18    H    ALA   3           H        ALA   3   7.128  -4.880   1.997
   19    HA   ALA   3           HA       ALA   3   4.239  -5.397   2.090
   20   1HB   ALA   3          1HB       ALA   3   4.155  -5.747  -0.321
   21   2HB   ALA   3          2HB       ALA   3   5.854  -5.292  -0.458
   22   3HB   ALA   3          3HB       ALA   3   4.660  -4.097   0.050
   23    H    LYS   4           H        LYS   4   3.701  -7.569   1.983
   24    HA   LYS   4           HA       LYS   4   5.876  -9.467   1.587
   25   1HB   LYS   4          1HB       LYS   4   5.275 -10.716   3.631
   26   2HB   LYS   4          2HB       LYS   4   5.919  -9.120   3.971
   27   1HG   LYS   4          1HG       LYS   4   2.965  -9.600   3.879
   28   2HG   LYS   4          2HG       LYS   4   3.906  -9.971   5.323
   29   1HD   LYS   4          1HD       LYS   4   4.762  -7.588   5.213
   30   2HD   LYS   4          2HD       LYS   4   3.525  -7.297   3.988
   31   1HE   LYS   4          1HE       LYS   4   2.972  -8.343   6.761
   32   2HE   LYS   4          2HE       LYS   4   2.848  -6.649   6.295
   33   1HZ   LYS   4          1HZ       LYS   4   1.010  -7.065   4.980
   34   2HZ   LYS   4          2HZ       LYS   4   0.747  -8.097   6.292
   35   3HZ   LYS   4          3HZ       LYS   4   1.336  -8.716   4.827
   36    H    VAL   5           H        VAL   5   5.102 -11.721   1.511
   37    HA   VAL   5           HA       VAL   5   2.995 -11.998  -0.360
   38    HB   VAL   5           HB       VAL   5   4.851 -13.552  -0.371
   39   1HG1  VAL   5          1HG1      VAL   5   5.244 -15.151   1.446
   40   2HG1  VAL   5          2HG1      VAL   5   3.979 -14.371   2.395
   41   3HG1  VAL   5          3HG1      VAL   5   5.444 -13.481   1.977
   42   1HG2  VAL   5          1HG2      VAL   5   3.709 -15.704  -0.387
   43   2HG2  VAL   5          2HG2      VAL   5   2.703 -14.453  -1.120
   44   3HG2  VAL   5          3HG2      VAL   5   2.366 -15.009   0.520
   45    H    GLY   6           H        GLY   6   0.965 -12.957  -0.152
   46   1HA   GLY   6          1HA       GLY   6  -0.926 -13.729   1.053
   47   2HA   GLY   6          2HA       GLY   6  -0.101 -13.329   2.558
   48    H    ASP   7           H        ASP   7   0.123 -11.109   0.048
   49    HA   ASP   7           HA       ASP   7  -2.012  -9.289   1.142
   50   1HB   ASP   7          1HB       ASP   7   0.960  -8.681   0.942
   51   2HB   ASP   7          2HB       ASP   7  -0.280  -7.437   1.042
   52    H    TYR   8           H        TYR   8  -1.633  -7.198  -0.246
   53    HA   TYR   8           HA       TYR   8  -1.774  -8.107  -3.048
   54   1HB   TYR   8          1HB       TYR   8  -3.878  -6.552  -1.513
   55   2HB   TYR   8          2HB       TYR   8  -3.902  -6.797  -3.249
   56    HD1  TYR   8           HD1      TYR   8  -4.367  -8.430   0.028
   57    HD2  TYR   8           HD2      TYR   8  -4.667  -8.835  -4.193
   58    HE1  TYR   8           HE1      TYR   8  -5.789 -10.430   0.309
   59    HE2  TYR   8           HE2      TYR   8  -6.070 -10.837  -3.918
   60    HH   TYR   8           HH       TYR   8  -6.337 -12.621  -2.030
   61    H    LEU   9           H        LEU   9  -2.157  -6.165  -4.488
   62    HA   LEU   9           HA       LEU   9  -0.514  -3.914  -3.580
   63   1HB   LEU   9          1HB       LEU   9   1.054  -5.571  -4.407
   64   2HB   LEU   9          2HB       LEU   9   0.106  -5.807  -5.856
   65    HG   LEU   9           HG       LEU   9   1.386  -3.136  -5.313
   66   1HD1  LEU   9          1HD1      LEU   9   3.342  -3.887  -6.555
   67   2HD1  LEU   9          2HD1      LEU   9   2.694  -5.527  -6.596
   68   3HD1  LEU   9          3HD1      LEU   9   3.148  -4.793  -5.057
   69   1HD2  LEU   9          1HD2      LEU   9   0.716  -4.629  -7.850
   70   2HD2  LEU   9          2HD2      LEU   9   1.406  -3.009  -7.751
   71   3HD2  LEU   9          3HD2      LEU   9  -0.227  -3.309  -7.156
   72    H    VAL  10           H        VAL  10  -0.875  -2.043  -4.654
   73    HA   VAL  10           HA       VAL  10  -2.630  -2.024  -7.001
   74    HB   VAL  10           HB       VAL  10  -3.095  -0.044  -4.771
   75   1HG1  VAL  10          1HG1      VAL  10  -5.262   0.261  -5.839
   76   2HG1  VAL  10          2HG1      VAL  10  -4.853  -0.967  -7.038
   77   3HG1  VAL  10          3HG1      VAL  10  -3.945   0.545  -6.978
   78   1HG2  VAL  10          1HG2      VAL  10  -3.531  -2.237  -3.808
   79   2HG2  VAL  10          2HG2      VAL  10  -4.602  -2.619  -5.155
   80   3HG2  VAL  10          3HG2      VAL  10  -5.026  -1.328  -4.030
   81    H    VAL  11           H        VAL  11  -2.753   0.381  -7.720
   82    HA   VAL  11           HA       VAL  11  -0.215   1.788  -7.240
   83    HB   VAL  11           HB       VAL  11  -1.421   1.085  -9.922
   84   1HG1  VAL  11          1HG1      VAL  11   0.229   2.551 -10.967
   85   2HG1  VAL  11          2HG1      VAL  11   0.751   3.108  -9.377
   86   3HG1  VAL  11          3HG1      VAL  11  -0.879   3.467  -9.946
   87   1HG2  VAL  11          1HG2      VAL  11   0.827   0.234 -10.394
   88   2HG2  VAL  11          2HG2      VAL  11   0.116  -0.550  -8.982
   89   3HG2  VAL  11          3HG2      VAL  11   1.341   0.701  -8.773
   90    H    LYS  12           H        LYS  12  -0.428   3.873  -6.956
   91    HA   LYS  12           HA       LYS  12  -3.063   4.914  -6.508
   92   1HB   LYS  12          1HB       LYS  12  -0.318   6.129  -6.181
   93   2HB   LYS  12          2HB       LYS  12  -1.809   6.885  -5.640
   94   1HG   LYS  12          1HG       LYS  12  -2.141   5.289  -3.963
   95   2HG   LYS  12          2HG       LYS  12  -0.990   4.163  -4.688
   96   1HD   LYS  12          1HD       LYS  12   0.853   5.615  -4.133
   97   2HD   LYS  12          2HD       LYS  12  -0.253   6.854  -3.539
   98   1HE   LYS  12          1HE       LYS  12  -0.010   4.091  -2.366
   99   2HE   LYS  12          2HE       LYS  12   0.853   5.503  -1.757
  100   1HZ   LYS  12          1HZ       LYS  12  -1.389   6.560  -1.490
  101   2HZ   LYS  12          2HZ       LYS  12  -1.063   5.268  -0.443
  102   3HZ   LYS  12          3HZ       LYS  12  -2.075   5.036  -1.784
  103    H    GLY  13           H        GLY  13  -2.420   7.658  -6.938
  104   1HA   GLY  13          1HA       GLY  13  -1.755   8.795  -9.174
  105   2HA   GLY  13          2HA       GLY  13  -3.068   7.791  -9.787
  106    H    THR  14           H        THR  14  -5.171   8.229  -9.225
  107    HA   THR  14           HA       THR  14  -6.994   9.315  -8.421
  108    HB   THR  14           HB       THR  14  -5.144  10.903  -6.638
  109    HG1  THR  14           HG1      THR  14  -5.629   8.286  -6.662
  110   1HG2  THR  14          1HG2      THR  14  -7.429  11.797  -6.822
  111   2HG2  THR  14          2HG2      THR  14  -7.128  11.127  -5.219
  112   3HG2  THR  14          3HG2      THR  14  -8.079  10.215  -6.390
  113    H    THR  15           H        THR  15  -4.223  11.380  -9.169
  114    HA   THR  15           HA       THR  15  -5.826  13.633  -9.944
  115    HB   THR  15           HB       THR  15  -3.636  14.464 -10.897
  116    HG1  THR  15           HG1      THR  15  -1.998  13.123 -10.999
  117   1HG2  THR  15          1HG2      THR  15  -2.585  14.777  -8.689
  118   2HG2  THR  15          2HG2      THR  15  -3.650  13.541  -8.020
  119   3HG2  THR  15          3HG2      THR  15  -4.326  15.049  -8.635
  120    H    THR  16           H        THR  16  -5.414  10.701 -11.319
  121    HA   THR  16           HA       THR  16  -6.471  11.643 -13.841
  122    HB   THR  16           HB       THR  16  -4.067   9.796 -13.840
  123    HG1  THR  16           HG1      THR  16  -4.257  12.540 -13.838
  124   1HG2  THR  16          1HG2      THR  16  -4.103  10.164 -16.265
  125   2HG2  THR  16          2HG2      THR  16  -5.542  11.170 -16.094
  126   3HG2  THR  16          3HG2      THR  16  -5.615   9.451 -15.705
  127    H    GLU  17           H        GLU  17  -5.000   8.534 -12.982
  128    HA   GLU  17           HA       GLU  17  -7.678   7.342 -12.898
  129   1HB   GLU  17          1HB       GLU  17  -4.964   6.037 -13.215
  130   2HB   GLU  17          2HB       GLU  17  -6.499   5.175 -13.165
  131   1HG   GLU  17          1HG       GLU  17  -7.231   6.369 -15.172
  132   2HG   GLU  17          2HG       GLU  17  -5.687   7.214 -15.227
  133    H    ARG  18           H        ARG  18  -8.381   6.282 -11.056
  134    HA   ARG  18           HA       ARG  18  -7.425   7.660  -8.745
  135   1HB   ARG  18          1HB       ARG  18  -9.575   5.554  -8.983
  136   2HB   ARG  18          2HB       ARG  18  -9.320   6.616  -7.602
  137   1HG   ARG  18          1HG       ARG  18  -9.874   8.548  -8.897
  138   2HG   ARG  18          2HG       ARG  18  -9.935   7.595 -10.380
  139   1HD   ARG  18          1HD       ARG  18 -11.802   6.289  -9.353
  140   2HD   ARG  18          2HD       ARG  18 -11.803   7.447  -8.024
  141    HE   ARG  18           HE       ARG  18 -12.239   9.175  -9.806
  142   1HH1  ARG  18          1HH1      ARG  18 -13.234   5.830 -10.143
  143   2HH1  ARG  18          2HH1      ARG  18 -14.494   6.184 -11.293
  144   1HH2  ARG  18          1HH2      ARG  18 -13.906   9.653 -11.296
  145   2HH2  ARG  18          2HH2      ARG  18 -14.860   8.361 -11.966
  146    H    HIS  19           H        HIS  19  -8.183   4.188  -8.868
  147    HA   HIS  19           HA       HIS  19  -5.580   3.566  -7.707
  148   1HB   HIS  19          1HB       HIS  19  -8.199   2.786  -6.387
  149   2HB   HIS  19          2HB       HIS  19  -6.625   2.128  -5.949
  150    HD1  HIS  19           HD1      HIS  19  -8.952   4.653  -4.979
  151    HD2  HIS  19           HD2      HIS  19  -4.801   4.365  -5.087
  152    HE1  HIS  19           HE1      HIS  19  -8.103   6.437  -3.417
  153    HE2  HIS  19           HE2      HIS  19  -5.596   6.394  -3.692
  154    H    ASP  20           H        ASP  20  -4.913   2.283  -9.316
  155    HA   ASP  20           HA       ASP  20  -6.655   0.049 -10.053
  156   1HB   ASP  20          1HB       ASP  20  -5.272   1.933 -11.961
  157   2HB   ASP  20          2HB       ASP  20  -5.883   0.355 -12.445
  158    H    GLN  21           H        GLN  21  -5.224  -1.364 -11.705
  159    HA   GLN  21           HA       GLN  21  -3.725  -3.056 -11.690
  160   1HB   GLN  21          1HB       GLN  21  -1.840  -1.124 -10.330
  161   2HB   GLN  21          2HB       GLN  21  -1.400  -2.585 -11.203
  162   1HG   GLN  21          1HG       GLN  21  -2.693  -1.302 -13.154
  163   2HG   GLN  21          2HG       GLN  21  -2.157   0.086 -12.211
  164   1HE2  GLN  21          1HE2      GLN  21   0.236  -1.385 -11.290
  165   2HE2  GLN  21          2HE2      GLN  21   1.318  -1.393 -12.638
  166    H    HIS  22           H        HIS  22  -4.598  -4.577 -10.330
  167    HA   HIS  22           HA       HIS  22  -3.737  -4.505  -7.529
  168   1HB   HIS  22          1HB       HIS  22  -6.045  -3.512  -7.747
  169   2HB   HIS  22          2HB       HIS  22  -6.595  -5.099  -8.274
  170    HD1  HIS  22           HD1      HIS  22  -5.529  -7.031  -6.301
  171    HD2  HIS  22           HD2      HIS  22  -6.736  -3.206  -5.190
  172    HE1  HIS  22           HE1      HIS  22  -6.024  -7.161  -3.848
  173    HE2  HIS  22           HE2      HIS  22  -6.892  -4.878  -3.233
  174    H    ALA  23           H        ALA  23  -2.897  -6.279  -6.968
  175    HA   ALA  23           HA       ALA  23  -3.737  -8.920  -7.972
  176   1HB   ALA  23          1HB       ALA  23  -1.878  -8.163  -9.395
  177   2HB   ALA  23          2HB       ALA  23  -1.455  -9.560  -8.404
  178   3HB   ALA  23          3HB       ALA  23  -0.881  -7.952  -7.955
  179    H    GLU  24           H        GLU  24  -2.291 -10.588  -6.768
  180    HA   GLU  24           HA       GLU  24  -1.720  -9.689  -4.015
  181   1HB   GLU  24          1HB       GLU  24  -3.844 -10.905  -3.876
  182   2HB   GLU  24          2HB       GLU  24  -3.147 -12.257  -4.766
  183   1HG   GLU  24          1HG       GLU  24  -1.430 -12.400  -2.887
  184   2HG   GLU  24          2HG       GLU  24  -2.480 -11.311  -1.991
  185    H    ILE  25           H        ILE  25   0.146 -10.201  -3.404
  186    HA   ILE  25           HA       ILE  25   1.864 -11.685  -5.160
  187    HB   ILE  25           HB       ILE  25   3.635 -10.962  -3.453
  188   1HG1  ILE  25          1HG1      ILE  25   1.295  -9.267  -2.542
  189   2HG1  ILE  25          2HG1      ILE  25   2.175 -10.444  -1.575
  190   1HG2  ILE  25          1HG2      ILE  25   3.740  -8.712  -4.414
  191   2HG2  ILE  25          2HG2      ILE  25   2.083  -8.887  -4.992
  192   3HG2  ILE  25          3HG2      ILE  25   3.354  -9.928  -5.631
  193   1HD1  ILE  25          1HD1      ILE  25   4.185  -9.047  -1.733
  194   2HD1  ILE  25          2HD1      ILE  25   2.833  -8.191  -0.990
  195   3HD1  ILE  25          3HD1      ILE  25   3.273  -7.861  -2.666
  196    H    ILE  26           H        ILE  26   1.968 -13.733  -5.023
  197    HA   ILE  26           HA       ILE  26   2.169 -15.032  -2.394
  198    HB   ILE  26           HB       ILE  26   1.680 -17.138  -3.412
  199   1HG1  ILE  26          1HG1      ILE  26   2.958 -16.620  -5.575
  200   2HG1  ILE  26          2HG1      ILE  26   1.487 -17.561  -5.751
  201   1HG2  ILE  26          1HG2      ILE  26  -0.573 -16.736  -4.367
  202   2HG2  ILE  26          2HG2      ILE  26  -0.188 -15.025  -4.538
  203   3HG2  ILE  26          3HG2      ILE  26  -0.278 -15.752  -2.933
  204   1HD1  ILE  26          1HD1      ILE  26   1.716 -15.909  -7.509
  205   2HD1  ILE  26          2HD1      ILE  26   1.767 -14.618  -6.307
  206   3HD1  ILE  26          3HD1      ILE  26   0.300 -15.581  -6.508
  207    H    GLU  27           H        GLU  27   3.873 -13.807  -4.944
  208    HA   GLU  27           HA       GLU  27   6.319 -15.075  -3.989
  209   1HB   GLU  27          1HB       GLU  27   5.189 -15.634  -6.503
  210   2HB   GLU  27          2HB       GLU  27   6.502 -14.510  -6.822
  211   1HG   GLU  27          1HG       GLU  27   6.707 -17.131  -5.359
  212   2HG   GLU  27          2HG       GLU  27   7.283 -16.787  -6.989
  213    H    VAL  28           H        VAL  28   7.817 -13.592  -3.532
  214    HA   VAL  28           HA       VAL  28   7.340 -10.817  -4.363
  215    HB   VAL  28           HB       VAL  28   7.657 -11.600  -1.469
  216   1HG1  VAL  28          1HG1      VAL  28   6.982  -9.288  -1.039
  217   2HG1  VAL  28          2HG1      VAL  28   6.889  -8.994  -2.776
  218   3HG1  VAL  28          3HG1      VAL  28   8.442  -9.366  -2.026
  219   1HG2  VAL  28          1HG2      VAL  28   5.282 -11.073  -1.184
  220   2HG2  VAL  28          2HG2      VAL  28   5.519 -12.441  -2.273
  221   3HG2  VAL  28          3HG2      VAL  28   5.126 -10.852  -2.927
  222    H    ARG  29           H        ARG  29   9.248  -9.966  -4.939
  223    HA   ARG  29           HA       ARG  29  11.661 -11.410  -4.631
  224   1HB   ARG  29          1HB       ARG  29  11.075  -8.652  -5.687
  225   2HB   ARG  29          2HB       ARG  29  12.691  -9.344  -5.682
  226   1HG   ARG  29          1HG       ARG  29  10.320 -10.591  -7.052
  227   2HG   ARG  29          2HG       ARG  29  11.492  -9.539  -7.847
  228   1HD   ARG  29          1HD       ARG  29  12.773 -11.316  -8.222
  229   2HD   ARG  29          2HD       ARG  29  12.986 -11.486  -6.481
  230    HE   ARG  29           HE       ARG  29  11.038 -12.971  -6.488
  231   1HH1  ARG  29          1HH1      ARG  29  12.716 -12.374  -9.510
  232   2HH1  ARG  29          2HH1      ARG  29  12.114 -13.818 -10.278
  233   1HH2  ARG  29          1HH2      ARG  29  10.264 -14.889  -7.483
  234   2HH2  ARG  29          2HH2      ARG  29  10.738 -15.244  -9.120
  235    H    SER  30           H        SER  30  10.322  -8.641  -2.947
  236    HA   SER  30           HA       SER  30  12.451  -8.826  -0.979
  237   1HB   SER  30          1HB       SER  30  11.832  -6.220  -2.393
  238   2HB   SER  30          2HB       SER  30  12.987  -6.445  -1.079
  239    HG   SER  30           HG       SER  30  13.670  -8.199  -2.864
  240    H    ALA  31           H        ALA  31  11.912  -7.903   1.033
  241    HA   ALA  31           HA       ALA  31   9.084  -7.866   1.562
  242   1HB   ALA  31          1HB       ALA  31   9.726  -7.657   3.904
  243   2HB   ALA  31          2HB       ALA  31  11.403  -7.380   3.432
  244   3HB   ALA  31          3HB       ALA  31  10.645  -8.942   3.117
  245    H    ASP  32           H        ASP  32  11.461  -5.556   0.804
  246    HA   ASP  32           HA       ASP  32  10.150  -3.311   2.038
  247   1HB   ASP  32          1HB       ASP  32  12.602  -3.369   1.453
  248   2HB   ASP  32          2HB       ASP  32  12.140  -3.269  -0.243
  249    H    GLY  33           H        GLY  33  10.810  -3.886  -1.395
  250   1HA   GLY  33          1HA       GLY  33   8.407  -4.052  -2.553
  251   2HA   GLY  33          2HA       GLY  33   8.463  -2.351  -2.107
  252    H    SER  34           H        SER  34   9.857  -4.847  -4.097
  253    HA   SER  34           HA       SER  34  10.828  -2.806  -5.933
  254   1HB   SER  34          1HB       SER  34  12.557  -5.082  -4.919
  255   2HB   SER  34          2HB       SER  34  12.998  -3.945  -6.193
  256    HG   SER  34           HG       SER  34  12.176  -2.769  -3.842
  257    HA   PRO  35           HA       PRO  35   8.942  -5.840  -8.645
  258   1HB   PRO  35          1HB       PRO  35   9.189  -4.410 -10.921
  259   2HB   PRO  35          2HB       PRO  35   7.974  -4.019  -9.697
  260   1HG   PRO  35          1HG       PRO  35  10.630  -2.743 -10.204
  261   2HG   PRO  35          2HG       PRO  35   9.075  -1.977  -9.833
  262   1HD   PRO  35          1HD       PRO  35  11.032  -2.382  -7.977
  263   2HD   PRO  35          2HD       PRO  35   9.305  -2.318  -7.577
  264    HA   PRO  36           HA       PRO  36   8.622  -6.570 -10.968
  265   1HB   PRO  36          1HB       PRO  36   9.279  -9.321 -11.585
  266   2HB   PRO  36          2HB       PRO  36   8.858  -8.009 -12.687
  267   1HG   PRO  36          1HG       PRO  36  11.347  -9.125 -12.554
  268   2HG   PRO  36          2HG       PRO  36  11.045  -7.454 -13.064
  269   1HD   PRO  36          1HD       PRO  36  11.969  -8.488 -10.410
  270   2HD   PRO  36          2HD       PRO  36  12.506  -7.052 -11.309
  271    H    TYR  37           H        TYR  37   7.103  -8.546 -10.687
  272    HA   TYR  37           HA       TYR  37   7.417  -9.846  -8.067
  273   1HB   TYR  37          1HB       TYR  37   5.088  -8.166  -8.993
  274   2HB   TYR  37          2HB       TYR  37   4.916  -9.390  -7.746
  275    HD1  TYR  37           HD1      TYR  37   5.859  -9.061  -5.541
  276    HD2  TYR  37           HD2      TYR  37   6.280  -6.088  -8.551
  277    HE1  TYR  37           HE1      TYR  37   6.488  -7.422  -3.824
  278    HE2  TYR  37           HE2      TYR  37   6.917  -4.439  -6.839
  279    HH   TYR  37           HH       TYR  37   7.526  -5.377  -3.532
  280    H    VAL  38           H        VAL  38   5.718 -11.594  -7.826
  281    HA   VAL  38           HA       VAL  38   4.647 -12.499 -10.403
  282    HB   VAL  38           HB       VAL  38   6.163 -14.330  -8.515
  283   1HG1  VAL  38          1HG1      VAL  38   4.122 -15.397  -9.329
  284   2HG1  VAL  38          2HG1      VAL  38   5.532 -16.115 -10.109
  285   3HG1  VAL  38          3HG1      VAL  38   4.532 -14.955 -10.985
  286   1HG2  VAL  38          1HG2      VAL  38   7.577 -14.772 -10.465
  287   2HG2  VAL  38          2HG2      VAL  38   7.605 -13.059 -10.045
  288   3HG2  VAL  38          3HG2      VAL  38   6.641 -13.617 -11.412
  289    H    VAL  39           H        VAL  39   2.637 -13.014 -10.212
  290    HA   VAL  39           HA       VAL  39   1.517 -12.673  -7.541
  291    HB   VAL  39           HB       VAL  39   2.237 -10.585  -9.181
  292   1HG1  VAL  39          1HG1      VAL  39  -0.703 -11.022  -9.588
  293   2HG1  VAL  39          2HG1      VAL  39   0.558 -11.021 -10.821
  294   3HG1  VAL  39          3HG1      VAL  39   0.162  -9.533  -9.961
  295   1HG2  VAL  39          1HG2      VAL  39   0.106 -10.595  -7.072
  296   2HG2  VAL  39          2HG2      VAL  39   0.944  -9.168  -7.684
  297   3HG2  VAL  39          3HG2      VAL  39   1.843 -10.419  -6.825
  298    H    ARG  40           H        ARG  40  -0.968 -12.547  -7.817
  299    HA   ARG  40           HA       ARG  40  -1.850 -13.985 -10.207
  300   1HB   ARG  40          1HB       ARG  40  -2.508 -14.763  -7.357
  301   2HB   ARG  40          2HB       ARG  40  -3.371 -15.372  -8.760
  302   1HG   ARG  40          1HG       ARG  40  -1.298 -16.388  -9.581
  303   2HG   ARG  40          2HG       ARG  40  -0.451 -15.791  -8.153
  304   1HD   ARG  40          1HD       ARG  40  -1.853 -17.140  -6.713
  305   2HD   ARG  40          2HD       ARG  40  -2.819 -17.660  -8.093
  306    HE   ARG  40           HE       ARG  40  -0.716 -18.746  -8.921
  307   1HH1  ARG  40          1HH1      ARG  40  -1.303 -18.216  -5.505
  308   2HH1  ARG  40          2HH1      ARG  40  -0.178 -19.441  -4.992
  309   1HH2  ARG  40          1HH2      ARG  40   0.745 -20.386  -8.247
  310   2HH2  ARG  40          2HH2      ARG  40   0.970 -20.682  -6.542
  311    H    TRP  41           H        TRP  41  -3.592 -13.082 -11.071
  312    HA   TRP  41           HA       TRP  41  -5.162 -11.142  -9.623
  313   1HB   TRP  41          1HB       TRP  41  -6.086 -12.498 -12.146
  314   2HB   TRP  41          2HB       TRP  41  -6.422 -10.865 -11.596
  315    HD1  TRP  41           HD1      TRP  41  -4.645 -12.543 -14.193
  316    HE1  TRP  41           HE1      TRP  41  -2.769 -11.095 -15.189
  317    HE3  TRP  41           HE3      TRP  41  -4.272  -9.036 -10.491
  318    HZ2  TRP  41           HZ2      TRP  41  -1.320  -8.786 -14.501
  319    HZ3  TRP  41           HZ3      TRP  41  -2.610  -7.243 -10.740
  320    HH2  TRP  41           HH2      TRP  41  -1.167  -7.123 -12.703
  321    H    LEU  42           H        LEU  42  -5.888 -12.324  -7.828
  322    HA   LEU  42           HA       LEU  42  -6.541 -15.072  -7.951
  323   1HB   LEU  42          1HB       LEU  42  -7.785 -13.316  -5.894
  324   2HB   LEU  42          2HB       LEU  42  -7.168 -14.946  -5.732
  325    HG   LEU  42           HG       LEU  42  -5.536 -12.425  -5.944
  326   1HD1  LEU  42          1HD1      LEU  42  -6.664 -12.737  -3.826
  327   2HD1  LEU  42          2HD1      LEU  42  -4.928 -12.998  -3.653
  328   3HD1  LEU  42          3HD1      LEU  42  -6.025 -14.378  -3.711
  329   1HD2  LEU  42          1HD2      LEU  42  -4.624 -15.282  -5.610
  330   2HD2  LEU  42          2HD2      LEU  42  -3.600 -13.848  -5.544
  331   3HD2  LEU  42          3HD2      LEU  42  -4.399 -14.291  -7.053
  332    H    VAL  43           H        VAL  43  -8.740 -12.367  -7.339
  333    HA   VAL  43           HA       VAL  43 -11.080 -13.885  -7.517
  334    HB   VAL  43           HB       VAL  43 -12.078 -11.488  -7.998
  335   1HG1  VAL  43          1HG1      VAL  43 -12.288 -12.759  -5.905
  336   2HG1  VAL  43          2HG1      VAL  43 -12.002 -11.047  -5.592
  337   3HG1  VAL  43          3HG1      VAL  43 -10.685 -12.205  -5.420
  338   1HG2  VAL  43          1HG2      VAL  43  -9.961 -10.415  -8.569
  339   2HG2  VAL  43          2HG2      VAL  43  -9.292 -10.884  -7.006
  340   3HG2  VAL  43          3HG2      VAL  43 -10.616  -9.721  -7.085
  341    H    ASN  44           H        ASN  44  -9.313 -12.061  -9.937
  342    HA   ASN  44           HA       ASN  44 -11.042 -12.456 -12.100
  343   1HB   ASN  44          1HB       ASN  44  -8.030 -12.244 -12.048
  344   2HB   ASN  44          2HB       ASN  44  -9.001 -12.209 -13.519
  345   1HD2  ASN  44          1HD2      ASN  44  -8.145 -10.506 -10.603
  346   2HD2  ASN  44          2HD2      ASN  44  -8.758  -8.967 -11.087
  347    H    GLY  45           H        GLY  45  -8.130 -14.349 -11.249
  348   1HA   GLY  45          1HA       GLY  45  -8.410 -16.792 -11.075
  349   2HA   GLY  45          2HA       GLY  45  -9.422 -16.694 -12.505
  350    H    HIS  46           H        HIS  46  -6.305 -15.075 -11.949
  351    HA   HIS  46           HA       HIS  46  -5.032 -16.901 -13.864
  352   1HB   HIS  46          1HB       HIS  46  -5.088 -13.889 -14.140
  353   2HB   HIS  46          2HB       HIS  46  -3.948 -14.919 -14.995
  354    HD1  HIS  46           HD1      HIS  46  -6.952 -13.203 -15.593
  355    HD2  HIS  46           HD2      HIS  46  -5.608 -17.038 -16.505
  356    HE1  HIS  46           HE1      HIS  46  -8.393 -13.996 -17.493
  357    HE2  HIS  46           HE2      HIS  46  -7.427 -16.225 -18.163
  358    H    GLU  47           H        GLU  47  -2.612 -16.599 -13.919
  359    HA   GLU  47           HA       GLU  47  -1.518 -15.199 -11.602
  360   1HB   GLU  47          1HB       GLU  47   0.103 -17.144 -11.288
  361   2HB   GLU  47          2HB       GLU  47  -1.534 -17.340 -10.682
  362   1HG   GLU  47          1HG       GLU  47  -2.105 -18.661 -12.624
  363   2HG   GLU  47          2HG       GLU  47  -0.470 -18.462 -13.261
  364    H    THR  48           H        THR  48   0.344 -14.191 -11.952
  365    HA   THR  48           HA       THR  48   1.444 -14.309 -14.649
  366    HB   THR  48           HB       THR  48  -0.478 -12.886 -14.789
  367    HG1  THR  48           HG1      THR  48   0.880 -12.004 -16.165
  368   1HG2  THR  48          1HG2      THR  48  -0.593 -10.765 -13.536
  369   2HG2  THR  48          2HG2      THR  48   0.810 -11.284 -12.602
  370   3HG2  THR  48          3HG2      THR  48  -0.698 -12.191 -12.504
  371    H    THR  49           H        THR  49   2.983 -12.348 -14.883
  372    HA   THR  49           HA       THR  49   4.528 -11.783 -12.456
  373    HB   THR  49           HB       THR  49   5.727 -12.704 -15.092
  374    HG1  THR  49           HG1      THR  49   4.893 -14.074 -12.918
  375   1HG2  THR  49          1HG2      THR  49   7.878 -12.625 -13.905
  376   2HG2  THR  49          2HG2      THR  49   7.067 -11.960 -12.487
  377   3HG2  THR  49          3HG2      THR  49   7.125 -11.032 -13.986
  378    H    VAL  50           H        VAL  50   4.803  -9.585 -12.360
  379    HA   VAL  50           HA       VAL  50   4.287  -8.047 -14.836
  380    HB   VAL  50           HB       VAL  50   2.744  -7.268 -12.399
  381   1HG1  VAL  50          1HG1      VAL  50   2.753  -5.775 -14.298
  382   2HG1  VAL  50          2HG1      VAL  50   1.142  -6.459 -14.079
  383   3HG1  VAL  50          3HG1      VAL  50   2.194  -7.071 -15.354
  384   1HG2  VAL  50          1HG2      VAL  50   2.212  -9.623 -12.591
  385   2HG2  VAL  50          2HG2      VAL  50   1.842  -9.422 -14.304
  386   3HG2  VAL  50          3HG2      VAL  50   0.833  -8.642 -13.084
  387    H    TYR  51           H        TYR  51   4.218  -5.613 -14.210
  388    HA   TYR  51           HA       TYR  51   6.212  -4.945 -12.169
  389   1HB   TYR  51          1HB       TYR  51   6.382  -3.549 -14.808
  390   2HB   TYR  51          2HB       TYR  51   7.653  -3.886 -13.641
  391    HD1  TYR  51           HD1      TYR  51   8.885  -5.979 -13.716
  392    HD2  TYR  51           HD2      TYR  51   5.755  -5.207 -16.485
  393    HE1  TYR  51           HE1      TYR  51   9.649  -7.865 -15.098
  394    HE2  TYR  51           HE2      TYR  51   6.509  -7.087 -17.874
  395    HH   TYR  51           HH       TYR  51   8.413  -8.432 -18.289
  396    HA   PRO  52           HA       PRO  52   2.686  -2.102 -11.606
  397   1HB   PRO  52          1HB       PRO  52   4.384  -1.225  -9.343
  398   2HB   PRO  52          2HB       PRO  52   2.703  -1.769  -9.342
  399   1HG   PRO  52          1HG       PRO  52   4.654  -3.317  -8.370
  400   2HG   PRO  52          2HG       PRO  52   3.288  -4.009  -9.263
  401   1HD   PRO  52          1HD       PRO  52   6.089  -3.485 -10.184
  402   2HD   PRO  52          2HD       PRO  52   5.030  -4.873 -10.522
  403    H    GLY  53           H        GLY  53   2.439   0.044 -12.161
  404   1HA   GLY  53          1HA       GLY  53   4.821   1.317 -13.269
  405   2HA   GLY  53          2HA       GLY  53   3.154   1.751 -13.614
  406    H    SER  54           H        SER  54   5.423   1.665 -10.887
  407    HA   SER  54           HA       SER  54   5.969   3.184  -9.293
  408   1HB   SER  54          1HB       SER  54   6.246   4.777 -11.134
  409   2HB   SER  54          2HB       SER  54   4.522   5.137 -11.107
  410    HG   SER  54           HG       SER  54   4.765   6.327  -9.356
  411    H    ASP  55           H        ASP  55   4.941   4.762  -7.676
  412    HA   ASP  55           HA       ASP  55   3.403   5.219  -6.074
  413   1HB   ASP  55          1HB       ASP  55   1.509   4.920  -8.414
  414   2HB   ASP  55          2HB       ASP  55   1.073   5.618  -6.856
  415    H    ALA  56           H        ALA  56   4.248   2.587  -6.184
  416    HA   ALA  56           HA       ALA  56   2.112   0.720  -6.194
  417   1HB   ALA  56          1HB       ALA  56   4.440   0.087  -6.643
  418   2HB   ALA  56          2HB       ALA  56   3.737  -0.863  -5.335
  419   3HB   ALA  56          3HB       ALA  56   4.852   0.451  -4.967
  420    H    VAL  57           H        VAL  57   0.920  -0.114  -4.582
  421    HA   VAL  57           HA       VAL  57   1.469   0.650  -1.805
  422    HB   VAL  57           HB       VAL  57  -0.240   2.200  -2.858
  423   1HG1  VAL  57          1HG1      VAL  57  -1.501   0.605  -4.141
  424   2HG1  VAL  57          2HG1      VAL  57  -2.543   1.415  -2.968
  425   3HG1  VAL  57          3HG1      VAL  57  -1.974  -0.228  -2.659
  426   1HG2  VAL  57          1HG2      VAL  57  -1.636   2.268  -0.869
  427   2HG2  VAL  57          2HG2      VAL  57   0.072   2.065  -0.475
  428   3HG2  VAL  57          3HG2      VAL  57  -1.021   0.683  -0.402
  429    H    VAL  58           H        VAL  58  -0.414  -0.458  -0.526
  430    HA   VAL  58           HA       VAL  58  -0.452  -3.309  -1.297
  431    HB   VAL  58           HB       VAL  58   0.587  -2.316   1.370
  432   1HG1  VAL  58          1HG1      VAL  58   0.373  -5.110   0.259
  433   2HG1  VAL  58          2HG1      VAL  58  -0.581  -4.430   1.578
  434   3HG1  VAL  58          3HG1      VAL  58   1.156  -4.668   1.777
  435   1HG2  VAL  58          1HG2      VAL  58   2.199  -1.911  -0.421
  436   2HG2  VAL  58          2HG2      VAL  58   2.091  -3.605  -0.905
  437   3HG2  VAL  58          3HG2      VAL  58   2.759  -3.178   0.671
  438    H    VAL  59           H        VAL  59  -2.206  -4.420  -0.602
  439    HA   VAL  59           HA       VAL  59  -4.107  -3.155   1.212
  440    HB   VAL  59           HB       VAL  59  -5.752  -4.134  -0.566
  441   1HG1  VAL  59          1HG1      VAL  59  -4.345  -1.496  -0.888
  442   2HG1  VAL  59          2HG1      VAL  59  -5.747  -1.810   0.134
  443   3HG1  VAL  59          3HG1      VAL  59  -5.896  -1.906  -1.620
  444   1HG2  VAL  59          1HG2      VAL  59  -4.977  -3.778  -2.851
  445   2HG2  VAL  59          2HG2      VAL  59  -4.081  -5.052  -2.025
  446   3HG2  VAL  59          3HG2      VAL  59  -3.359  -3.456  -2.225
  447    H    THR  60           H        THR  60  -6.056  -4.746   1.325
  448    HA   THR  60           HA       THR  60  -4.962  -7.455   1.903
  449    HB   THR  60           HB       THR  60  -6.754  -7.453   3.738
  450    HG1  THR  60           HG1      THR  60  -6.909  -4.779   2.844
  451   1HG2  THR  60          1HG2      THR  60  -5.345  -6.184   5.307
  452   2HG2  THR  60          2HG2      THR  60  -4.475  -5.486   3.942
  453   3HG2  THR  60          3HG2      THR  60  -4.386  -7.219   4.251
  454    H    ALA  61           H        ALA  61  -7.189  -8.774   2.607
  455    HA   ALA  61           HA       ALA  61  -8.079  -9.767   0.185
  456   1HB   ALA  61          1HB       ALA  61  -7.992 -11.035   2.263
  457   2HB   ALA  61          2HB       ALA  61  -9.564 -11.172   1.473
  458   3HB   ALA  61          3HB       ALA  61  -9.370 -10.121   2.876
  459    H    THR  62           H        THR  62  -9.956  -7.651   2.400
  460    HA   THR  62           HA       THR  62 -12.390  -7.848   0.971
  461    HB   THR  62           HB       THR  62 -12.577  -5.365   1.930
  462    HG1  THR  62           HG1      THR  62 -11.277  -5.156   3.763
  463   1HG2  THR  62          1HG2      THR  62 -13.497  -6.357   3.982
  464   2HG2  THR  62          2HG2      THR  62 -12.738  -7.893   3.568
  465   3HG2  THR  62          3HG2      THR  62 -14.010  -7.233   2.541
  466    H    GLU  63           H        GLU  63  -9.954  -5.334   0.884
  467    HA   GLU  63           HA       GLU  63 -10.972  -3.779  -1.186
  468   1HB   GLU  63          1HB       GLU  63  -8.049  -4.249  -0.534
  469   2HB   GLU  63          2HB       GLU  63  -8.748  -2.819  -1.284
  470   1HG   GLU  63          1HG       GLU  63  -9.732  -2.109   0.711
  471   2HG   GLU  63          2HG       GLU  63  -9.559  -3.687   1.469
  472    H    HIS  64           H        HIS  64  -9.186  -6.730  -1.166
  473    HA   HIS  64           HA       HIS  64  -8.159  -6.798  -3.735
  474   1HB   HIS  64          1HB       HIS  64  -7.271  -8.625  -2.873
  475   2HB   HIS  64          2HB       HIS  64  -8.384  -8.549  -1.520
  476    HD1  HIS  64           HD1      HIS  64 -10.315 -10.218  -1.490
  477    HD2  HIS  64           HD2      HIS  64  -7.911 -10.529  -4.863
  478    HE1  HIS  64           HE1      HIS  64 -10.851 -12.453  -2.494
  479    HE2  HIS  64           HE2      HIS  64  -9.194 -12.717  -4.365
  480    H    ALA  65           H        ALA  65 -11.446  -7.731  -2.697
  481    HA   ALA  65           HA       ALA  65 -11.951  -9.414  -4.877
  482   1HB   ALA  65          1HB       ALA  65 -13.935  -7.770  -3.302
  483   2HB   ALA  65          2HB       ALA  65 -13.316  -9.353  -2.835
  484   3HB   ALA  65          3HB       ALA  65 -14.302  -9.186  -4.287
  485    H    GLU  66           H        GLU  66 -13.463  -6.304  -4.414
  486    HA   GLU  66           HA       GLU  66 -14.440  -5.907  -6.983
  487   1HB   GLU  66          1HB       GLU  66 -13.644  -3.591  -5.269
  488   2HB   GLU  66          2HB       GLU  66 -15.161  -3.888  -6.110
  489   1HG   GLU  66          1HG       GLU  66 -14.326  -5.537  -3.727
  490   2HG   GLU  66          2HG       GLU  66 -15.176  -4.004  -3.539
  491    H    ALA  67           H        ALA  67 -11.745  -4.268  -5.421
  492    HA   ALA  67           HA       ALA  67 -10.883  -2.775  -7.587
  493   1HB   ALA  67          1HB       ALA  67  -8.861  -2.356  -6.323
  494   2HB   ALA  67          2HB       ALA  67  -9.225  -3.706  -5.250
  495   3HB   ALA  67          3HB       ALA  67 -10.271  -2.286  -5.265
  496    H    GLU  68           H        GLU  68  -9.616  -5.919  -6.411
  497    HA   GLU  68           HA       GLU  68  -7.507  -6.053  -8.239
  498   1HB   GLU  68          1HB       GLU  68  -7.718  -7.554  -6.307
  499   2HB   GLU  68          2HB       GLU  68  -9.044  -8.377  -7.109
  500   1HG   GLU  68          1HG       GLU  68  -7.621  -9.253  -8.769
  501   2HG   GLU  68          2HG       GLU  68  -6.290  -8.198  -8.280
  502    H    LYS  69           H        LYS  69 -10.906  -7.075  -8.625
  503    HA   LYS  69           HA       LYS  69 -10.570  -8.313 -11.113
  504   1HB   LYS  69          1HB       LYS  69 -12.890  -6.699 -10.048
  505   2HB   LYS  69          2HB       LYS  69 -12.950  -7.600 -11.558
  506   1HG   LYS  69          1HG       LYS  69 -12.497  -9.669 -10.332
  507   2HG   LYS  69          2HG       LYS  69 -12.471  -8.759  -8.821
  508   1HD   LYS  69          1HD       LYS  69 -14.791  -8.118  -9.135
  509   2HD   LYS  69          2HD       LYS  69 -14.826  -8.934 -10.699
  510   1HE   LYS  69          1HE       LYS  69 -14.386 -11.075  -9.578
  511   2HE   LYS  69          2HE       LYS  69 -14.380 -10.252  -8.019
  512   1HZ   LYS  69          1HZ       LYS  69 -16.691 -10.331  -9.880
  513   2HZ   LYS  69          2HZ       LYS  69 -16.672  -9.660  -8.318
  514   3HZ   LYS  69          3HZ       LYS  69 -16.509 -11.336  -8.525
  515    H    ARG  70           H        ARG  70 -11.731  -4.947 -10.636
  516    HA   ARG  70           HA       ARG  70 -11.449  -4.249 -13.371
  517   1HB   ARG  70          1HB       ARG  70 -11.497  -2.553 -10.880
  518   2HB   ARG  70          2HB       ARG  70 -11.434  -1.859 -12.494
  519   1HG   ARG  70          1HG       ARG  70 -13.534  -3.006 -13.049
  520   2HG   ARG  70          2HG       ARG  70 -13.604  -3.640 -11.405
  521   1HD   ARG  70          1HD       ARG  70 -13.844  -1.454 -10.492
  522   2HD   ARG  70          2HD       ARG  70 -13.483  -0.702 -12.047
  523    HE   ARG  70           HE       ARG  70 -15.719  -2.345 -12.378
  524   1HH1  ARG  70          1HH1      ARG  70 -14.854   0.570 -10.636
  525   2HH1  ARG  70          2HH1      ARG  70 -16.450   1.250 -10.718
  526   1HH2  ARG  70          1HH2      ARG  70 -17.805  -1.437 -12.535
  527   2HH2  ARG  70          2HH2      ARG  70 -18.125   0.120 -11.823
  528    H    ALA  71           H        ALA  71  -9.362  -3.399 -10.687
  529    HA   ALA  71           HA       ALA  71  -7.356  -2.112 -12.091
  530   1HB   ALA  71          1HB       ALA  71  -6.047  -2.325 -10.083
  531   2HB   ALA  71          2HB       ALA  71  -7.122  -3.593  -9.488
  532   3HB   ALA  71          3HB       ALA  71  -7.722  -1.945  -9.682
  533    H    ALA  72           H        ALA  72  -7.840  -5.595 -11.696
  534    HA   ALA  72           HA       ALA  72  -5.167  -6.292 -12.441
  535   1HB   ALA  72          1HB       ALA  72  -6.025  -8.519 -12.922
  536   2HB   ALA  72          2HB       ALA  72  -7.678  -7.925 -12.780
  537   3HB   ALA  72          3HB       ALA  72  -6.622  -7.935 -11.370
  538    H    ALA  73           H        ALA  73  -8.217  -5.879 -14.200
  539    HA   ALA  73           HA       ALA  73  -7.282  -6.384 -16.788
  540   1HB   ALA  73          1HB       ALA  73  -9.253  -4.250 -15.956
  541   2HB   ALA  73          2HB       ALA  73  -9.643  -5.943 -16.266
  542   3HB   ALA  73          3HB       ALA  73  -9.064  -4.917 -17.579
  543    H    ARG  74           H        ARG  74  -6.859  -3.595 -14.711
  544    HA   ARG  74           HA       ARG  74  -5.571  -1.938 -16.671
  545   1HB   ARG  74          1HB       ARG  74  -6.079  -1.809 -13.772
  546   2HB   ARG  74          2HB       ARG  74  -4.640  -0.964 -14.313
  547   1HG   ARG  74          1HG       ARG  74  -6.422   0.590 -14.259
  548   2HG   ARG  74          2HG       ARG  74  -6.056   0.260 -15.951
  549   1HD   ARG  74          1HD       ARG  74  -8.062  -0.716 -16.326
  550   2HD   ARG  74          2HD       ARG  74  -8.127  -1.440 -14.718
  551    HE   ARG  74           HE       ARG  74  -8.809   0.721 -13.852
  552   1HH1  ARG  74          1HH1      ARG  74  -8.960   0.341 -17.339
  553   2HH1  ARG  74          2HH1      ARG  74 -10.176   1.568 -17.543
  554   1HH2  ARG  74          1HH2      ARG  74 -10.394   2.314 -14.117
  555   2HH2  ARG  74          2HH2      ARG  74 -11.023   2.677 -15.699
  556    H    ALA  75           H        ALA  75  -4.253  -3.803 -13.925
  557    HA   ALA  75           HA       ALA  75  -1.640  -2.915 -14.015
  558   1HB   ALA  75          1HB       ALA  75  -2.628  -4.234 -12.201
  559   2HB   ALA  75          2HB       ALA  75  -1.063  -4.861 -12.722
  560   3HB   ALA  75          3HB       ALA  75  -2.548  -5.671 -13.220
  561    H    GLY  76           H        GLY  76  -3.008  -5.677 -15.812
  562   1HA   GLY  76          1HA       GLY  76  -0.326  -6.357 -16.760
  563   2HA   GLY  76          2HA       GLY  76  -1.785  -7.275 -17.069
  564    H    HIS  77           H        HIS  77  -1.750  -3.858 -17.605
  565    HA   HIS  77           HA       HIS  77  -2.490  -4.098 -20.323
  566   1HB   HIS  77          1HB       HIS  77  -2.456  -1.697 -20.404
  567   2HB   HIS  77          2HB       HIS  77  -3.073  -2.163 -18.825
  568    HD1  HIS  77           HD1      HIS  77  -0.720   0.056 -20.371
  569    HD2  HIS  77           HD2      HIS  77  -0.893  -2.020 -16.769
  570    HE1  HIS  77           HE1      HIS  77   0.960   1.168 -18.859
  571    HE2  HIS  77           HE2      HIS  77   0.975  -0.237 -16.766
  572    H    ALA  78           H        ALA  78   0.594  -3.835 -18.752
  573    HA   ALA  78           HA       ALA  78   1.887  -3.484 -21.376
  574   1HB   ALA  78          1HB       ALA  78   2.174  -1.530 -19.932
  575   2HB   ALA  78          2HB       ALA  78   3.711  -2.337 -20.236
  576   3HB   ALA  78          3HB       ALA  78   2.893  -2.551 -18.689
  577    H    ALA  79           H        ALA  79   1.100  -5.962 -19.910
  578    HA   ALA  79           HA       ALA  79   3.607  -7.134 -19.086
  579   1HB   ALA  79          1HB       ALA  79   0.926  -8.446 -19.528
  580   2HB   ALA  79          2HB       ALA  79   1.512  -7.797 -17.997
  581   3HB   ALA  79          3HB       ALA  79   2.325  -9.175 -18.739
  582    H    THR  80           H        THR  80   4.686  -6.634 -21.129
  583    HA   THR  80           HA       THR  80   4.025  -8.542 -23.270
  584    HB   THR  80           HB       THR  80   5.651  -5.992 -23.474
  585    HG1  THR  80           HG1      THR  80   2.933  -6.609 -24.024
  586   1HG2  THR  80          1HG2      THR  80   4.599  -7.851 -25.610
  587   2HG2  THR  80          2HG2      THR  80   6.287  -7.675 -25.133
  588   3HG2  THR  80          3HG2      THR  80   5.443  -6.327 -25.893
  Start of MODEL   23
    1    H    MET   1           H        MET   1  10.429   0.635  -0.367
    2    HA   MET   1           HA       MET   1   7.541   0.904   0.227
    3   1HB   MET   1          1HB       MET   1   8.198   1.113  -2.182
    4   2HB   MET   1          2HB       MET   1   8.955  -0.469  -2.077
    5   1HG   MET   1          1HG       MET   1   6.724  -1.407  -1.466
    6   2HG   MET   1          2HG       MET   1   6.032   0.178  -1.804
    7   1HE   MET   1          1HE       MET   1   5.175  -2.643  -3.179
    8   2HE   MET   1          2HE       MET   1   4.891  -2.073  -4.824
    9   3HE   MET   1          3HE       MET   1   4.361  -1.102  -3.448
   10    H    HIS   2           H        HIS   2   6.505  -1.259   0.369
   11    HA   HIS   2           HA       HIS   2   8.288  -3.410   1.236
   12   1HB   HIS   2          1HB       HIS   2   6.137  -2.119   2.879
   13   2HB   HIS   2          2HB       HIS   2   6.436  -3.843   3.057
   14    HD1  HIS   2           HD1      HIS   2   8.942  -4.490   3.793
   15    HD2  HIS   2           HD2      HIS   2   7.854  -0.509   4.275
   16    HE1  HIS   2           HE1      HIS   2  10.601  -3.528   5.418
   17    HE2  HIS   2           HE2      HIS   2  10.039  -1.075   5.546
   18    H    ALA   3           H        ALA   3   7.554  -5.437   0.753
   19    HA   ALA   3           HA       ALA   3   4.844  -5.705  -0.327
   20   1HB   ALA   3          1HB       ALA   3   5.651  -6.932  -2.276
   21   2HB   ALA   3          2HB       ALA   3   7.317  -6.638  -1.783
   22   3HB   ALA   3          3HB       ALA   3   6.288  -5.288  -2.260
   23    H    LYS   4           H        LYS   4   3.956  -7.695  -0.004
   24    HA   LYS   4           HA       LYS   4   5.537  -9.702   1.400
   25   1HB   LYS   4          1HB       LYS   4   3.120  -8.295   2.501
   26   2HB   LYS   4          2HB       LYS   4   3.627  -9.872   3.082
   27   1HG   LYS   4          1HG       LYS   4   5.832  -8.888   3.659
   28   2HG   LYS   4          2HG       LYS   4   5.191  -7.305   3.211
   29   1HD   LYS   4          1HD       LYS   4   3.526  -7.425   4.928
   30   2HD   LYS   4          2HD       LYS   4   3.944  -9.101   5.285
   31   1HE   LYS   4          1HE       LYS   4   6.214  -8.318   5.947
   32   2HE   LYS   4          2HE       LYS   4   5.651  -6.659   5.740
   33   1HZ   LYS   4          1HZ       LYS   4   4.447  -8.637   7.598
   34   2HZ   LYS   4          2HZ       LYS   4   4.012  -7.006   7.445
   35   3HZ   LYS   4          3HZ       LYS   4   5.540  -7.421   8.052
   36    H    VAL   5           H        VAL   5   4.900 -11.769   1.019
   37    HA   VAL   5           HA       VAL   5   2.813 -12.311  -0.848
   38    HB   VAL   5           HB       VAL   5   4.658 -13.852  -0.728
   39   1HG1  VAL   5          1HG1      VAL   5   5.365 -13.460   1.556
   40   2HG1  VAL   5          2HG1      VAL   5   5.169 -15.188   1.270
   41   3HG1  VAL   5          3HG1      VAL   5   3.937 -14.297   2.164
   42   1HG2  VAL   5          1HG2      VAL   5   2.214 -15.170   0.445
   43   2HG2  VAL   5          2HG2      VAL   5   3.547 -16.008  -0.349
   44   3HG2  VAL   5          3HG2      VAL   5   2.535 -14.892  -1.267
   45    H    GLY   6           H        GLY   6   0.681 -13.122  -0.405
   46   1HA   GLY   6          1HA       GLY   6  -1.238 -13.535   0.907
   47   2HA   GLY   6          2HA       GLY   6  -0.270 -13.288   2.360
   48    H    ASP   7           H        ASP   7   0.128 -11.123  -0.089
   49    HA   ASP   7           HA       ASP   7  -1.440  -8.936   1.145
   50   1HB   ASP   7          1HB       ASP   7   1.577  -9.137   1.068
   51   2HB   ASP   7          2HB       ASP   7   0.804  -7.570   0.867
   52    H    TYR   8           H        TYR   8  -1.476  -7.080  -0.326
   53    HA   TYR   8           HA       TYR   8  -1.945  -8.187  -3.022
   54   1HB   TYR   8          1HB       TYR   8  -3.905  -7.111  -0.942
   55   2HB   TYR   8          2HB       TYR   8  -4.256  -6.977  -2.645
   56    HD1  TYR   8           HD1      TYR   8  -4.248  -9.164   0.272
   57    HD2  TYR   8           HD2      TYR   8  -4.893  -8.944  -3.926
   58    HE1  TYR   8           HE1      TYR   8  -5.626 -11.212   0.361
   59    HE2  TYR   8           HE2      TYR   8  -6.248 -11.002  -3.842
   60    HH   TYR   8           HH       TYR   8  -6.240 -13.107  -2.009
   61    H    LEU   9           H        LEU   9  -2.332  -6.241  -4.496
   62    HA   LEU   9           HA       LEU   9  -1.039  -3.875  -3.303
   63   1HB   LEU   9          1HB       LEU   9   0.772  -5.300  -3.957
   64   2HB   LEU   9          2HB       LEU   9   0.005  -5.699  -5.473
   65    HG   LEU   9           HG       LEU   9   1.055  -2.923  -4.885
   66   1HD1  LEU   9          1HD1      LEU   9   3.047  -3.567  -6.147
   67   2HD1  LEU   9          2HD1      LEU   9   2.460  -5.227  -6.229
   68   3HD1  LEU   9          3HD1      LEU   9   2.886  -4.519  -4.671
   69   1HD2  LEU   9          1HD2      LEU   9   1.126  -2.748  -7.330
   70   2HD2  LEU   9          2HD2      LEU   9  -0.510  -3.091  -6.770
   71   3HD2  LEU   9          3HD2      LEU   9   0.470  -4.379  -7.471
   72    H    VAL  10           H        VAL  10  -1.284  -2.029  -4.379
   73    HA   VAL  10           HA       VAL  10  -3.197  -1.853  -6.594
   74    HB   VAL  10           HB       VAL  10  -3.581  -0.666  -3.832
   75   1HG1  VAL  10          1HG1      VAL  10  -5.460   0.612  -4.730
   76   2HG1  VAL  10          2HG1      VAL  10  -5.068   0.055  -6.357
   77   3HG1  VAL  10          3HG1      VAL  10  -3.943   1.097  -5.485
   78   1HG2  VAL  10          1HG2      VAL  10  -5.795  -1.690  -3.982
   79   2HG2  VAL  10          2HG2      VAL  10  -4.513  -2.888  -4.148
   80   3HG2  VAL  10          3HG2      VAL  10  -5.388  -2.332  -5.574
   81    H    VAL  11           H        VAL  11  -2.937   0.015  -7.798
   82    HA   VAL  11           HA       VAL  11  -0.918   1.959  -6.928
   83    HB   VAL  11           HB       VAL  11  -0.904   0.558  -9.618
   84   1HG1  VAL  11          1HG1      VAL  11   0.952   2.666  -8.528
   85   2HG1  VAL  11          2HG1      VAL  11  -0.250   2.900  -9.798
   86   3HG1  VAL  11          3HG1      VAL  11   1.127   1.830 -10.071
   87   1HG2  VAL  11          1HG2      VAL  11   1.281  -0.318  -8.927
   88   2HG2  VAL  11          2HG2      VAL  11  -0.019  -0.877  -7.874
   89   3HG2  VAL  11          3HG2      VAL  11   1.059   0.411  -7.336
   90    H    LYS  12           H        LYS  12  -1.322   4.038  -7.661
   91    HA   LYS  12           HA       LYS  12  -3.859   4.379  -9.126
   92   1HB   LYS  12          1HB       LYS  12  -2.536   6.618  -7.650
   93   2HB   LYS  12          2HB       LYS  12  -4.244   6.343  -7.958
   94   1HG   LYS  12          1HG       LYS  12  -4.151   4.447  -6.336
   95   2HG   LYS  12          2HG       LYS  12  -2.503   4.943  -5.945
   96   1HD   LYS  12          1HD       LYS  12  -3.551   7.267  -5.528
   97   2HD   LYS  12          2HD       LYS  12  -5.080   6.388  -5.447
   98   1HE   LYS  12          1HE       LYS  12  -4.348   6.503  -3.225
   99   2HE   LYS  12          2HE       LYS  12  -3.917   4.876  -3.753
  100   1HZ   LYS  12          1HZ       LYS  12  -2.110   7.216  -3.522
  101   2HZ   LYS  12          2HZ       LYS  12  -1.654   5.754  -4.239
  102   3HZ   LYS  12          3HZ       LYS  12  -2.068   5.801  -2.589
  103    H    GLY  13           H        GLY  13  -0.745   4.252  -9.835
  104   1HA   GLY  13          1HA       GLY  13  -0.390   6.794 -11.173
  105   2HA   GLY  13          2HA       GLY  13   0.771   5.479 -11.100
  106    H    THR  14           H        THR  14  -2.579   5.483 -12.272
  107    HA   THR  14           HA       THR  14  -1.537   4.728 -14.919
  108    HB   THR  14           HB       THR  14  -3.853   3.758 -15.282
  109    HG1  THR  14           HG1      THR  14  -4.966   3.240 -13.274
  110   1HG2  THR  14          1HG2      THR  14  -3.360   1.699 -14.048
  111   2HG2  THR  14          2HG2      THR  14  -2.164   2.563 -13.082
  112   3HG2  THR  14          3HG2      THR  14  -1.911   2.350 -14.816
  113    H    THR  15           H        THR  15  -4.773   5.800 -14.019
  114    HA   THR  15           HA       THR  15  -4.346   8.247 -15.605
  115    HB   THR  15           HB       THR  15  -6.903   6.634 -15.470
  116    HG1  THR  15           HG1      THR  15  -4.842   6.840 -17.436
  117   1HG2  THR  15          1HG2      THR  15  -7.275   9.037 -15.799
  118   2HG2  THR  15          2HG2      THR  15  -7.662   8.124 -17.257
  119   3HG2  THR  15          3HG2      THR  15  -6.149   9.025 -17.158
  120    H    THR  16           H        THR  16  -7.139   7.143 -13.679
  121    HA   THR  16           HA       THR  16  -6.458   9.050 -11.581
  122    HB   THR  16           HB       THR  16  -7.822  10.338 -13.242
  123    HG1  THR  16           HG1      THR  16  -7.954  10.355 -10.677
  124   1HG2  THR  16          1HG2      THR  16 -10.216   9.882 -13.411
  125   2HG2  THR  16          2HG2      THR  16 -10.024   8.447 -12.405
  126   3HG2  THR  16          3HG2      THR  16  -9.273   8.513 -13.999
  127    H    GLU  17           H        GLU  17  -7.272   6.084 -12.416
  128    HA   GLU  17           HA       GLU  17  -9.306   5.365 -10.587
  129   1HB   GLU  17          1HB       GLU  17  -7.099   3.762 -11.892
  130   2HB   GLU  17          2HB       GLU  17  -8.359   3.047 -10.900
  131   1HG   GLU  17          1HG       GLU  17  -8.858   2.776 -13.249
  132   2HG   GLU  17          2HG       GLU  17 -10.051   3.814 -12.478
  133    H    ARG  18           H        ARG  18  -9.085   5.815  -8.502
  134    HA   ARG  18           HA       ARG  18  -6.585   6.133  -7.208
  135   1HB   ARG  18          1HB       ARG  18  -9.135   6.948  -6.713
  136   2HB   ARG  18          2HB       ARG  18  -8.945   5.688  -5.503
  137   1HG   ARG  18          1HG       ARG  18  -7.027   6.801  -4.569
  138   2HG   ARG  18          2HG       ARG  18  -7.062   8.013  -5.856
  139   1HD   ARG  18          1HD       ARG  18  -9.389   8.593  -5.080
  140   2HD   ARG  18          2HD       ARG  18  -9.094   7.564  -3.682
  141    HE   ARG  18           HE       ARG  18  -7.069   9.147  -3.366
  142   1HH1  ARG  18          1HH1      ARG  18 -10.180  10.058  -4.680
  143   2HH1  ARG  18          2HH1      ARG  18 -10.144  11.666  -4.026
  144   1HH2  ARG  18          1HH2      ARG  18  -6.993  11.296  -2.520
  145   2HH2  ARG  18          2HH2      ARG  18  -8.332  12.363  -2.800
  146    H    HIS  19           H        HIS  19  -8.384   3.378  -7.929
  147    HA   HIS  19           HA       HIS  19  -6.663   1.781  -6.169
  148   1HB   HIS  19          1HB       HIS  19  -9.602   1.173  -6.633
  149   2HB   HIS  19          2HB       HIS  19  -8.482   0.210  -5.684
  150    HD1  HIS  19           HD1      HIS  19  -8.625   0.604  -3.224
  151    HD2  HIS  19           HD2      HIS  19  -9.986   3.866  -5.419
  152    HE1  HIS  19           HE1      HIS  19  -9.513   2.234  -1.539
  153    HE2  HIS  19           HE2      HIS  19 -10.588   4.051  -2.916
  154    H    ASP  20           H        ASP  20  -5.576   1.896  -8.421
  155    HA   ASP  20           HA       ASP  20  -6.888   0.038 -10.298
  156   1HB   ASP  20          1HB       ASP  20  -6.171   2.481 -10.943
  157   2HB   ASP  20          2HB       ASP  20  -4.561   1.782 -11.046
  158    H    GLN  21           H        GLN  21  -5.019  -1.024 -11.729
  159    HA   GLN  21           HA       GLN  21  -3.651  -2.868 -11.701
  160   1HB   GLN  21          1HB       GLN  21  -1.949  -0.815 -10.285
  161   2HB   GLN  21          2HB       GLN  21  -1.335  -2.313 -10.968
  162   1HG   GLN  21          1HG       GLN  21  -2.107  -1.580 -13.192
  163   2HG   GLN  21          2HG       GLN  21  -2.623  -0.051 -12.482
  164   1HE2  GLN  21          1HE2      GLN  21   0.096  -2.019 -13.383
  165   2HE2  GLN  21          2HE2      GLN  21   1.297  -0.780 -13.261
  166    H    HIS  22           H        HIS  22  -4.619  -4.499 -10.345
  167    HA   HIS  22           HA       HIS  22  -3.382  -4.601  -7.694
  168   1HB   HIS  22          1HB       HIS  22  -5.489  -3.567  -7.222
  169   2HB   HIS  22          2HB       HIS  22  -6.357  -4.763  -8.178
  170    HD1  HIS  22           HD1      HIS  22  -4.802  -4.235  -4.835
  171    HD2  HIS  22           HD2      HIS  22  -6.695  -7.244  -6.949
  172    HE1  HIS  22           HE1      HIS  22  -5.307  -6.029  -3.151
  173    HE2  HIS  22           HE2      HIS  22  -6.157  -7.952  -4.544
  174    H    ALA  23           H        ALA  23  -3.004  -6.414  -6.853
  175    HA   ALA  23           HA       ALA  23  -3.603  -8.992  -8.148
  176   1HB   ALA  23          1HB       ALA  23  -1.528  -8.131  -9.157
  177   2HB   ALA  23          2HB       ALA  23  -1.252  -9.578  -8.187
  178   3HB   ALA  23          3HB       ALA  23  -0.812  -7.991  -7.551
  179    H    GLU  24           H        GLU  24  -2.428 -10.752  -6.815
  180    HA   GLU  24           HA       GLU  24  -2.048  -9.948  -4.012
  181   1HB   GLU  24          1HB       GLU  24  -4.176 -11.223  -4.074
  182   2HB   GLU  24          2HB       GLU  24  -3.327 -12.558  -4.854
  183   1HG   GLU  24          1HG       GLU  24  -1.734 -12.339  -2.766
  184   2HG   GLU  24          2HG       GLU  24  -3.149 -11.587  -2.039
  185    H    ILE  25           H        ILE  25  -0.272 -10.465  -3.332
  186    HA   ILE  25           HA       ILE  25   1.646 -11.616  -5.110
  187    HB   ILE  25           HB       ILE  25   1.895 -10.354  -2.375
  188   1HG1  ILE  25          1HG1      ILE  25   2.314  -9.157  -5.121
  189   2HG1  ILE  25          2HG1      ILE  25   0.928  -8.848  -4.082
  190   1HG2  ILE  25          1HG2      ILE  25   3.976 -10.903  -4.455
  191   2HG2  ILE  25          2HG2      ILE  25   3.797 -11.730  -2.906
  192   3HG2  ILE  25          3HG2      ILE  25   4.222 -10.018  -2.951
  193   1HD1  ILE  25          1HD1      ILE  25   2.398  -7.824  -2.428
  194   2HD1  ILE  25          2HD1      ILE  25   2.526  -7.028  -3.997
  195   3HD1  ILE  25          3HD1      ILE  25   3.787  -8.142  -3.467
  196    H    ILE  26           H        ILE  26   1.673 -13.807  -5.124
  197    HA   ILE  26           HA       ILE  26   1.780 -15.198  -2.538
  198    HB   ILE  26           HB       ILE  26   1.409 -17.278  -3.640
  199   1HG1  ILE  26          1HG1      ILE  26   2.819 -16.769  -5.679
  200   2HG1  ILE  26          2HG1      ILE  26   1.313 -17.609  -6.023
  201   1HG2  ILE  26          1HG2      ILE  26  -0.606 -15.967  -3.268
  202   2HG2  ILE  26          2HG2      ILE  26  -0.773 -16.884  -4.765
  203   3HG2  ILE  26          3HG2      ILE  26  -0.410 -15.160  -4.823
  204   1HD1  ILE  26          1HD1      ILE  26   1.854 -14.678  -6.423
  205   2HD1  ILE  26          2HD1      ILE  26   0.313 -15.483  -6.720
  206   3HD1  ILE  26          3HD1      ILE  26   1.731 -15.913  -7.677
  207    H    GLU  27           H        GLU  27   3.647 -14.015  -5.058
  208    HA   GLU  27           HA       GLU  27   6.035 -15.160  -3.835
  209   1HB   GLU  27          1HB       GLU  27   5.269 -15.270  -6.726
  210   2HB   GLU  27          2HB       GLU  27   6.963 -15.098  -6.298
  211   1HG   GLU  27          1HG       GLU  27   5.157 -17.321  -5.379
  212   2HG   GLU  27          2HG       GLU  27   6.332 -17.428  -6.691
  213    H    VAL  28           H        VAL  28   7.898 -13.849  -4.093
  214    HA   VAL  28           HA       VAL  28   7.297 -11.039  -4.703
  215    HB   VAL  28           HB       VAL  28   8.719 -11.873  -2.171
  216   1HG1  VAL  28          1HG1      VAL  28   7.581  -9.232  -3.079
  217   2HG1  VAL  28          2HG1      VAL  28   9.288  -9.664  -2.996
  218   3HG1  VAL  28          3HG1      VAL  28   8.338  -9.538  -1.514
  219   1HG2  VAL  28          1HG2      VAL  28   6.408 -12.639  -2.025
  220   2HG2  VAL  28          2HG2      VAL  28   5.838 -11.025  -2.453
  221   3HG2  VAL  28          3HG2      VAL  28   6.695 -11.285  -0.932
  222    H    ARG  29           H        ARG  29   8.841 -10.719  -6.278
  223    HA   ARG  29           HA       ARG  29  11.110 -12.529  -6.331
  224   1HB   ARG  29          1HB       ARG  29   9.652 -12.362  -8.282
  225   2HB   ARG  29          2HB       ARG  29  10.015 -10.653  -8.429
  226   1HG   ARG  29          1HG       ARG  29  11.230 -11.951 -10.076
  227   2HG   ARG  29          2HG       ARG  29  12.339 -11.182  -8.944
  228   1HD   ARG  29          1HD       ARG  29  11.427 -13.984  -8.447
  229   2HD   ARG  29          2HD       ARG  29  12.680 -13.678  -9.650
  230    HE   ARG  29           HE       ARG  29  13.114 -12.485  -7.039
  231   1HH1  ARG  29          1HH1      ARG  29  13.739 -15.219  -9.148
  232   2HH1  ARG  29          2HH1      ARG  29  15.182 -15.695  -8.298
  233   1HH2  ARG  29          1HH2      ARG  29  14.999 -13.121  -5.930
  234   2HH2  ARG  29          2HH2      ARG  29  15.889 -14.507  -6.467
  235    H    SER  30           H        SER  30  10.534  -9.103  -5.919
  236    HA   SER  30           HA       SER  30  13.128  -8.265  -6.711
  237   1HB   SER  30          1HB       SER  30  12.465  -6.158  -5.402
  238   2HB   SER  30          2HB       SER  30  11.462  -6.604  -6.783
  239    HG   SER  30           HG       SER  30  10.071  -6.182  -5.133
  240    H    ALA  31           H        ALA  31  11.967  -7.541  -3.480
  241    HA   ALA  31           HA       ALA  31  13.660  -9.228  -2.002
  242   1HB   ALA  31          1HB       ALA  31  15.404  -7.695  -1.280
  243   2HB   ALA  31          2HB       ALA  31  14.764  -6.435  -2.335
  244   3HB   ALA  31          3HB       ALA  31  15.467  -7.894  -3.032
  245    H    ASP  32           H        ASP  32  12.871  -5.777  -1.878
  246    HA   ASP  32           HA       ASP  32  10.892  -6.229   0.188
  247   1HB   ASP  32          1HB       ASP  32  12.998  -6.009   1.471
  248   2HB   ASP  32          2HB       ASP  32  13.308  -4.465   0.685
  249    H    GLY  33           H        GLY  33   9.430  -5.442  -1.298
  250   1HA   GLY  33          1HA       GLY  33   8.182  -3.747  -2.278
  251   2HA   GLY  33          2HA       GLY  33   9.374  -2.585  -1.707
  252    H    SER  34           H        SER  34   8.449  -2.160  -4.177
  253    HA   SER  34           HA       SER  34   9.168  -1.666  -6.271
  254   1HB   SER  34          1HB       SER  34  11.803  -2.853  -5.360
  255   2HB   SER  34          2HB       SER  34  11.559  -1.917  -6.836
  256    HG   SER  34           HG       SER  34  10.663  -0.714  -4.514
  257    HA   PRO  35           HA       PRO  35   8.489  -5.343  -8.637
  258   1HB   PRO  35          1HB       PRO  35   9.824  -4.163 -10.953
  259   2HB   PRO  35          2HB       PRO  35   8.109  -4.495 -10.710
  260   1HG   PRO  35          1HG       PRO  35   9.106  -1.985 -10.792
  261   2HG   PRO  35          2HG       PRO  35   7.699  -2.422  -9.807
  262   1HD   PRO  35          1HD       PRO  35  10.552  -2.041  -8.973
  263   2HD   PRO  35          2HD       PRO  35   9.060  -1.516  -8.162
  264    HA   PRO  36           HA       PRO  36   8.525  -6.593 -10.367
  265   1HB   PRO  36          1HB       PRO  36   9.123  -9.157 -11.198
  266   2HB   PRO  36          2HB       PRO  36   9.406  -7.700 -12.150
  267   1HG   PRO  36          1HG       PRO  36  11.353  -9.468 -11.021
  268   2HG   PRO  36          2HG       PRO  36  11.636  -7.993 -11.957
  269   1HD   PRO  36          1HD       PRO  36  11.675  -8.410  -9.029
  270   2HD   PRO  36          2HD       PRO  36  12.501  -7.178 -10.007
  271    H    TYR  37           H        TYR  37   7.073  -8.626 -10.232
  272    HA   TYR  37           HA       TYR  37   7.380 -10.066  -7.692
  273   1HB   TYR  37          1HB       TYR  37   4.803  -8.761  -8.593
  274   2HB   TYR  37          2HB       TYR  37   5.036  -9.713  -7.134
  275    HD1  TYR  37           HD1      TYR  37   4.955  -6.459  -8.500
  276    HD2  TYR  37           HD2      TYR  37   6.777  -8.774  -5.431
  277    HE1  TYR  37           HE1      TYR  37   5.476  -4.397  -7.264
  278    HE2  TYR  37           HE2      TYR  37   7.296  -6.720  -4.186
  279    HH   TYR  37           HH       TYR  37   7.668  -4.273  -4.786
  280    H    VAL  38           H        VAL  38   5.632 -11.819  -7.592
  281    HA   VAL  38           HA       VAL  38   4.765 -12.682 -10.259
  282    HB   VAL  38           HB       VAL  38   6.078 -14.555  -8.263
  283   1HG1  VAL  38          1HG1      VAL  38   4.783 -15.106 -10.941
  284   2HG1  VAL  38          2HG1      VAL  38   4.144 -15.570  -9.365
  285   3HG1  VAL  38          3HG1      VAL  38   5.640 -16.292  -9.956
  286   1HG2  VAL  38          1HG2      VAL  38   7.698 -13.246  -9.547
  287   2HG2  VAL  38          2HG2      VAL  38   6.919 -13.749 -11.047
  288   3HG2  VAL  38          3HG2      VAL  38   7.723 -14.943 -10.029
  289    H    VAL  39           H        VAL  39   2.713 -13.110 -10.192
  290    HA   VAL  39           HA       VAL  39   1.462 -12.914  -7.564
  291    HB   VAL  39           HB       VAL  39   2.269 -10.730  -9.027
  292   1HG1  VAL  39          1HG1      VAL  39   0.652 -11.052 -10.768
  293   2HG1  VAL  39          2HG1      VAL  39   0.248  -9.608  -9.839
  294   3HG1  VAL  39          3HG1      VAL  39  -0.659 -11.100  -9.589
  295   1HG2  VAL  39          1HG2      VAL  39   0.902  -9.414  -7.495
  296   2HG2  VAL  39          2HG2      VAL  39   1.769 -10.718  -6.684
  297   3HG2  VAL  39          3HG2      VAL  39   0.045 -10.879  -7.020
  298    H    ARG  40           H        ARG  40  -1.000 -12.697  -7.950
  299    HA   ARG  40           HA       ARG  40  -1.816 -13.986 -10.447
  300   1HB   ARG  40          1HB       ARG  40  -2.736 -14.815  -7.682
  301   2HB   ARG  40          2HB       ARG  40  -3.411 -15.407  -9.189
  302   1HG   ARG  40          1HG       ARG  40  -1.347 -16.517  -9.729
  303   2HG   ARG  40          2HG       ARG  40  -0.566 -15.823  -8.304
  304   1HD   ARG  40          1HD       ARG  40  -2.168 -17.006  -6.867
  305   2HD   ARG  40          2HD       ARG  40  -2.913 -17.719  -8.297
  306    HE   ARG  40           HE       ARG  40  -0.462 -18.589  -8.642
  307   1HH1  ARG  40          1HH1      ARG  40  -2.334 -18.440  -5.684
  308   2HH1  ARG  40          2HH1      ARG  40  -1.451 -19.721  -4.909
  309   1HH2  ARG  40          1HH2      ARG  40   0.662 -20.293  -7.662
  310   2HH2  ARG  40          2HH2      ARG  40   0.243 -20.801  -6.050
  311    H    TRP  41           H        TRP  41  -3.524 -12.979 -11.313
  312    HA   TRP  41           HA       TRP  41  -5.056 -11.065  -9.779
  313   1HB   TRP  41          1HB       TRP  41  -5.973 -12.212 -12.405
  314   2HB   TRP  41          2HB       TRP  41  -6.217 -10.591 -11.768
  315    HD1  TRP  41           HD1      TRP  41  -4.469 -12.208 -14.422
  316    HE1  TRP  41           HE1      TRP  41  -2.440 -10.857 -15.250
  317    HE3  TRP  41           HE3      TRP  41  -3.966  -9.012 -10.471
  318    HZ2  TRP  41           HZ2      TRP  41  -0.844  -8.731 -14.341
  319    HZ3  TRP  41           HZ3      TRP  41  -2.158  -7.351 -10.533
  320    HH2  TRP  41           HH2      TRP  41  -0.631  -7.212 -12.427
  321    H    LEU  42           H        LEU  42  -5.804 -12.378  -8.065
  322    HA   LEU  42           HA       LEU  42  -6.335 -15.136  -8.440
  323   1HB   LEU  42          1HB       LEU  42  -7.707 -13.745  -6.213
  324   2HB   LEU  42          2HB       LEU  42  -6.877 -15.284  -6.229
  325    HG   LEU  42           HG       LEU  42  -5.483 -12.623  -6.301
  326   1HD1  LEU  42          1HD1      LEU  42  -6.788 -12.890  -4.281
  327   2HD1  LEU  42          2HD1      LEU  42  -5.067 -13.055  -3.933
  328   3HD1  LEU  42          3HD1      LEU  42  -6.090 -14.489  -4.024
  329   1HD2  LEU  42          1HD2      LEU  42  -3.529 -13.929  -5.657
  330   2HD2  LEU  42          2HD2      LEU  42  -4.171 -14.494  -7.199
  331   3HD2  LEU  42          3HD2      LEU  42  -4.482 -15.412  -5.725
  332    H    VAL  43           H        VAL  43  -8.700 -12.682  -7.445
  333    HA   VAL  43           HA       VAL  43 -10.885 -14.373  -7.802
  334    HB   VAL  43           HB       VAL  43 -12.150 -12.087  -7.855
  335   1HG1  VAL  43          1HG1      VAL  43 -12.073 -13.652  -5.988
  336   2HG1  VAL  43          2HG1      VAL  43 -11.961 -11.983  -5.425
  337   3HG1  VAL  43          3HG1      VAL  43 -10.514 -12.989  -5.502
  338   1HG2  VAL  43          1HG2      VAL  43  -9.429 -11.249  -6.869
  339   2HG2  VAL  43          2HG2      VAL  43 -10.901 -10.282  -6.774
  340   3HG2  VAL  43          3HG2      VAL  43 -10.206 -10.678  -8.346
  341    H    ASN  44           H        ASN  44  -9.270 -12.173  -9.997
  342    HA   ASN  44           HA       ASN  44 -11.069 -12.400 -12.130
  343   1HB   ASN  44          1HB       ASN  44  -8.088 -11.972 -12.072
  344   2HB   ASN  44          2HB       ASN  44  -8.972 -12.085 -13.587
  345   1HD2  ASN  44          1HD2      ASN  44 -10.274 -10.604 -10.690
  346   2HD2  ASN  44          2HD2      ASN  44 -10.237  -8.980 -11.280
  347    H    GLY  45           H        GLY  45  -8.029 -14.207 -11.654
  348   1HA   GLY  45          1HA       GLY  45  -8.282 -16.684 -11.589
  349   2HA   GLY  45          2HA       GLY  45  -9.291 -16.508 -13.014
  350    H    HIS  46           H        HIS  46  -6.149 -14.958 -12.268
  351    HA   HIS  46           HA       HIS  46  -4.903 -16.592 -14.361
  352   1HB   HIS  46          1HB       HIS  46  -5.734 -14.414 -15.348
  353   2HB   HIS  46          2HB       HIS  46  -4.579 -13.587 -14.312
  354    HD1  HIS  46           HD1      HIS  46  -2.117 -13.631 -15.027
  355    HD2  HIS  46           HD2      HIS  46  -4.603 -15.842 -17.511
  356    HE1  HIS  46           HE1      HIS  46  -0.724 -14.199 -17.037
  357    HE2  HIS  46           HE2      HIS  46  -2.330 -15.304 -18.625
  358    H    GLU  47           H        GLU  47  -2.476 -16.397 -14.352
  359    HA   GLU  47           HA       GLU  47  -1.350 -15.470 -11.794
  360   1HB   GLU  47          1HB       GLU  47  -1.764 -17.854 -11.511
  361   2HB   GLU  47          2HB       GLU  47  -0.933 -18.205 -13.021
  362   1HG   GLU  47          1HG       GLU  47   1.154 -17.353 -12.048
  363   2HG   GLU  47          2HG       GLU  47   0.306 -17.064 -10.529
  364    H    THR  48           H        THR  48   0.475 -14.347 -12.070
  365    HA   THR  48           HA       THR  48   1.806 -14.404 -14.668
  366    HB   THR  48           HB       THR  48  -0.067 -12.862 -14.838
  367    HG1  THR  48           HG1      THR  48   1.199 -11.829 -16.162
  368   1HG2  THR  48          1HG2      THR  48   1.349 -11.313 -12.688
  369   2HG2  THR  48          2HG2      THR  48  -0.212 -12.118 -12.538
  370   3HG2  THR  48          3HG2      THR  48  -0.034 -10.735 -13.617
  371    H    THR  49           H        THR  49   3.421 -12.498 -14.719
  372    HA   THR  49           HA       THR  49   4.760 -11.992 -12.160
  373    HB   THR  49           HB       THR  49   6.185 -12.905 -14.687
  374    HG1  THR  49           HG1      THR  49   5.117 -14.322 -12.731
  375   1HG2  THR  49          1HG2      THR  49   8.240 -12.792 -13.322
  376   2HG2  THR  49          2HG2      THR  49   7.307 -12.115 -11.987
  377   3HG2  THR  49          3HG2      THR  49   7.481 -11.209 -13.489
  378    H    VAL  50           H        VAL  50   4.867  -9.786 -12.017
  379    HA   VAL  50           HA       VAL  50   4.627  -8.239 -14.512
  380    HB   VAL  50           HB       VAL  50   2.686  -6.977 -13.480
  381   1HG1  VAL  50          1HG1      VAL  50   1.038  -8.591 -14.313
  382   2HG1  VAL  50          2HG1      VAL  50   2.282  -9.842 -14.327
  383   3HG1  VAL  50          3HG1      VAL  50   2.424  -8.445 -15.394
  384   1HG2  VAL  50          1HG2      VAL  50   2.865  -7.832 -11.210
  385   2HG2  VAL  50          2HG2      VAL  50   2.547  -9.470 -11.783
  386   3HG2  VAL  50          3HG2      VAL  50   1.292  -8.237 -11.896
  387    H    TYR  51           H        TYR  51   4.131  -5.837 -13.830
  388    HA   TYR  51           HA       TYR  51   5.843  -4.999 -11.598
  389   1HB   TYR  51          1HB       TYR  51   6.031  -3.573 -14.237
  390   2HB   TYR  51          2HB       TYR  51   7.187  -3.605 -12.913
  391    HD1  TYR  51           HD1      TYR  51   6.047  -5.247 -15.951
  392    HD2  TYR  51           HD2      TYR  51   8.729  -5.513 -12.663
  393    HE1  TYR  51           HE1      TYR  51   7.331  -6.965 -17.148
  394    HE2  TYR  51           HE2      TYR  51  10.022  -7.235 -13.852
  395    HH   TYR  51           HH       TYR  51   9.584  -7.901 -17.168
  396    HA   PRO  52           HA       PRO  52   2.205  -2.399 -11.231
  397   1HB   PRO  52          1HB       PRO  52   2.957  -1.068  -8.997
  398   2HB   PRO  52          2HB       PRO  52   2.369  -2.733  -8.975
  399   1HG   PRO  52          1HG       PRO  52   5.165  -1.707  -8.812
  400   2HG   PRO  52          2HG       PRO  52   4.416  -3.064  -7.955
  401   1HD   PRO  52          1HD       PRO  52   6.040  -3.341 -10.150
  402   2HD   PRO  52          2HD       PRO  52   4.799  -4.517  -9.676
  403    H    GLY  53           H        GLY  53   4.835  -0.393  -9.946
  404   1HA   GLY  53          1HA       GLY  53   5.742   1.267 -11.715
  405   2HA   GLY  53          2HA       GLY  53   4.042   1.698 -11.850
  406    H    SER  54           H        SER  54   4.558   3.838 -11.190
  407    HA   SER  54           HA       SER  54   5.570   4.230  -8.490
  408   1HB   SER  54          1HB       SER  54   4.653   6.208 -10.590
  409   2HB   SER  54          2HB       SER  54   5.366   6.645  -9.037
  410    HG   SER  54           HG       SER  54   6.567   5.327 -11.232
  411    H    ASP  55           H        ASP  55   4.378   5.616  -6.966
  412    HA   ASP  55           HA       ASP  55   2.597   5.963  -5.600
  413   1HB   ASP  55          1HB       ASP  55   1.671   6.982  -7.848
  414   2HB   ASP  55          2HB       ASP  55   0.642   5.553  -7.844
  415    H    ALA  56           H        ALA  56   3.710   3.479  -5.847
  416    HA   ALA  56           HA       ALA  56   1.669   1.469  -6.049
  417   1HB   ALA  56          1HB       ALA  56   4.521   1.214  -5.096
  418   2HB   ALA  56          2HB       ALA  56   3.966   0.991  -6.755
  419   3HB   ALA  56          3HB       ALA  56   3.427  -0.113  -5.489
  420    H    VAL  57           H        VAL  57   0.680   0.396  -4.416
  421    HA   VAL  57           HA       VAL  57   1.129   1.256  -1.636
  422    HB   VAL  57           HB       VAL  57  -1.659   1.115  -2.774
  423   1HG1  VAL  57          1HG1      VAL  57  -1.421   1.028  -0.345
  424   2HG1  VAL  57          2HG1      VAL  57  -2.231   2.509  -0.856
  425   3HG1  VAL  57          3HG1      VAL  57  -0.535   2.553  -0.373
  426   1HG2  VAL  57          1HG2      VAL  57   0.050   3.596  -2.647
  427   2HG2  VAL  57          2HG2      VAL  57  -1.682   3.565  -2.981
  428   3HG2  VAL  57          3HG2      VAL  57  -0.551   2.811  -4.107
  429    H    VAL  58           H        VAL  58  -0.514  -0.077  -0.258
  430    HA   VAL  58           HA       VAL  58  -0.624  -2.841  -1.245
  431    HB   VAL  58           HB       VAL  58   0.615  -2.049   1.403
  432   1HG1  VAL  58          1HG1      VAL  58  -0.588  -4.147   1.569
  433   2HG1  VAL  58          2HG1      VAL  58   1.150  -4.442   1.611
  434   3HG1  VAL  58          3HG1      VAL  58   0.236  -4.761   0.137
  435   1HG2  VAL  58          1HG2      VAL  58   2.116  -1.568  -0.453
  436   2HG2  VAL  58          2HG2      VAL  58   1.899  -3.205  -1.070
  437   3HG2  VAL  58          3HG2      VAL  58   2.703  -2.946   0.478
  438    H    VAL  59           H        VAL  59  -2.247  -4.008  -0.499
  439    HA   VAL  59           HA       VAL  59  -4.128  -2.986   1.446
  440    HB   VAL  59           HB       VAL  59  -5.806  -3.853  -0.222
  441   1HG1  VAL  59          1HG1      VAL  59  -5.578  -1.485   0.237
  442   2HG1  VAL  59          2HG1      VAL  59  -5.925  -1.765  -1.470
  443   3HG1  VAL  59          3HG1      VAL  59  -4.279  -1.389  -0.954
  444   1HG2  VAL  59          1HG2      VAL  59  -5.185  -3.754  -2.582
  445   2HG2  VAL  59          2HG2      VAL  59  -4.349  -5.034  -1.702
  446   3HG2  VAL  59          3HG2      VAL  59  -3.505  -3.535  -2.091
  447    H    THR  60           H        THR  60  -5.910  -4.763   1.476
  448    HA   THR  60           HA       THR  60  -4.551  -7.369   1.942
  449    HB   THR  60           HB       THR  60  -5.201  -5.891   3.928
  450    HG1  THR  60           HG1      THR  60  -5.189  -7.749   4.926
  451   1HG2  THR  60          1HG2      THR  60  -7.987  -6.673   3.145
  452   2HG2  THR  60          2HG2      THR  60  -7.316  -5.042   3.161
  453   3HG2  THR  60          3HG2      THR  60  -7.525  -5.923   4.674
  454    H    ALA  61           H        ALA  61  -6.924  -8.647   2.802
  455    HA   ALA  61           HA       ALA  61  -7.960  -9.720   0.455
  456   1HB   ALA  61          1HB       ALA  61  -7.960 -10.870   2.607
  457   2HB   ALA  61          2HB       ALA  61  -9.565 -10.864   1.873
  458   3HB   ALA  61          3HB       ALA  61  -9.196  -9.760   3.199
  459    H    THR  62           H        THR  62  -9.516  -7.314   2.628
  460    HA   THR  62           HA       THR  62 -11.959  -7.195   1.239
  461    HB   THR  62           HB       THR  62 -11.715  -4.648   2.096
  462    HG1  THR  62           HG1      THR  62 -10.539  -4.674   4.033
  463   1HG2  THR  62          1HG2      THR  62 -12.476  -7.055   3.737
  464   2HG2  THR  62          2HG2      THR  62 -13.520  -6.178   2.617
  465   3HG2  THR  62          3HG2      THR  62 -12.937  -5.388   4.083
  466    H    GLU  63           H        GLU  63  -9.177  -4.956   0.960
  467    HA   GLU  63           HA       GLU  63 -10.317  -3.441  -1.128
  468   1HB   GLU  63          1HB       GLU  63  -7.526  -3.940  -0.189
  469   2HB   GLU  63          2HB       GLU  63  -7.779  -3.086  -1.703
  470   1HG   GLU  63          1HG       GLU  63  -9.072  -2.238   0.867
  471   2HG   GLU  63          2HG       GLU  63  -7.482  -1.664   0.355
  472    H    HIS  64           H        HIS  64  -8.800  -6.494  -1.081
  473    HA   HIS  64           HA       HIS  64  -7.851  -6.748  -3.658
  474   1HB   HIS  64          1HB       HIS  64  -7.111  -8.573  -2.663
  475   2HB   HIS  64          2HB       HIS  64  -8.273  -8.388  -1.364
  476    HD1  HIS  64           HD1      HIS  64 -10.150 -10.035  -1.236
  477    HD2  HIS  64           HD2      HIS  64  -8.064 -10.314  -4.815
  478    HE1  HIS  64           HE1      HIS  64 -10.953 -12.152  -2.322
  479    HE2  HIS  64           HE2      HIS  64  -9.476 -12.427  -4.334
  480    H    ALA  65           H        ALA  65 -11.172  -7.293  -2.507
  481    HA   ALA  65           HA       ALA  65 -11.996  -8.986  -4.572
  482   1HB   ALA  65          1HB       ALA  65 -14.268  -8.400  -3.866
  483   2HB   ALA  65          2HB       ALA  65 -13.628  -7.042  -2.939
  484   3HB   ALA  65          3HB       ALA  65 -13.219  -8.693  -2.478
  485    H    GLU  66           H        GLU  66 -13.148  -5.724  -4.160
  486    HA   GLU  66           HA       GLU  66 -14.142  -5.365  -6.737
  487   1HB   GLU  66          1HB       GLU  66 -13.890  -2.852  -5.986
  488   2HB   GLU  66          2HB       GLU  66 -15.048  -3.922  -5.208
  489   1HG   GLU  66          1HG       GLU  66 -13.792  -4.096  -3.258
  490   2HG   GLU  66          2HG       GLU  66 -12.291  -3.621  -4.059
  491    H    ALA  67           H        ALA  67 -11.145  -4.149  -5.299
  492    HA   ALA  67           HA       ALA  67 -10.185  -2.761  -7.499
  493   1HB   ALA  67          1HB       ALA  67  -8.557  -4.132  -5.367
  494   2HB   ALA  67          2HB       ALA  67  -9.255  -2.516  -5.250
  495   3HB   ALA  67          3HB       ALA  67  -8.004  -2.852  -6.447
  496    H    GLU  68           H        GLU  68  -9.560  -6.155  -6.542
  497    HA   GLU  68           HA       GLU  68  -7.687  -6.662  -8.553
  498   1HB   GLU  68          1HB       GLU  68  -8.574  -8.118  -6.516
  499   2HB   GLU  68          2HB       GLU  68  -9.517  -8.862  -7.798
  500   1HG   GLU  68          1HG       GLU  68  -7.669  -9.719  -8.850
  501   2HG   GLU  68          2HG       GLU  68  -6.588  -8.496  -8.175
  502    H    LYS  69           H        LYS  69 -11.246  -6.860  -8.666
  503    HA   LYS  69           HA       LYS  69 -11.370  -7.887 -11.266
  504   1HB   LYS  69          1HB       LYS  69 -13.185  -5.870  -9.943
  505   2HB   LYS  69          2HB       LYS  69 -13.537  -6.657 -11.478
  506   1HG   LYS  69          1HG       LYS  69 -13.319  -8.857 -10.270
  507   2HG   LYS  69          2HG       LYS  69 -13.274  -7.931  -8.768
  508   1HD   LYS  69          1HD       LYS  69 -15.465  -6.997  -9.263
  509   2HD   LYS  69          2HD       LYS  69 -15.506  -7.872 -10.796
  510   1HE   LYS  69          1HE       LYS  69 -15.327  -9.998  -9.523
  511   2HE   LYS  69          2HE       LYS  69 -15.440  -9.069  -8.028
  512   1HZ   LYS  69          1HZ       LYS  69 -17.625  -8.297  -8.723
  513   2HZ   LYS  69          2HZ       LYS  69 -17.573  -9.990  -8.660
  514   3HZ   LYS  69          3HZ       LYS  69 -17.509  -9.196 -10.156
  515    H    ARG  70           H        ARG  70 -11.755  -4.393 -10.524
  516    HA   ARG  70           HA       ARG  70 -11.486  -3.613 -13.249
  517   1HB   ARG  70          1HB       ARG  70 -10.875  -1.957 -10.792
  518   2HB   ARG  70          2HB       ARG  70 -11.152  -1.328 -12.407
  519   1HG   ARG  70          1HG       ARG  70 -13.292  -1.131 -11.899
  520   2HG   ARG  70          2HG       ARG  70 -13.397  -2.891 -11.809
  521   1HD   ARG  70          1HD       ARG  70 -14.226  -1.823  -9.759
  522   2HD   ARG  70          2HD       ARG  70 -12.811  -2.830  -9.451
  523    HE   ARG  70           HE       ARG  70 -11.921  -0.219  -9.890
  524   1HH1  ARG  70          1HH1      ARG  70 -13.841  -1.965  -7.548
  525   2HH1  ARG  70          2HH1      ARG  70 -13.398  -0.946  -6.209
  526   1HH2  ARG  70          1HH2      ARG  70 -11.324   1.135  -8.152
  527   2HH2  ARG  70          2HH2      ARG  70 -11.979   0.837  -6.559
  528    H    ALA  71           H        ALA  71  -9.227  -3.240 -10.640
  529    HA   ALA  71           HA       ALA  71  -7.092  -2.132 -11.990
  530   1HB   ALA  71          1HB       ALA  71  -7.107  -3.773  -9.478
  531   2HB   ALA  71          2HB       ALA  71  -7.452  -2.048  -9.593
  532   3HB   ALA  71          3HB       ALA  71  -5.843  -2.654  -9.987
  533    H    ALA  72           H        ALA  72  -7.519  -5.612 -11.077
  534    HA   ALA  72           HA       ALA  72  -5.026  -6.430 -12.061
  535   1HB   ALA  72          1HB       ALA  72  -7.528  -8.095 -11.983
  536   2HB   ALA  72          2HB       ALA  72  -6.388  -7.886 -10.654
  537   3HB   ALA  72          3HB       ALA  72  -5.874  -8.691 -12.138
  538    H    ALA  73           H        ALA  73  -8.156  -6.048 -13.722
  539    HA   ALA  73           HA       ALA  73  -7.365  -7.085 -16.199
  540   1HB   ALA  73          1HB       ALA  73  -9.042  -5.614 -17.194
  541   2HB   ALA  73          2HB       ALA  73  -9.120  -4.681 -15.699
  542   3HB   ALA  73          3HB       ALA  73  -9.654  -6.363 -15.719
  543    H    ARG  74           H        ARG  74  -7.002  -3.795 -14.937
  544    HA   ARG  74           HA       ARG  74  -5.581  -2.661 -17.064
  545   1HB   ARG  74          1HB       ARG  74  -6.482  -1.276 -15.310
  546   2HB   ARG  74          2HB       ARG  74  -5.451  -2.053 -14.114
  547   1HG   ARG  74          1HG       ARG  74  -4.296  -0.115 -14.489
  548   2HG   ARG  74          2HG       ARG  74  -3.518  -1.190 -15.651
  549   1HD   ARG  74          1HD       ARG  74  -3.912   0.623 -16.983
  550   2HD   ARG  74          2HD       ARG  74  -5.408  -0.275 -17.243
  551    HE   ARG  74           HE       ARG  74  -5.846   1.382 -15.055
  552   1HH1  ARG  74          1HH1      ARG  74  -5.165   1.697 -18.473
  553   2HH1  ARG  74          2HH1      ARG  74  -5.839   3.295 -18.595
  554   1HH2  ARG  74          1HH2      ARG  74  -6.763   3.455 -15.198
  555   2HH2  ARG  74          2HH2      ARG  74  -6.767   4.296 -16.716
  556    H    ALA  75           H        ALA  75  -4.218  -3.885 -14.013
  557    HA   ALA  75           HA       ALA  75  -1.596  -3.135 -14.421
  558   1HB   ALA  75          1HB       ALA  75  -0.999  -4.659 -12.643
  559   2HB   ALA  75          2HB       ALA  75  -2.521  -5.526 -12.838
  560   3HB   ALA  75          3HB       ALA  75  -2.526  -3.858 -12.271
  561    H    GLY  76           H        GLY  76  -3.159  -6.106 -15.560
  562   1HA   GLY  76          1HA       GLY  76  -0.458  -6.973 -16.446
  563   2HA   GLY  76          2HA       GLY  76  -1.718  -8.097 -15.992
  564    H    HIS  77           H        HIS  77  -2.804  -5.421 -17.816
  565    HA   HIS  77           HA       HIS  77  -2.992  -7.140 -20.185
  566   1HB   HIS  77          1HB       HIS  77  -5.082  -6.108 -19.309
  567   2HB   HIS  77          2HB       HIS  77  -4.402  -4.518 -19.643
  568    HD1  HIS  77           HD1      HIS  77  -4.930  -3.574 -21.881
  569    HD2  HIS  77           HD2      HIS  77  -5.347  -7.715 -21.778
  570    HE1  HIS  77           HE1      HIS  77  -5.851  -4.225 -24.131
  571    HE2  HIS  77           HE2      HIS  77  -5.974  -6.743 -24.091
  572    H    ALA  78           H        ALA  78  -2.020  -3.861 -19.225
  573    HA   ALA  78           HA       ALA  78  -0.783  -3.502 -21.856
  574   1HB   ALA  78          1HB       ALA  78  -2.284  -1.724 -21.078
  575   2HB   ALA  78          2HB       ALA  78  -0.635  -1.141 -21.300
  576   3HB   ALA  78          3HB       ALA  78  -1.245  -1.466 -19.678
  577    H    ALA  79           H        ALA  79   0.992  -4.893 -21.484
  578    HA   ALA  79           HA       ALA  79   2.907  -4.062 -19.444
  579   1HB   ALA  79          1HB       ALA  79   2.435  -6.459 -19.671
  580   2HB   ALA  79          2HB       ALA  79   4.128  -6.089 -19.996
  581   3HB   ALA  79          3HB       ALA  79   3.023  -6.412 -21.334
  582    H    THR  80           H        THR  80   3.264  -2.023 -20.557
  583    HA   THR  80           HA       THR  80   5.565  -2.214 -22.286
  584    HB   THR  80           HB       THR  80   3.132  -0.670 -23.234
  585    HG1  THR  80           HG1      THR  80   3.909  -3.252 -23.612
  586   1HG2  THR  80          1HG2      THR  80   5.828  -1.117 -24.532
  587   2HG2  THR  80          2HG2      THR  80   5.255   0.399 -23.838
  588   3HG2  THR  80          3HG2      THR  80   4.461  -0.275 -25.260
  Start of MODEL   24
    1    H    MET   1           H        MET   1   8.644   1.385   1.058
    2    HA   MET   1           HA       MET   1   6.723   1.208   2.489
    3   1HB   MET   1          1HB       MET   1   4.780  -0.121   1.696
    4   2HB   MET   1          2HB       MET   1   4.965   1.402   0.846
    5   1HG   MET   1          1HG       MET   1   4.419  -0.100  -0.826
    6   2HG   MET   1          2HG       MET   1   6.169   0.037  -0.955
    7   1HE   MET   1          1HE       MET   1   5.926  -2.171  -2.516
    8   2HE   MET   1          2HE       MET   1   4.205  -2.313  -2.158
    9   3HE   MET   1          3HE       MET   1   5.270  -3.700  -1.929
   10    H    HIS   2           H        HIS   2   5.744  -1.237   3.041
   11    HA   HIS   2           HA       HIS   2   7.822  -3.179   2.362
   12   1HB   HIS   2          1HB       HIS   2   8.017  -3.945   4.699
   13   2HB   HIS   2          2HB       HIS   2   8.560  -2.288   4.500
   14    HD1  HIS   2           HD1      HIS   2   6.899  -0.405   5.459
   15    HD2  HIS   2           HD2      HIS   2   6.049  -4.330   6.552
   16    HE1  HIS   2           HE1      HIS   2   5.342  -0.244   7.429
   17    HE2  HIS   2           HE2      HIS   2   4.667  -2.626   7.913
   18    H    ALA   3           H        ALA   3   6.694  -4.620   1.275
   19    HA   ALA   3           HA       ALA   3   4.017  -5.360   2.216
   20   1HB   ALA   3          1HB       ALA   3   4.210  -4.621  -0.114
   21   2HB   ALA   3          2HB       ALA   3   3.665  -6.294   0.002
   22   3HB   ALA   3          3HB       ALA   3   5.337  -5.940  -0.432
   23    H    LYS   4           H        LYS   4   3.408  -7.668   1.936
   24    HA   LYS   4           HA       LYS   4   5.645  -9.531   2.286
   25   1HB   LYS   4          1HB       LYS   4   3.147  -9.447   3.993
   26   2HB   LYS   4          2HB       LYS   4   4.349 -10.728   4.031
   27   1HG   LYS   4          1HG       LYS   4   6.036  -9.034   4.717
   28   2HG   LYS   4          2HG       LYS   4   4.727  -7.855   4.831
   29   1HD   LYS   4          1HD       LYS   4   5.193  -8.777   7.021
   30   2HD   LYS   4          2HD       LYS   4   3.600  -9.310   6.477
   31   1HE   LYS   4          1HE       LYS   4   4.526 -11.460   5.813
   32   2HE   LYS   4          2HE       LYS   4   6.141 -10.929   6.283
   33   1HZ   LYS   4          1HZ       LYS   4   5.196 -12.278   8.010
   34   2HZ   LYS   4          2HZ       LYS   4   3.810 -11.310   8.086
   35   3HZ   LYS   4          3HZ       LYS   4   5.313 -10.681   8.567
   36    H    VAL   5           H        VAL   5   4.724 -11.854   2.188
   37    HA   VAL   5           HA       VAL   5   3.188 -12.038  -0.255
   38    HB   VAL   5           HB       VAL   5   5.076 -13.563   0.081
   39   1HG1  VAL   5          1HG1      VAL   5   4.978 -15.361   1.742
   40   2HG1  VAL   5          2HG1      VAL   5   3.489 -14.675   2.392
   41   3HG1  VAL   5          3HG1      VAL   5   4.999 -13.770   2.505
   42   1HG2  VAL   5          1HG2      VAL   5   3.962 -15.676  -0.456
   43   2HG2  VAL   5          2HG2      VAL   5   3.250 -14.316  -1.325
   44   3HG2  VAL   5          3HG2      VAL   5   2.425 -14.995   0.079
   45    H    GLY   6           H        GLY   6   1.194 -12.932  -0.529
   46   1HA   GLY   6          1HA       GLY   6  -0.863 -13.837   0.141
   47   2HA   GLY   6          2HA       GLY   6  -0.339 -13.741   1.819
   48    H    ASP   7           H        ASP   7   0.402 -10.944   0.169
   49    HA   ASP   7           HA       ASP   7  -2.014  -9.602   1.288
   50   1HB   ASP   7          1HB       ASP   7   0.784  -8.553   0.777
   51   2HB   ASP   7          2HB       ASP   7  -0.585  -7.504   1.122
   52    H    TYR   8           H        TYR   8  -2.430  -7.471   0.044
   53    HA   TYR   8           HA       TYR   8  -2.569  -8.174  -2.801
   54   1HB   TYR   8          1HB       TYR   8  -4.427  -6.970  -0.925
   55   2HB   TYR   8          2HB       TYR   8  -4.222  -5.976  -2.361
   56    HD1  TYR   8           HD1      TYR   8  -4.511  -9.649  -1.693
   57    HD2  TYR   8           HD2      TYR   8  -5.881  -6.287  -3.905
   58    HE1  TYR   8           HE1      TYR   8  -6.093 -11.091  -2.897
   59    HE2  TYR   8           HE2      TYR   8  -7.467  -7.720  -5.113
   60    HH   TYR   8           HH       TYR   8  -7.611 -10.226  -5.706
   61    H    LEU   9           H        LEU   9  -1.789  -6.886  -4.316
   62    HA   LEU   9           HA       LEU   9  -0.135  -4.630  -3.477
   63   1HB   LEU   9          1HB       LEU   9   0.955  -6.419  -4.749
   64   2HB   LEU   9          2HB       LEU   9  -0.204  -6.227  -6.045
   65    HG   LEU   9           HG       LEU   9   1.538  -3.908  -5.289
   66   1HD1  LEU   9          1HD1      LEU   9   2.344  -6.201  -7.080
   67   2HD1  LEU   9          2HD1      LEU   9   3.064  -5.805  -5.519
   68   3HD1  LEU   9          3HD1      LEU   9   3.227  -4.690  -6.875
   69   1HD2  LEU   9          1HD2      LEU   9   1.304  -3.402  -7.675
   70   2HD2  LEU   9          2HD2      LEU   9  -0.272  -3.565  -6.901
   71   3HD2  LEU   9          3HD2      LEU   9   0.360  -4.875  -7.899
   72    H    VAL  10           H        VAL  10  -0.521  -2.650  -4.078
   73    HA   VAL  10           HA       VAL  10  -2.447  -2.043  -6.211
   74    HB   VAL  10           HB       VAL  10  -2.298  -0.786  -3.451
   75   1HG1  VAL  10          1HG1      VAL  10  -2.467   1.006  -5.101
   76   2HG1  VAL  10          2HG1      VAL  10  -3.968   0.832  -4.193
   77   3HG1  VAL  10          3HG1      VAL  10  -3.856   0.203  -5.836
   78   1HG2  VAL  10          1HG2      VAL  10  -3.696  -2.766  -3.603
   79   2HG2  VAL  10          2HG2      VAL  10  -4.559  -2.067  -4.974
   80   3HG2  VAL  10          3HG2      VAL  10  -4.690  -1.325  -3.379
   81    H    VAL  11           H        VAL  11  -1.966   0.100  -7.205
   82    HA   VAL  11           HA       VAL  11   0.683   1.181  -6.497
   83    HB   VAL  11           HB       VAL  11  -0.378   0.583  -9.260
   84   1HG1  VAL  11          1HG1      VAL  11   2.021   2.271  -8.548
   85   2HG1  VAL  11          2HG1      VAL  11   0.527   2.855  -9.281
   86   3HG1  VAL  11          3HG1      VAL  11   1.572   1.745 -10.171
   87   1HG2  VAL  11          1HG2      VAL  11   1.749  -0.600  -9.496
   88   2HG2  VAL  11          2HG2      VAL  11   0.797  -1.227  -8.150
   89   3HG2  VAL  11          3HG2      VAL  11   2.171  -0.164  -7.840
   90    H    LYS  12           H        LYS  12   0.708   3.345  -6.183
   91    HA   LYS  12           HA       LYS  12  -1.735   4.831  -6.607
   92   1HB   LYS  12          1HB       LYS  12   0.047   5.066  -4.673
   93   2HB   LYS  12          2HB       LYS  12   0.839   6.144  -5.811
   94   1HG   LYS  12          1HG       LYS  12  -2.021   6.470  -4.924
   95   2HG   LYS  12          2HG       LYS  12  -0.655   7.253  -4.135
   96   1HD   LYS  12          1HD       LYS  12  -1.093   7.587  -7.080
   97   2HD   LYS  12          2HD       LYS  12  -2.024   8.544  -5.930
   98   1HE   LYS  12          1HE       LYS  12  -0.062   9.771  -6.679
   99   2HE   LYS  12          2HE       LYS  12   0.055   9.403  -4.961
  100   1HZ   LYS  12          1HZ       LYS  12   2.137   9.056  -6.242
  101   2HZ   LYS  12          2HZ       LYS  12   1.373   7.795  -7.079
  102   3HZ   LYS  12          3HZ       LYS  12   1.607   7.684  -5.402
  103    H    GLY  13           H        GLY  13  -1.513   4.229  -8.938
  104   1HA   GLY  13          1HA       GLY  13  -0.186   6.454 -10.354
  105   2HA   GLY  13          2HA       GLY  13  -0.268   4.827 -11.029
  106    H    THR  14           H        THR  14  -1.983   7.740 -10.355
  107    HA   THR  14           HA       THR  14  -4.616   6.903 -10.501
  108    HB   THR  14           HB       THR  14  -3.614   9.574 -11.480
  109    HG1  THR  14           HG1      THR  14  -3.232  10.108  -9.435
  110   1HG2  THR  14          1HG2      THR  14  -6.003   9.145 -11.822
  111   2HG2  THR  14          2HG2      THR  14  -5.750  10.383 -10.589
  112   3HG2  THR  14          3HG2      THR  14  -6.177   8.738 -10.114
  113    H    THR  15           H        THR  15  -5.177   5.536 -12.100
  114    HA   THR  15           HA       THR  15  -5.210   6.665 -14.820
  115    HB   THR  15           HB       THR  15  -5.034   3.705 -14.233
  116    HG1  THR  15           HG1      THR  15  -3.116   4.837 -13.538
  117   1HG2  THR  15          1HG2      THR  15  -4.563   5.327 -16.740
  118   2HG2  THR  15          2HG2      THR  15  -5.968   4.313 -16.412
  119   3HG2  THR  15          3HG2      THR  15  -4.375   3.580 -16.599
  120    H    THR  16           H        THR  16  -6.649   3.705 -13.442
  121    HA   THR  16           HA       THR  16  -9.296   4.563 -14.288
  122    HB   THR  16           HB       THR  16  -8.795   2.143 -12.583
  123    HG1  THR  16           HG1      THR  16  -7.234   1.757 -14.044
  124   1HG2  THR  16          1HG2      THR  16 -11.087   2.687 -13.247
  125   2HG2  THR  16          2HG2      THR  16 -10.554   1.183 -13.996
  126   3HG2  THR  16          3HG2      THR  16 -10.607   2.669 -14.944
  127    H    GLU  17           H        GLU  17  -7.307   4.437 -11.520
  128    HA   GLU  17           HA       GLU  17  -9.188   5.882  -9.874
  129   1HB   GLU  17          1HB       GLU  17  -9.821   3.545  -9.443
  130   2HB   GLU  17          2HB       GLU  17  -8.147   3.128  -9.126
  131   1HG   GLU  17          1HG       GLU  17  -9.547   3.318  -7.101
  132   2HG   GLU  17          2HG       GLU  17  -8.145   4.385  -7.101
  133    H    ARG  18           H        ARG  18  -8.013   6.625  -7.831
  134    HA   ARG  18           HA       ARG  18  -5.400   7.543  -8.387
  135   1HB   ARG  18          1HB       ARG  18  -6.710   7.184  -5.680
  136   2HB   ARG  18          2HB       ARG  18  -5.280   8.149  -6.004
  137   1HG   ARG  18          1HG       ARG  18  -6.650   9.605  -7.466
  138   2HG   ARG  18          2HG       ARG  18  -8.076   8.677  -6.989
  139   1HD   ARG  18          1HD       ARG  18  -7.571   9.232  -4.621
  140   2HD   ARG  18          2HD       ARG  18  -6.258  10.265  -5.181
  141    HE   ARG  18           HE       ARG  18  -8.942  10.812  -6.198
  142   1HH1  ARG  18          1HH1      ARG  18  -6.296  11.693  -4.084
  143   2HH1  ARG  18          2HH1      ARG  18  -6.943  13.258  -3.708
  144   1HH2  ARG  18          1HH2      ARG  18  -9.783  12.878  -5.736
  145   2HH2  ARG  18          2HH2      ARG  18  -8.925  13.946  -4.665
  146    H    HIS  19           H        HIS  19  -6.635   4.617  -7.133
  147    HA   HIS  19           HA       HIS  19  -3.907   3.603  -6.741
  148   1HB   HIS  19          1HB       HIS  19  -6.411   2.930  -5.177
  149   2HB   HIS  19          2HB       HIS  19  -4.908   2.021  -5.060
  150    HD1  HIS  19           HD1      HIS  19  -6.583   5.107  -3.890
  151    HD2  HIS  19           HD2      HIS  19  -2.774   3.430  -3.796
  152    HE1  HIS  19           HE1      HIS  19  -5.304   6.412  -2.156
  153    HE2  HIS  19           HE2      HIS  19  -2.962   5.471  -2.216
  154    H    ASP  20           H        ASP  20  -3.620   2.592  -8.648
  155    HA   ASP  20           HA       ASP  20  -5.750   0.824  -9.657
  156   1HB   ASP  20          1HB       ASP  20  -4.558   2.816 -11.004
  157   2HB   ASP  20          2HB       ASP  20  -3.371   1.557 -11.313
  158    H    GLN  21           H        GLN  21  -4.131  -0.772 -11.331
  159    HA   GLN  21           HA       GLN  21  -3.083  -2.806 -11.225
  160   1HB   GLN  21          1HB       GLN  21  -1.177  -0.964  -9.829
  161   2HB   GLN  21          2HB       GLN  21  -0.807  -2.676  -9.955
  162   1HG   GLN  21          1HG       GLN  21   0.294  -1.577 -11.732
  163   2HG   GLN  21          2HG       GLN  21  -1.057  -2.468 -12.428
  164   1HE2  GLN  21          1HE2      GLN  21   0.244   0.655 -11.693
  165   2HE2  GLN  21          2HE2      GLN  21  -0.871   1.570 -12.648
  166    H    HIS  22           H        HIS  22  -4.417  -4.182 -10.068
  167    HA   HIS  22           HA       HIS  22  -3.794  -4.414  -7.194
  168   1HB   HIS  22          1HB       HIS  22  -6.523  -4.848  -8.427
  169   2HB   HIS  22          2HB       HIS  22  -6.114  -4.966  -6.722
  170    HD1  HIS  22           HD1      HIS  22  -8.162  -2.969  -8.320
  171    HD2  HIS  22           HD2      HIS  22  -4.552  -2.039  -6.497
  172    HE1  HIS  22           HE1      HIS  22  -8.308  -0.531  -7.749
  173    HE2  HIS  22           HE2      HIS  22  -6.015   0.055  -6.920
  174    H    ALA  23           H        ALA  23  -3.479  -6.434  -6.405
  175    HA   ALA  23           HA       ALA  23  -4.663  -8.807  -7.426
  176   1HB   ALA  23          1HB       ALA  23  -3.103  -8.503  -9.294
  177   2HB   ALA  23          2HB       ALA  23  -2.739  -9.951  -8.353
  178   3HB   ALA  23          3HB       ALA  23  -1.755  -8.500  -8.154
  179    H    GLU  24           H        GLU  24  -3.394 -10.795  -6.529
  180    HA   GLU  24           HA       GLU  24  -2.460 -10.089  -3.835
  181   1HB   GLU  24          1HB       GLU  24  -4.146 -11.837  -3.865
  182   2HB   GLU  24          2HB       GLU  24  -3.206 -12.772  -5.024
  183   1HG   GLU  24          1HG       GLU  24  -1.411 -12.975  -3.320
  184   2HG   GLU  24          2HG       GLU  24  -2.466 -12.168  -2.167
  185    H    ILE  25           H        ILE  25  -0.390 -10.261  -3.249
  186    HA   ILE  25           HA       ILE  25   1.491 -11.206  -5.278
  187    HB   ILE  25           HB       ILE  25   3.212 -10.173  -3.665
  188   1HG1  ILE  25          1HG1      ILE  25   0.668  -8.887  -2.642
  189   2HG1  ILE  25          2HG1      ILE  25   1.771  -9.903  -1.720
  190   1HG2  ILE  25          1HG2      ILE  25   2.658  -9.249  -5.830
  191   2HG2  ILE  25          2HG2      ILE  25   2.861  -7.954  -4.648
  192   3HG2  ILE  25          3HG2      ILE  25   1.243  -8.446  -5.152
  193   1HD1  ILE  25          1HD1      ILE  25   2.064  -7.560  -1.174
  194   2HD1  ILE  25          2HD1      ILE  25   2.409  -7.195  -2.865
  195   3HD1  ILE  25          3HD1      ILE  25   3.512  -8.211  -1.938
  196    H    ILE  26           H        ILE  26   1.987 -13.243  -5.168
  197    HA   ILE  26           HA       ILE  26   2.304 -14.513  -2.546
  198    HB   ILE  26           HB       ILE  26   2.172 -16.675  -3.620
  199   1HG1  ILE  26          1HG1      ILE  26   3.204 -15.881  -5.831
  200   2HG1  ILE  26          2HG1      ILE  26   1.874 -17.023  -5.961
  201   1HG2  ILE  26          1HG2      ILE  26  -0.175 -16.566  -4.410
  202   2HG2  ILE  26          2HG2      ILE  26  -0.052 -14.810  -4.514
  203   3HG2  ILE  26          3HG2      ILE  26   0.078 -15.613  -2.948
  204   1HD1  ILE  26          1HD1      ILE  26   1.710 -15.287  -7.638
  205   2HD1  ILE  26          2HD1      ILE  26   1.700 -14.051  -6.380
  206   3HD1  ILE  26          3HD1      ILE  26   0.360 -15.191  -6.506
  207    H    GLU  27           H        GLU  27   4.049 -13.517  -5.383
  208    HA   GLU  27           HA       GLU  27   6.460 -14.468  -4.004
  209   1HB   GLU  27          1HB       GLU  27   6.097 -15.649  -6.174
  210   2HB   GLU  27          2HB       GLU  27   6.233 -14.096  -6.991
  211   1HG   GLU  27          1HG       GLU  27   8.495 -13.833  -6.231
  212   2HG   GLU  27          2HG       GLU  27   8.374 -15.289  -5.248
  213    H    VAL  28           H        VAL  28   7.062 -12.786  -2.937
  214    HA   VAL  28           HA       VAL  28   7.243 -10.168  -4.269
  215    HB   VAL  28           HB       VAL  28   7.126 -10.721  -1.297
  216   1HG1  VAL  28          1HG1      VAL  28   6.875  -8.155  -2.856
  217   2HG1  VAL  28          2HG1      VAL  28   8.246  -8.643  -1.860
  218   3HG1  VAL  28          3HG1      VAL  28   6.682  -8.320  -1.110
  219   1HG2  VAL  28          1HG2      VAL  28   5.027 -11.368  -2.337
  220   2HG2  VAL  28          2HG2      VAL  28   4.924  -9.800  -3.136
  221   3HG2  VAL  28          3HG2      VAL  28   4.824  -9.903  -1.378
  222    H    ARG  29           H        ARG  29   9.308 -10.138  -5.041
  223    HA   ARG  29           HA       ARG  29  11.457 -11.218  -3.384
  224   1HB   ARG  29          1HB       ARG  29  11.113 -11.693  -5.906
  225   2HB   ARG  29          2HB       ARG  29  11.784 -10.085  -6.148
  226   1HG   ARG  29          1HG       ARG  29  13.557 -11.332  -4.407
  227   2HG   ARG  29          2HG       ARG  29  13.126 -12.575  -5.582
  228   1HD   ARG  29          1HD       ARG  29  15.044 -11.377  -6.391
  229   2HD   ARG  29          2HD       ARG  29  13.652 -10.965  -7.394
  230    HE   ARG  29           HE       ARG  29  14.179  -9.159  -5.188
  231   1HH1  ARG  29          1HH1      ARG  29  14.633  -9.843  -8.590
  232   2HH1  ARG  29          2HH1      ARG  29  15.066  -8.212  -8.994
  233   1HH2  ARG  29          1HH2      ARG  29  14.719  -7.007  -5.709
  234   2HH2  ARG  29          2HH2      ARG  29  15.092  -6.586  -7.358
  235    H    SER  30           H        SER  30   9.946  -8.481  -3.227
  236    HA   SER  30           HA       SER  30  12.377  -6.926  -2.746
  237   1HB   SER  30          1HB       SER  30  11.532  -6.186  -4.922
  238   2HB   SER  30          2HB       SER  30   9.940  -5.899  -4.222
  239    HG   SER  30           HG       SER  30  12.362  -4.539  -3.632
  240    H    ALA  31           H        ALA  31  12.394  -6.052  -0.799
  241    HA   ALA  31           HA       ALA  31   9.998  -6.233   0.844
  242   1HB   ALA  31          1HB       ALA  31  12.126  -7.046   1.744
  243   2HB   ALA  31          2HB       ALA  31  11.482  -5.719   2.712
  244   3HB   ALA  31          3HB       ALA  31  12.810  -5.427   1.588
  245    H    ASP  32           H        ASP  32  11.797  -3.903  -0.901
  246    HA   ASP  32           HA       ASP  32  10.753  -1.621   0.562
  247   1HB   ASP  32          1HB       ASP  32  13.026  -1.512  -0.373
  248   2HB   ASP  32          2HB       ASP  32  12.382  -1.765  -1.990
  249    H    GLY  33           H        GLY  33  10.077  -3.462  -2.299
  250   1HA   GLY  33          1HA       GLY  33   7.850  -3.483  -3.198
  251   2HA   GLY  33          2HA       GLY  33   7.691  -1.795  -2.731
  252    H    SER  34           H        SER  34   9.514  -3.944  -4.864
  253    HA   SER  34           HA       SER  34   9.395  -1.917  -6.958
  254   1HB   SER  34          1HB       SER  34  11.584  -1.759  -5.633
  255   2HB   SER  34          2HB       SER  34  11.981  -3.338  -6.307
  256    HG   SER  34           HG       SER  34  12.020  -0.858  -7.473
  257    HA   PRO  35           HA       PRO  35   8.277  -5.614  -9.233
  258   1HB   PRO  35          1HB       PRO  35   8.502  -4.453 -11.721
  259   2HB   PRO  35          2HB       PRO  35   7.075  -4.332 -10.690
  260   1HG   PRO  35          1HG       PRO  35   9.292  -2.378 -11.102
  261   2HG   PRO  35          2HG       PRO  35   7.552  -2.083 -10.929
  262   1HD   PRO  35          1HD       PRO  35   9.279  -1.667  -8.906
  263   2HD   PRO  35          2HD       PRO  35   7.625  -2.249  -8.627
  264    HA   PRO  36           HA       PRO  36   8.153  -6.581 -11.498
  265   1HB   PRO  36          1HB       PRO  36   9.109  -9.221 -12.054
  266   2HB   PRO  36          2HB       PRO  36   8.736  -7.935 -13.202
  267   1HG   PRO  36          1HG       PRO  36  11.269  -8.926 -12.711
  268   2HG   PRO  36          2HG       PRO  36  10.919  -7.340 -13.418
  269   1HD   PRO  36          1HD       PRO  36  11.642  -8.046 -10.605
  270   2HD   PRO  36          2HD       PRO  36  12.122  -6.637 -11.576
  271    H    TYR  37           H        TYR  37   6.538  -7.991 -10.808
  272    HA   TYR  37           HA       TYR  37   7.111  -9.497  -8.342
  273   1HB   TYR  37          1HB       TYR  37   4.814  -7.705  -9.059
  274   2HB   TYR  37          2HB       TYR  37   4.569  -9.033  -7.933
  275    HD1  TYR  37           HD1      TYR  37   5.490  -8.973  -5.722
  276    HD2  TYR  37           HD2      TYR  37   6.247  -5.805  -8.456
  277    HE1  TYR  37           HE1      TYR  37   6.298  -7.576  -3.870
  278    HE2  TYR  37           HE2      TYR  37   7.064  -4.399  -6.608
  279    HH   TYR  37           HH       TYR  37   7.653  -5.681  -3.457
  280    H    VAL  38           H        VAL  38   6.134 -11.530  -8.126
  281    HA   VAL  38           HA       VAL  38   4.775 -12.484 -10.554
  282    HB   VAL  38           HB       VAL  38   5.855 -14.066  -8.209
  283   1HG1  VAL  38          1HG1      VAL  38   5.304 -16.053  -9.543
  284   2HG1  VAL  38          2HG1      VAL  38   4.546 -15.023 -10.758
  285   3HG1  VAL  38          3HG1      VAL  38   3.861 -15.125  -9.135
  286   1HG2  VAL  38          1HG2      VAL  38   7.471 -14.918  -9.844
  287   2HG2  VAL  38          2HG2      VAL  38   7.597 -13.168  -9.660
  288   3HG2  VAL  38          3HG2      VAL  38   6.787 -13.850 -11.071
  289    H    VAL  39           H        VAL  39   2.678 -12.252 -10.532
  290    HA   VAL  39           HA       VAL  39   1.429 -11.829  -7.908
  291    HB   VAL  39           HB       VAL  39   1.849  -9.991  -9.926
  292   1HG1  VAL  39          1HG1      VAL  39   0.106 -10.930 -11.313
  293   2HG1  VAL  39          2HG1      VAL  39  -0.371  -9.339 -10.719
  294   3HG1  VAL  39          3HG1      VAL  39  -1.050 -10.793  -9.989
  295   1HG2  VAL  39          1HG2      VAL  39   0.456  -8.515  -8.561
  296   2HG2  VAL  39          2HG2      VAL  39   1.554  -9.492  -7.586
  297   3HG2  VAL  39          3HG2      VAL  39  -0.154  -9.919  -7.685
  298    H    ARG  40           H        ARG  40  -0.830 -12.234  -7.757
  299    HA   ARG  40           HA       ARG  40  -1.814 -14.247  -9.663
  300   1HB   ARG  40          1HB       ARG  40  -0.868 -15.235  -7.567
  301   2HB   ARG  40          2HB       ARG  40  -2.067 -14.338  -6.651
  302   1HG   ARG  40          1HG       ARG  40  -3.849 -15.588  -7.682
  303   2HG   ARG  40          2HG       ARG  40  -2.695 -16.423  -8.728
  304   1HD   ARG  40          1HD       ARG  40  -1.575 -17.294  -6.684
  305   2HD   ARG  40          2HD       ARG  40  -2.867 -16.579  -5.723
  306    HE   ARG  40           HE       ARG  40  -4.380 -18.074  -7.115
  307   1HH1  ARG  40          1HH1      ARG  40  -1.065 -18.882  -6.361
  308   2HH1  ARG  40          2HH1      ARG  40  -1.329 -20.592  -6.401
  309   1HH2  ARG  40          1HH2      ARG  40  -4.752 -20.312  -7.167
  310   2HH2  ARG  40          2HH2      ARG  40  -3.445 -21.416  -6.854
  311    H    TRP  41           H        TRP  41  -3.596 -13.430 -10.574
  312    HA   TRP  41           HA       TRP  41  -5.261 -11.483  -9.268
  313   1HB   TRP  41          1HB       TRP  41  -6.276 -13.109 -11.558
  314   2HB   TRP  41          2HB       TRP  41  -6.496 -11.402 -11.224
  315    HD1  TRP  41           HD1      TRP  41  -4.883 -13.568 -13.599
  316    HE1  TRP  41           HE1      TRP  41  -3.035 -12.354 -14.913
  317    HE3  TRP  41           HE3      TRP  41  -4.302  -9.482 -10.583
  318    HZ2  TRP  41           HZ2      TRP  41  -1.530  -9.980 -14.692
  319    HZ3  TRP  41           HZ3      TRP  41  -2.637  -7.785 -11.210
  320    HH2  TRP  41           HH2      TRP  41  -1.279  -8.031 -13.220
  321    H    LEU  42           H        LEU  42  -6.804 -11.978  -7.766
  322    HA   LEU  42           HA       LEU  42  -7.363 -14.813  -7.361
  323   1HB   LEU  42          1HB       LEU  42  -8.277 -12.458  -5.714
  324   2HB   LEU  42          2HB       LEU  42  -8.397 -14.150  -5.270
  325    HG   LEU  42           HG       LEU  42  -5.968 -12.400  -5.374
  326   1HD1  LEU  42          1HD1      LEU  42  -7.092 -14.288  -3.315
  327   2HD1  LEU  42          2HD1      LEU  42  -7.207 -12.528  -3.295
  328   3HD1  LEU  42          3HD1      LEU  42  -5.635 -13.311  -3.133
  329   1HD2  LEU  42          1HD2      LEU  42  -5.375 -14.387  -6.645
  330   2HD2  LEU  42          2HD2      LEU  42  -5.970 -15.414  -5.341
  331   3HD2  LEU  42          3HD2      LEU  42  -4.568 -14.379  -5.078
  332    H    VAL  43           H        VAL  43  -9.137 -11.810  -7.976
  333    HA   VAL  43           HA       VAL  43 -11.579 -13.348  -8.349
  334    HB   VAL  43           HB       VAL  43 -12.349 -10.834  -8.974
  335   1HG1  VAL  43          1HG1      VAL  43 -13.362 -12.289  -7.299
  336   2HG1  VAL  43          2HG1      VAL  43 -13.117 -10.665  -6.655
  337   3HG1  VAL  43          3HG1      VAL  43 -12.021 -11.969  -6.198
  338   1HG2  VAL  43          1HG2      VAL  43 -11.258  -9.285  -7.425
  339   2HG2  VAL  43          2HG2      VAL  43 -10.124  -9.891  -8.632
  340   3HG2  VAL  43          3HG2      VAL  43 -10.095 -10.539  -6.992
  341    H    ASN  44           H        ASN  44  -8.997 -12.331 -10.227
  342    HA   ASN  44           HA       ASN  44 -10.575 -12.580 -12.680
  343   1HB   ASN  44          1HB       ASN  44  -7.664 -11.940 -12.201
  344   2HB   ASN  44          2HB       ASN  44  -8.294 -12.305 -13.802
  345   1HD2  ASN  44          1HD2      ASN  44  -8.271 -10.015 -11.169
  346   2HD2  ASN  44          2HD2      ASN  44  -8.971  -8.708 -12.063
  347    H    GLY  45           H        GLY  45  -8.015 -14.219 -10.869
  348   1HA   GLY  45          1HA       GLY  45  -7.916 -16.516 -10.502
  349   2HA   GLY  45          2HA       GLY  45  -9.084 -16.753 -11.788
  350    H    HIS  46           H        HIS  46  -5.728 -15.535 -11.439
  351    HA   HIS  46           HA       HIS  46  -4.634 -17.628 -12.997
  352   1HB   HIS  46          1HB       HIS  46  -5.829 -16.232 -14.760
  353   2HB   HIS  46          2HB       HIS  46  -4.640 -14.976 -14.445
  354    HD1  HIS  46           HD1      HIS  46  -4.656 -18.660 -15.398
  355    HD2  HIS  46           HD2      HIS  46  -2.476 -15.181 -16.064
  356    HE1  HIS  46           HE1      HIS  46  -2.892 -19.277 -17.079
  357    HE2  HIS  46           HE2      HIS  46  -1.758 -17.102 -17.647
  358    H    GLU  47           H        GLU  47  -2.351 -17.474 -13.188
  359    HA   GLU  47           HA       GLU  47  -1.161 -15.408 -11.442
  360   1HB   GLU  47          1HB       GLU  47  -0.131 -18.189 -12.048
  361   2HB   GLU  47          2HB       GLU  47   0.608 -17.028 -10.953
  362   1HG   GLU  47          1HG       GLU  47  -1.309 -17.148  -9.484
  363   2HG   GLU  47          2HG       GLU  47  -2.121 -18.244 -10.601
  364    H    THR  48           H        THR  48   0.734 -14.368 -12.124
  365    HA   THR  48           HA       THR  48   2.226 -15.158 -14.390
  366    HB   THR  48           HB       THR  48   0.262 -14.416 -15.641
  367    HG1  THR  48           HG1      THR  48   1.352 -13.039 -17.054
  368   1HG2  THR  48          1HG2      THR  48  -0.639 -12.785 -14.067
  369   2HG2  THR  48          2HG2      THR  48  -0.417 -12.061 -15.660
  370   3HG2  THR  48          3HG2      THR  48   0.737 -11.724 -14.369
  371    H    THR  49           H        THR  49   3.528 -13.179 -15.204
  372    HA   THR  49           HA       THR  49   4.551 -11.808 -12.797
  373    HB   THR  49           HB       THR  49   6.047 -12.410 -15.361
  374    HG1  THR  49           HG1      THR  49   5.453 -14.292 -14.032
  375   1HG2  THR  49          1HG2      THR  49   7.017 -11.446 -12.664
  376   2HG2  THR  49          2HG2      THR  49   6.916 -10.475 -14.134
  377   3HG2  THR  49          3HG2      THR  49   8.037 -11.834 -14.048
  378    H    VAL  50           H        VAL  50   4.055  -9.710 -12.718
  379    HA   VAL  50           HA       VAL  50   3.794  -8.238 -15.255
  380    HB   VAL  50           HB       VAL  50   1.961  -6.912 -14.254
  381   1HG1  VAL  50          1HG1      VAL  50   1.451  -9.880 -14.390
  382   2HG1  VAL  50          2HG1      VAL  50   1.433  -8.752 -15.745
  383   3HG1  VAL  50          3HG1      VAL  50   0.217  -8.623 -14.474
  384   1HG2  VAL  50          1HG2      VAL  50   2.463  -7.263 -11.899
  385   2HG2  VAL  50          2HG2      VAL  50   2.067  -8.976 -12.054
  386   3HG2  VAL  50          3HG2      VAL  50   0.809  -7.757 -12.259
  387    H    TYR  51           H        TYR  51   3.706  -5.815 -14.828
  388    HA   TYR  51           HA       TYR  51   5.658  -5.095 -12.742
  389   1HB   TYR  51          1HB       TYR  51   5.310  -3.799 -15.460
  390   2HB   TYR  51          2HB       TYR  51   6.469  -3.316 -14.229
  391    HD1  TYR  51           HD1      TYR  51   5.579  -6.003 -16.609
  392    HD2  TYR  51           HD2      TYR  51   8.563  -4.432 -14.015
  393    HE1  TYR  51           HE1      TYR  51   7.227  -7.540 -17.587
  394    HE2  TYR  51           HE2      TYR  51  10.220  -5.970 -14.986
  395    HH   TYR  51           HH       TYR  51  10.417  -7.933 -16.235
  396    HA   PRO  52           HA       PRO  52   1.877  -2.842 -11.548
  397   1HB   PRO  52          1HB       PRO  52   2.809  -2.257  -9.049
  398   2HB   PRO  52          2HB       PRO  52   2.037  -3.789  -9.469
  399   1HG   PRO  52          1HG       PRO  52   4.948  -3.133  -9.237
  400   2HG   PRO  52          2HG       PRO  52   4.072  -4.562  -8.657
  401   1HD   PRO  52          1HD       PRO  52   5.526  -4.607 -10.916
  402   2HD   PRO  52          2HD       PRO  52   4.022  -5.537 -10.752
  403    H    GLY  53           H        GLY  53   5.229  -1.810 -10.956
  404   1HA   GLY  53          1HA       GLY  53   5.996   0.281 -11.930
  405   2HA   GLY  53          2HA       GLY  53   4.401   0.945 -11.594
  406    H    SER  54           H        SER  54   5.579   2.671 -10.527
  407    HA   SER  54           HA       SER  54   6.779   1.987  -7.957
  408   1HB   SER  54          1HB       SER  54   6.470   4.699  -9.269
  409   2HB   SER  54          2HB       SER  54   7.478   4.313  -7.874
  410    HG   SER  54           HG       SER  54   7.784   3.402 -10.548
  411    H    ASP  55           H        ASP  55   6.144   3.459  -6.074
  412    HA   ASP  55           HA       ASP  55   4.611   4.250  -4.589
  413   1HB   ASP  55          1HB       ASP  55   3.011   4.825  -7.091
  414   2HB   ASP  55          2HB       ASP  55   2.505   5.302  -5.477
  415    H    ALA  56           H        ALA  56   4.688   1.463  -5.309
  416    HA   ALA  56           HA       ALA  56   1.991   0.514  -5.456
  417   1HB   ALA  56          1HB       ALA  56   4.516  -1.026  -4.864
  418   2HB   ALA  56          2HB       ALA  56   3.835  -0.748  -6.466
  419   3HB   ALA  56          3HB       ALA  56   2.949  -1.716  -5.289
  420    H    VAL  57           H        VAL  57   0.643   0.564  -3.844
  421    HA   VAL  57           HA       VAL  57   1.594   0.560  -1.069
  422    HB   VAL  57           HB       VAL  57  -1.208   1.145  -2.044
  423   1HG1  VAL  57          1HG1      VAL  57  -1.427   2.343   0.083
  424   2HG1  VAL  57          2HG1      VAL  57   0.216   1.867   0.514
  425   3HG1  VAL  57          3HG1      VAL  57  -1.038   0.641   0.330
  426   1HG2  VAL  57          1HG2      VAL  57   0.300   2.697  -3.142
  427   2HG2  VAL  57          2HG2      VAL  57   1.033   3.108  -1.592
  428   3HG2  VAL  57          3HG2      VAL  57  -0.650   3.527  -1.910
  429    H    VAL  58           H        VAL  58   0.211  -0.707   0.503
  430    HA   VAL  58           HA       VAL  58  -0.455  -3.305  -0.714
  431    HB   VAL  58           HB       VAL  58   0.285  -2.870   2.174
  432   1HG1  VAL  58          1HG1      VAL  58   0.859  -5.247   2.091
  433   2HG1  VAL  58          2HG1      VAL  58   0.367  -5.305   0.399
  434   3HG1  VAL  58          3HG1      VAL  58  -0.827  -4.971   1.653
  435   1HG2  VAL  58          1HG2      VAL  58   2.151  -3.533  -0.099
  436   2HG2  VAL  58          2HG2      VAL  58   2.569  -3.548   1.615
  437   3HG2  VAL  58          3HG2      VAL  58   2.131  -2.031   0.827
  438    H    VAL  59           H        VAL  59  -2.238  -4.465   0.047
  439    HA   VAL  59           HA       VAL  59  -3.985  -3.361   2.088
  440    HB   VAL  59           HB       VAL  59  -4.799  -2.263   0.029
  441   1HG1  VAL  59          1HG1      VAL  59  -4.109  -3.882  -1.614
  442   2HG1  VAL  59          2HG1      VAL  59  -5.836  -3.557  -1.755
  443   3HG1  VAL  59          3HG1      VAL  59  -5.279  -5.041  -0.984
  444   1HG2  VAL  59          1HG2      VAL  59  -6.695  -4.327   1.093
  445   2HG2  VAL  59          2HG2      VAL  59  -7.150  -2.894   0.172
  446   3HG2  VAL  59          3HG2      VAL  59  -6.406  -2.721   1.761
  447    H    THR  60           H        THR  60  -5.892  -4.973   2.356
  448    HA   THR  60           HA       THR  60  -4.796  -7.675   2.271
  449    HB   THR  60           HB       THR  60  -6.633  -8.259   3.744
  450    HG1  THR  60           HG1      THR  60  -8.424  -7.122   3.747
  451   1HG2  THR  60          1HG2      THR  60  -4.692  -7.161   4.750
  452   2HG2  THR  60          2HG2      THR  60  -6.169  -6.729   5.610
  453   3HG2  THR  60          3HG2      THR  60  -5.439  -5.586   4.485
  454    H    ALA  61           H        ALA  61  -6.482  -9.408   1.788
  455    HA   ALA  61           HA       ALA  61  -6.750  -9.443  -0.948
  456   1HB   ALA  61          1HB       ALA  61  -6.675 -11.429   0.483
  457   2HB   ALA  61          2HB       ALA  61  -8.003 -11.487  -0.677
  458   3HB   ALA  61          3HB       ALA  61  -8.324 -11.096   1.013
  459    H    THR  62           H        THR  62  -9.508  -9.134   1.335
  460    HA   THR  62           HA       THR  62 -11.290  -9.212  -0.892
  461    HB   THR  62           HB       THR  62 -12.990  -8.733   0.985
  462    HG1  THR  62           HG1      THR  62 -11.878  -9.659   3.016
  463   1HG2  THR  62          1HG2      THR  62 -12.951 -11.105   1.637
  464   2HG2  THR  62          2HG2      THR  62 -11.334 -11.254   0.947
  465   3HG2  THR  62          3HG2      THR  62 -12.708 -10.900  -0.099
  466    H    GLU  63           H        GLU  63  -9.982  -6.613   1.066
  467    HA   GLU  63           HA       GLU  63 -12.026  -4.736   0.725
  468   1HB   GLU  63          1HB       GLU  63  -9.055  -4.255   0.972
  469   2HB   GLU  63          2HB       GLU  63 -10.284  -3.006   1.104
  470   1HG   GLU  63          1HG       GLU  63 -11.247  -4.402   3.007
  471   2HG   GLU  63          2HG       GLU  63  -9.716  -5.278   2.971
  472    H    HIS  64           H        HIS  64  -8.954  -4.853  -1.084
  473    HA   HIS  64           HA       HIS  64 -10.110  -3.211  -3.131
  474   1HB   HIS  64          1HB       HIS  64  -7.400  -4.147  -2.482
  475   2HB   HIS  64          2HB       HIS  64  -7.728  -3.895  -4.195
  476    HD1  HIS  64           HD1      HIS  64  -6.641  -2.106  -1.280
  477    HD2  HIS  64           HD2      HIS  64  -8.926  -1.171  -4.620
  478    HE1  HIS  64           HE1      HIS  64  -6.601   0.399  -1.441
  479    HE2  HIS  64           HE2      HIS  64  -8.161   0.952  -3.344
  480    H    ALA  65           H        ALA  65 -10.147  -6.574  -2.682
  481    HA   ALA  65           HA       ALA  65  -9.331  -7.772  -4.974
  482   1HB   ALA  65          1HB       ALA  65 -11.810  -8.510  -3.435
  483   2HB   ALA  65          2HB       ALA  65 -10.160  -8.953  -2.995
  484   3HB   ALA  65          3HB       ALA  65 -10.869  -9.567  -4.487
  485    H    GLU  66           H        GLU  66 -12.551  -6.342  -4.495
  486    HA   GLU  66           HA       GLU  66 -13.651  -7.160  -6.960
  487   1HB   GLU  66          1HB       GLU  66 -14.267  -4.571  -5.520
  488   2HB   GLU  66          2HB       GLU  66 -15.345  -5.501  -6.554
  489   1HG   GLU  66          1HG       GLU  66 -14.251  -6.478  -3.916
  490   2HG   GLU  66          2HG       GLU  66 -15.836  -5.735  -4.127
  491    H    ALA  67           H        ALA  67 -12.080  -4.162  -6.029
  492    HA   ALA  67           HA       ALA  67 -11.866  -3.014  -8.584
  493   1HB   ALA  67          1HB       ALA  67 -11.629  -1.718  -6.526
  494   2HB   ALA  67          2HB       ALA  67 -10.217  -1.532  -7.566
  495   3HB   ALA  67          3HB       ALA  67 -10.138  -2.582  -6.151
  496    H    GLU  68           H        GLU  68 -10.185  -5.633  -7.098
  497    HA   GLU  68           HA       GLU  68  -7.828  -5.478  -8.719
  498   1HB   GLU  68          1HB       GLU  68  -7.791  -6.791  -6.640
  499   2HB   GLU  68          2HB       GLU  68  -9.016  -7.871  -7.289
  500   1HG   GLU  68          1HG       GLU  68  -6.834  -7.739  -9.123
  501   2HG   GLU  68          2HG       GLU  68  -6.209  -8.064  -7.510
  502    H    LYS  69           H        LYS  69 -10.944  -7.169  -8.942
  503    HA   LYS  69           HA       LYS  69 -10.449  -8.570 -11.288
  504   1HB   LYS  69          1HB       LYS  69 -12.576  -8.498  -9.803
  505   2HB   LYS  69          2HB       LYS  69 -13.061  -7.148 -10.820
  506   1HG   LYS  69          1HG       LYS  69 -13.063  -8.537 -12.773
  507   2HG   LYS  69          2HG       LYS  69 -12.370  -9.887 -11.870
  508   1HD   LYS  69          1HD       LYS  69 -14.393  -9.934 -10.452
  509   2HD   LYS  69          2HD       LYS  69 -15.083  -8.639 -11.429
  510   1HE   LYS  69          1HE       LYS  69 -15.984 -10.747 -12.153
  511   2HE   LYS  69          2HE       LYS  69 -14.934 -10.102 -13.412
  512   1HZ   LYS  69          1HZ       LYS  69 -14.181 -12.209 -11.449
  513   2HZ   LYS  69          2HZ       LYS  69 -13.190 -11.607 -12.686
  514   3HZ   LYS  69          3HZ       LYS  69 -14.587 -12.475 -13.073
  515    H    ARG  70           H        ARG  70 -11.672  -5.248 -10.861
  516    HA   ARG  70           HA       ARG  70 -11.609  -4.567 -13.630
  517   1HB   ARG  70          1HB       ARG  70 -11.335  -2.766 -11.225
  518   2HB   ARG  70          2HB       ARG  70 -11.608  -2.206 -12.866
  519   1HG   ARG  70          1HG       ARG  70 -13.736  -3.504 -12.875
  520   2HG   ARG  70          2HG       ARG  70 -13.470  -3.832 -11.160
  521   1HD   ARG  70          1HD       ARG  70 -13.412  -1.418 -10.722
  522   2HD   ARG  70          2HD       ARG  70 -13.713  -1.109 -12.431
  523    HE   ARG  70           HE       ARG  70 -15.652  -2.643 -10.830
  524   1HH1  ARG  70          1HH1      ARG  70 -14.839   0.149 -12.781
  525   2HH1  ARG  70          2HH1      ARG  70 -16.479   0.698 -12.917
  526   1HH2  ARG  70          1HH2      ARG  70 -17.819  -1.917 -10.996
  527   2HH2  ARG  70          2HH2      ARG  70 -18.169  -0.464 -11.885
  528    H    ALA  71           H        ALA  71  -9.308  -3.502 -11.126
  529    HA   ALA  71           HA       ALA  71  -7.661  -2.193 -13.032
  530   1HB   ALA  71          1HB       ALA  71  -7.937  -1.379 -10.749
  531   2HB   ALA  71          2HB       ALA  71  -6.242  -1.621 -11.170
  532   3HB   ALA  71          3HB       ALA  71  -7.072  -2.793 -10.146
  533    H    ALA  72           H        ALA  72  -7.654  -5.444 -11.858
  534    HA   ALA  72           HA       ALA  72  -4.906  -5.907 -12.628
  535   1HB   ALA  72          1HB       ALA  72  -7.081  -7.912 -12.050
  536   2HB   ALA  72          2HB       ALA  72  -5.910  -7.296 -10.884
  537   3HB   ALA  72          3HB       ALA  72  -5.364  -8.265 -12.252
  538    H    ALA  73           H        ALA  73  -8.159  -6.375 -14.011
  539    HA   ALA  73           HA       ALA  73  -7.409  -7.464 -16.459
  540   1HB   ALA  73          1HB       ALA  73  -9.464  -5.302 -15.994
  541   2HB   ALA  73          2HB       ALA  73  -9.741  -7.037 -15.843
  542   3HB   ALA  73          3HB       ALA  73  -9.355  -6.338 -17.417
  543    H    ARG  74           H        ARG  74  -7.093  -4.145 -15.266
  544    HA   ARG  74           HA       ARG  74  -5.854  -3.190 -17.686
  545   1HB   ARG  74          1HB       ARG  74  -6.925  -1.840 -15.698
  546   2HB   ARG  74          2HB       ARG  74  -5.293  -1.910 -15.042
  547   1HG   ARG  74          1HG       ARG  74  -4.604  -1.052 -17.404
  548   2HG   ARG  74          2HG       ARG  74  -6.287  -0.540 -17.500
  549   1HD   ARG  74          1HD       ARG  74  -5.225   1.340 -16.658
  550   2HD   ARG  74          2HD       ARG  74  -5.833   0.556 -15.199
  551    HE   ARG  74           HE       ARG  74  -3.631  -0.124 -14.668
  552   1HH1  ARG  74          1HH1      ARG  74  -3.818   1.935 -17.496
  553   2HH1  ARG  74          2HH1      ARG  74  -2.126   2.324 -17.495
  554   1HH2  ARG  74          1HH2      ARG  74  -1.388   0.333 -14.693
  555   2HH2  ARG  74          2HH2      ARG  74  -0.721   1.372 -15.922
  556    H    ALA  75           H        ALA  75  -4.501  -3.961 -14.475
  557    HA   ALA  75           HA       ALA  75  -1.816  -3.481 -14.895
  558   1HB   ALA  75          1HB       ALA  75  -2.992  -5.687 -13.209
  559   2HB   ALA  75          2HB       ALA  75  -2.820  -4.000 -12.725
  560   3HB   ALA  75          3HB       ALA  75  -1.386  -4.977 -13.042
  561    H    GLY  76           H        GLY  76  -3.497  -6.607 -15.406
  562   1HA   GLY  76          1HA       GLY  76  -1.040  -7.858 -16.270
  563   2HA   GLY  76          2HA       GLY  76  -2.626  -8.604 -16.211
  564    H    HIS  77           H        HIS  77  -2.863  -5.713 -17.824
  565    HA   HIS  77           HA       HIS  77  -2.909  -7.082 -20.401
  566   1HB   HIS  77          1HB       HIS  77  -4.863  -5.736 -19.790
  567   2HB   HIS  77          2HB       HIS  77  -3.845  -4.315 -19.590
  568    HD1  HIS  77           HD1      HIS  77  -4.190  -2.768 -21.474
  569    HD2  HIS  77           HD2      HIS  77  -4.380  -6.745 -22.692
  570    HE1  HIS  77           HE1      HIS  77  -4.544  -2.704 -23.963
  571    HE2  HIS  77           HE2      HIS  77  -4.641  -5.116 -24.686
  572    H    ALA  78           H        ALA  78  -0.935  -4.989 -18.564
  573    HA   ALA  78           HA       ALA  78   0.960  -4.708 -20.724
  574   1HB   ALA  78          1HB       ALA  78  -0.308  -2.241 -19.531
  575   2HB   ALA  78          2HB       ALA  78  -0.556  -2.838 -21.172
  576   3HB   ALA  78          3HB       ALA  78   1.037  -2.268 -20.672
  577    H    ALA  79           H        ALA  79   2.406  -2.562 -19.540
  578    HA   ALA  79           HA       ALA  79   2.948  -3.412 -16.794
  579   1HB   ALA  79          1HB       ALA  79   5.077  -3.207 -18.925
  580   2HB   ALA  79          2HB       ALA  79   4.487  -4.700 -18.196
  581   3HB   ALA  79          3HB       ALA  79   5.355  -3.522 -17.213
  582    H    THR  80           H        THR  80   1.896  -1.058 -18.460
  583    HA   THR  80           HA       THR  80   3.389   1.027 -17.095
  584    HB   THR  80           HB       THR  80   3.329   2.339 -19.345
  585    HG1  THR  80           HG1      THR  80   2.148   0.583 -20.418
  586   1HG2  THR  80          1HG2      THR  80   5.397   1.705 -18.210
  587   2HG2  THR  80          2HG2      THR  80   5.555   1.492 -19.953
  588   3HG2  THR  80          3HG2      THR  80   5.301   0.091 -18.912
  Start of MODEL   25
    1    H    MET   1           H        MET   1   5.949   2.169  -2.410
    2    HA   MET   1           HA       MET   1   5.884   1.809  -0.004
    3   1HB   MET   1          1HB       MET   1   4.030   0.107  -0.065
    4   2HB   MET   1          2HB       MET   1   3.852   1.436  -1.196
    5   1HG   MET   1          1HG       MET   1   3.194  -0.523  -2.327
    6   2HG   MET   1          2HG       MET   1   4.768  -0.071  -2.974
    7   1HE   MET   1          1HE       MET   1   4.845  -2.526  -4.077
    8   2HE   MET   1          2HE       MET   1   3.310  -2.951  -3.319
    9   3HE   MET   1          3HE       MET   1   4.707  -4.012  -3.140
   10    H    HIS   2           H        HIS   2   5.135  -0.606   1.129
   11    HA   HIS   2           HA       HIS   2   7.468  -2.374   0.920
   12   1HB   HIS   2          1HB       HIS   2   7.474  -0.562   2.879
   13   2HB   HIS   2          2HB       HIS   2   6.395  -1.721   3.640
   14    HD1  HIS   2           HD1      HIS   2   7.441  -4.134   4.141
   15    HD2  HIS   2           HD2      HIS   2  10.135  -1.175   2.991
   16    HE1  HIS   2           HE1      HIS   2   9.718  -5.004   4.763
   17    HE2  HIS   2           HE2      HIS   2  11.341  -3.293   3.859
   18    H    ALA   3           H        ALA   3   6.729  -4.458   0.731
   19    HA   ALA   3           HA       ALA   3   4.086  -5.098   1.827
   20   1HB   ALA   3          1HB       ALA   3   4.859  -5.607  -1.039
   21   2HB   ALA   3          2HB       ALA   3   3.742  -4.361  -0.484
   22   3HB   ALA   3          3HB       ALA   3   3.342  -6.065  -0.268
   23    H    LYS   4           H        LYS   4   3.567  -7.464   1.484
   24    HA   LYS   4           HA       LYS   4   5.932  -9.181   1.597
   25   1HB   LYS   4          1HB       LYS   4   5.318  -8.469   3.919
   26   2HB   LYS   4          2HB       LYS   4   3.734  -9.190   3.683
   27   1HG   LYS   4          1HG       LYS   4   4.790 -11.386   3.398
   28   2HG   LYS   4          2HG       LYS   4   6.369 -10.649   3.673
   29   1HD   LYS   4          1HD       LYS   4   4.078 -10.692   5.637
   30   2HD   LYS   4          2HD       LYS   4   5.500 -11.736   5.692
   31   1HE   LYS   4          1HE       LYS   4   6.919  -9.719   5.908
   32   2HE   LYS   4          2HE       LYS   4   5.458  -8.730   5.956
   33   1HZ   LYS   4          1HZ       LYS   4   6.229 -10.827   7.917
   34   2HZ   LYS   4          2HZ       LYS   4   4.768  -9.966   7.946
   35   3HZ   LYS   4          3HZ       LYS   4   6.235  -9.149   8.184
   36    H    VAL   5           H        VAL   5   5.268 -11.533   1.458
   37    HA   VAL   5           HA       VAL   5   3.192 -11.952  -0.466
   38    HB   VAL   5           HB       VAL   5   5.140 -13.406  -0.466
   39   1HG1  VAL   5          1HG1      VAL   5   5.567 -15.015   1.338
   40   2HG1  VAL   5          2HG1      VAL   5   4.272 -14.281   2.285
   41   3HG1  VAL   5          3HG1      VAL   5   5.714 -13.346   1.889
   42   1HG2  VAL   5          1HG2      VAL   5   2.683 -14.935   0.369
   43   2HG2  VAL   5          2HG2      VAL   5   4.078 -15.610  -0.470
   44   3HG2  VAL   5          3HG2      VAL   5   3.075 -14.399  -1.266
   45    H    GLY   6           H        GLY   6   1.176 -12.947  -0.180
   46   1HA   GLY   6          1HA       GLY   6  -0.666 -13.729   1.092
   47   2HA   GLY   6          2HA       GLY   6   0.203 -13.310   2.569
   48    H    ASP   7           H        ASP   7   0.336 -11.084   0.065
   49    HA   ASP   7           HA       ASP   7  -1.785  -9.289   1.187
   50   1HB   ASP   7          1HB       ASP   7   1.173  -8.635   0.912
   51   2HB   ASP   7          2HB       ASP   7  -0.088  -7.418   1.068
   52    H    TYR   8           H        TYR   8  -1.467  -7.195  -0.219
   53    HA   TYR   8           HA       TYR   8  -1.584  -8.128  -3.024
   54   1HB   TYR   8          1HB       TYR   8  -3.691  -6.555  -1.508
   55   2HB   TYR   8          2HB       TYR   8  -3.692  -6.769  -3.245
   56    HD1  TYR   8           HD1      TYR   8  -4.605  -8.688  -4.231
   57    HD2  TYR   8           HD2      TYR   8  -4.126  -8.522  -0.010
   58    HE1  TYR   8           HE1      TYR   8  -6.071 -10.651  -4.004
   59    HE2  TYR   8           HE2      TYR   8  -5.579 -10.501   0.220
   60    HH   TYR   8           HH       TYR   8  -6.280 -12.547  -2.154
   61    H    LEU   9           H        LEU   9  -2.131  -6.144  -4.439
   62    HA   LEU   9           HA       LEU   9  -0.400  -3.916  -3.645
   63   1HB   LEU   9          1HB       LEU   9   1.037  -5.637  -4.623
   64   2HB   LEU   9          2HB       LEU   9  -0.008  -5.758  -6.017
   65    HG   LEU   9           HG       LEU   9   1.400  -3.169  -5.433
   66   1HD1  LEU   9          1HD1      LEU   9   2.545  -5.552  -6.882
   67   2HD1  LEU   9          2HD1      LEU   9   3.117  -4.897  -5.349
   68   3HD1  LEU   9          3HD1      LEU   9   3.258  -3.941  -6.824
   69   1HD2  LEU   9          1HD2      LEU   9   1.292  -2.966  -7.874
   70   2HD2  LEU   9          2HD2      LEU   9  -0.312  -3.192  -7.177
   71   3HD2  LEU   9          3HD2      LEU   9   0.501  -4.541  -7.970
   72    H    VAL  10           H        VAL  10  -0.771  -2.038  -4.762
   73    HA   VAL  10           HA       VAL  10  -2.845  -2.005  -6.835
   74    HB   VAL  10           HB       VAL  10  -2.906  -0.262  -4.341
   75   1HG1  VAL  10          1HG1      VAL  10  -4.824  -0.285  -6.667
   76   2HG1  VAL  10          2HG1      VAL  10  -3.655   0.987  -6.310
   77   3HG1  VAL  10          3HG1      VAL  10  -4.985   0.672  -5.194
   78   1HG2  VAL  10          1HG2      VAL  10  -4.800  -2.403  -5.283
   79   2HG2  VAL  10          2HG2      VAL  10  -5.063  -1.345  -3.897
   80   3HG2  VAL  10          3HG2      VAL  10  -3.721  -2.491  -3.890
   81    H    VAL  11           H        VAL  11  -2.945   0.292  -7.773
   82    HA   VAL  11           HA       VAL  11  -0.429   1.785  -7.532
   83    HB   VAL  11           HB       VAL  11  -1.687   0.717 -10.063
   84   1HG1  VAL  11          1HG1      VAL  11  -0.278   2.234 -11.374
   85   2HG1  VAL  11          2HG1      VAL  11   0.222   3.048  -9.891
   86   3HG1  VAL  11          3HG1      VAL  11  -1.462   3.118 -10.410
   87   1HG2  VAL  11          1HG2      VAL  11   0.621   0.081 -10.579
   88   2HG2  VAL  11          2HG2      VAL  11   0.087  -0.597  -9.042
   89   3HG2  VAL  11          3HG2      VAL  11   1.158   0.803  -9.062
   90    H    LYS  12           H        LYS  12  -0.791   3.963  -7.470
   91    HA   LYS  12           HA       LYS  12  -1.863   5.955  -7.332
   92   1HB   LYS  12          1HB       LYS  12  -3.829   4.617  -9.191
   93   2HB   LYS  12          2HB       LYS  12  -4.000   6.280  -8.652
   94   1HG   LYS  12          1HG       LYS  12  -1.998   6.928  -9.757
   95   2HG   LYS  12          2HG       LYS  12  -1.574   5.249 -10.098
   96   1HD   LYS  12          1HD       LYS  12  -2.457   6.327 -12.091
   97   2HD   LYS  12          2HD       LYS  12  -3.546   5.054 -11.547
   98   1HE   LYS  12          1HE       LYS  12  -4.852   6.966 -12.194
   99   2HE   LYS  12          2HE       LYS  12  -4.938   6.786 -10.444
  100   1HZ   LYS  12          1HZ       LYS  12  -4.559   9.108 -11.377
  101   2HZ   LYS  12          2HZ       LYS  12  -2.972   8.609 -11.699
  102   3HZ   LYS  12          3HZ       LYS  12  -3.559   8.612 -10.105
  103    H    GLY  13           H        GLY  13  -3.830   7.000  -6.439
  104   1HA   GLY  13          1HA       GLY  13  -6.009   6.621  -5.369
  105   2HA   GLY  13          2HA       GLY  13  -5.341   5.136  -4.712
  106    H    THR  14           H        THR  14  -3.130   7.723  -4.744
  107    HA   THR  14           HA       THR  14  -3.331   7.817  -1.835
  108    HB   THR  14           HB       THR  14  -1.117   7.364  -2.769
  109    HG1  THR  14           HG1      THR  14  -0.285   9.675  -1.828
  110   1HG2  THR  14          1HG2      THR  14  -1.304  10.112  -4.004
  111   2HG2  THR  14          2HG2      THR  14  -1.300   8.578  -4.876
  112   3HG2  THR  14          3HG2      THR  14   0.132   9.089  -3.981
  113    H    THR  15           H        THR  15  -3.439   9.995  -4.633
  114    HA   THR  15           HA       THR  15  -4.198  12.203  -2.874
  115    HB   THR  15           HB       THR  15  -4.197  13.506  -5.077
  116    HG1  THR  15           HG1      THR  15  -2.676  12.291  -6.609
  117   1HG2  THR  15          1HG2      THR  15  -2.380  13.659  -3.453
  118   2HG2  THR  15          2HG2      THR  15  -1.752  13.706  -5.099
  119   3HG2  THR  15          3HG2      THR  15  -1.621  12.227  -4.147
  120    H    THR  16           H        THR  16  -6.074  10.514  -2.562
  121    HA   THR  16           HA       THR  16  -8.221   9.853  -2.830
  122    HB   THR  16           HB       THR  16  -9.857  11.653  -3.440
  123    HG1  THR  16           HG1      THR  16  -7.871  12.748  -4.661
  124   1HG2  THR  16          1HG2      THR  16  -9.130  11.320  -1.132
  125   2HG2  THR  16          2HG2      THR  16  -9.409  13.030  -1.467
  126   3HG2  THR  16          3HG2      THR  16  -7.763  12.401  -1.402
  127    H    GLU  17           H        GLU  17  -6.891   8.718  -4.748
  128    HA   GLU  17           HA       GLU  17  -8.232   9.284  -7.305
  129   1HB   GLU  17          1HB       GLU  17  -5.839   7.506  -6.848
  130   2HB   GLU  17          2HB       GLU  17  -6.426   8.134  -8.380
  131   1HG   GLU  17          1HG       GLU  17  -5.632  10.285  -7.927
  132   2HG   GLU  17          2HG       GLU  17  -5.429   9.938  -6.208
  133    H    ARG  18           H        ARG  18  -8.515   7.242  -8.662
  134    HA   ARG  18           HA       ARG  18  -9.924   5.181  -7.233
  135   1HB   ARG  18          1HB       ARG  18  -9.041   5.434 -10.119
  136   2HB   ARG  18          2HB       ARG  18 -10.016   4.105  -9.509
  137   1HG   ARG  18          1HG       ARG  18 -11.848   5.527  -9.068
  138   2HG   ARG  18          2HG       ARG  18 -10.864   6.977  -9.282
  139   1HD   ARG  18          1HD       ARG  18 -11.471   4.979 -11.454
  140   2HD   ARG  18          2HD       ARG  18 -12.348   6.489 -11.209
  141    HE   ARG  18           HE       ARG  18  -9.454   6.613 -11.612
  142   1HH1  ARG  18          1HH1      ARG  18 -12.674   7.096 -12.905
  143   2HH1  ARG  18          2HH1      ARG  18 -12.153   8.213 -14.131
  144   1HH2  ARG  18          1HH2      ARG  18  -8.750   8.038 -13.243
  145   2HH2  ARG  18          2HH2      ARG  18  -9.913   8.752 -14.323
  146    H    HIS  19           H        HIS  19  -9.146   3.238  -6.563
  147    HA   HIS  19           HA       HIS  19  -6.283   2.817  -6.738
  148   1HB   HIS  19          1HB       HIS  19  -8.480   1.329  -5.298
  149   2HB   HIS  19          2HB       HIS  19  -6.811   0.776  -5.320
  150    HD1  HIS  19           HD1      HIS  19  -5.040   2.376  -4.147
  151    HD2  HIS  19           HD2      HIS  19  -9.030   3.308  -3.458
  152    HE1  HIS  19           HE1      HIS  19  -5.039   3.891  -2.143
  153    HE2  HIS  19           HE2      HIS  19  -7.444   4.601  -1.867
  154    H    ASP  20           H        ASP  20  -5.626   2.113  -8.675
  155    HA   ASP  20           HA       ASP  20  -7.158  -0.060  -9.951
  156   1HB   ASP  20          1HB       ASP  20  -7.027   2.258 -11.076
  157   2HB   ASP  20          2HB       ASP  20  -5.344   1.863 -11.405
  158    H    GLN  21           H        GLN  21  -5.481  -1.080 -11.744
  159    HA   GLN  21           HA       GLN  21  -4.095  -2.889 -11.772
  160   1HB   GLN  21          1HB       GLN  21  -2.200  -0.736 -10.821
  161   2HB   GLN  21          2HB       GLN  21  -1.711  -2.265 -11.548
  162   1HG   GLN  21          1HG       GLN  21  -3.019  -1.648 -13.575
  163   2HG   GLN  21          2HG       GLN  21  -3.314  -0.071 -12.853
  164   1HE2  GLN  21          1HE2      GLN  21  -0.610  -0.015 -11.678
  165   2HE2  GLN  21          2HE2      GLN  21   0.451   0.351 -12.991
  166    H    HIS  22           H        HIS  22  -4.659  -4.478 -10.354
  167    HA   HIS  22           HA       HIS  22  -3.532  -4.376  -7.648
  168   1HB   HIS  22          1HB       HIS  22  -5.825  -3.398  -7.592
  169   2HB   HIS  22          2HB       HIS  22  -6.456  -4.916  -8.206
  170    HD1  HIS  22           HD1      HIS  22  -7.121  -3.485  -5.412
  171    HD2  HIS  22           HD2      HIS  22  -4.690  -6.803  -5.998
  172    HE1  HIS  22           HE1      HIS  22  -7.143  -4.734  -3.232
  173    HE2  HIS  22           HE2      HIS  22  -5.784  -6.811  -3.664
  174    H    ALA  23           H        ALA  23  -2.796  -6.177  -6.981
  175    HA   ALA  23           HA       ALA  23  -3.532  -8.802  -8.098
  176   1HB   ALA  23          1HB       ALA  23  -1.615  -7.986  -9.404
  177   2HB   ALA  23          2HB       ALA  23  -1.183  -9.367  -8.397
  178   3HB   ALA  23          3HB       ALA  23  -0.707  -7.741  -7.914
  179    H    GLU  24           H        GLU  24  -2.117 -10.477  -6.867
  180    HA   GLU  24           HA       GLU  24  -1.683  -9.621  -4.074
  181   1HB   GLU  24          1HB       GLU  24  -3.799 -10.879  -4.073
  182   2HB   GLU  24          2HB       GLU  24  -3.015 -12.212  -4.919
  183   1HG   GLU  24          1HG       GLU  24  -1.397 -12.273  -2.929
  184   2HG   GLU  24          2HG       GLU  24  -2.578 -11.265  -2.102
  185    H    ILE  25           H        ILE  25   0.100 -10.205  -3.288
  186    HA   ILE  25           HA       ILE  25   2.040 -11.381  -5.058
  187    HB   ILE  25           HB       ILE  25   2.630 -10.417  -2.278
  188   1HG1  ILE  25          1HG1      ILE  25   2.269  -8.636  -4.706
  189   2HG1  ILE  25          2HG1      ILE  25   1.156  -8.713  -3.344
  190   1HG2  ILE  25          1HG2      ILE  25   4.403 -11.439  -3.587
  191   2HG2  ILE  25          2HG2      ILE  25   4.720  -9.722  -3.335
  192   3HG2  ILE  25          3HG2      ILE  25   4.115 -10.289  -4.893
  193   1HD1  ILE  25          1HD1      ILE  25   4.027  -7.814  -3.238
  194   2HD1  ILE  25          2HD1      ILE  25   2.923  -7.901  -1.865
  195   3HD1  ILE  25          3HD1      ILE  25   2.601  -6.775  -3.184
  196    H    ILE  26           H        ILE  26   2.019 -13.499  -5.106
  197    HA   ILE  26           HA       ILE  26   2.042 -15.004  -2.588
  198    HB   ILE  26           HB       ILE  26   1.804 -16.999  -4.249
  199   1HG1  ILE  26          1HG1      ILE  26   0.235 -16.138  -6.178
  200   2HG1  ILE  26          2HG1      ILE  26   1.113 -14.631  -5.958
  201   1HG2  ILE  26          1HG2      ILE  26  -0.637 -16.801  -4.150
  202   2HG2  ILE  26          2HG2      ILE  26  -0.468 -15.109  -3.682
  203   3HG2  ILE  26          3HG2      ILE  26   0.132 -16.381  -2.618
  204   1HD1  ILE  26          1HD1      ILE  26   2.309 -17.299  -6.670
  205   2HD1  ILE  26          2HD1      ILE  26   3.211 -15.803  -6.420
  206   3HD1  ILE  26          3HD1      ILE  26   2.066 -15.929  -7.756
  207    H    GLU  27           H        GLU  27   3.975 -13.850  -5.079
  208    HA   GLU  27           HA       GLU  27   6.246 -15.314  -3.970
  209   1HB   GLU  27          1HB       GLU  27   5.313 -16.122  -6.340
  210   2HB   GLU  27          2HB       GLU  27   6.235 -14.739  -6.903
  211   1HG   GLU  27          1HG       GLU  27   7.333 -17.055  -5.328
  212   2HG   GLU  27          2HG       GLU  27   7.503 -16.815  -7.063
  213    H    VAL  28           H        VAL  28   8.105 -14.042  -3.839
  214    HA   VAL  28           HA       VAL  28   7.708 -11.183  -4.380
  215    HB   VAL  28           HB       VAL  28   8.527 -12.173  -1.653
  216   1HG1  VAL  28          1HG1      VAL  28   8.001  -9.885  -0.971
  217   2HG1  VAL  28          2HG1      VAL  28   7.565  -9.490  -2.635
  218   3HG1  VAL  28          3HG1      VAL  28   9.228  -9.923  -2.235
  219   1HG2  VAL  28          1HG2      VAL  28   6.268 -11.631  -0.866
  220   2HG2  VAL  28          2HG2      VAL  28   6.255 -12.946  -2.041
  221   3HG2  VAL  28          3HG2      VAL  28   5.770 -11.324  -2.528
  222    H    ARG  29           H        ARG  29   9.537 -10.766  -5.547
  223    HA   ARG  29           HA       ARG  29  11.909 -12.311  -5.270
  224   1HB   ARG  29          1HB       ARG  29  11.287  -9.809  -6.820
  225   2HB   ARG  29          2HB       ARG  29  12.882 -10.547  -6.829
  226   1HG   ARG  29          1HG       ARG  29  10.327 -11.874  -7.719
  227   2HG   ARG  29          2HG       ARG  29  11.564 -11.197  -8.778
  228   1HD   ARG  29          1HD       ARG  29  12.018 -13.495  -8.748
  229   2HD   ARG  29          2HD       ARG  29  13.181 -12.807  -7.616
  230    HE   ARG  29           HE       ARG  29  10.662 -14.095  -6.739
  231   1HH1  ARG  29          1HH1      ARG  29  14.140 -13.650  -6.461
  232   2HH1  ARG  29          2HH1      ARG  29  14.282 -14.648  -5.051
  233   1HH2  ARG  29          1HH2      ARG  29  10.842 -15.403  -4.900
  234   2HH2  ARG  29          2HH2      ARG  29  12.409 -15.681  -4.176
  235    H    SER  30           H        SER  30  10.771  -9.486  -3.720
  236    HA   SER  30           HA       SER  30  13.115  -9.502  -2.032
  237   1HB   SER  30          1HB       SER  30  12.264  -6.996  -3.508
  238   2HB   SER  30          2HB       SER  30  13.462  -7.053  -2.213
  239    HG   SER  30           HG       SER  30  14.007  -8.888  -4.132
  240    H    ALA  31           H        ALA  31  12.335  -9.586  -0.053
  241    HA   ALA  31           HA       ALA  31   9.572  -9.119   0.479
  242   1HB   ALA  31          1HB       ALA  31  11.800  -9.728   2.415
  243   2HB   ALA  31          2HB       ALA  31  10.839 -10.924   1.548
  244   3HB   ALA  31          3HB       ALA  31  10.070  -9.866   2.733
  245    H    ASP  32           H        ASP  32  12.061  -6.980   0.230
  246    HA   ASP  32           HA       ASP  32  11.099  -5.188   2.323
  247   1HB   ASP  32          1HB       ASP  32  13.560  -5.459   1.814
  248   2HB   ASP  32          2HB       ASP  32  13.261  -4.655   0.277
  249    H    GLY  33           H        GLY  33  10.422  -5.923  -0.880
  250   1HA   GLY  33          1HA       GLY  33   8.578  -4.939  -2.020
  251   2HA   GLY  33          2HA       GLY  33   8.871  -3.443  -1.144
  252    H    SER  34           H        SER  34  10.362  -5.583  -3.548
  253    HA   SER  34           HA       SER  34  11.196  -3.203  -5.036
  254   1HB   SER  34          1HB       SER  34  12.979  -5.608  -4.573
  255   2HB   SER  34          2HB       SER  34  13.396  -4.142  -5.461
  256    HG   SER  34           HG       SER  34  12.560  -3.389  -3.073
  257    HA   PRO  35           HA       PRO  35   9.182  -5.599  -8.233
  258   1HB   PRO  35          1HB       PRO  35  10.240  -3.549 -10.052
  259   2HB   PRO  35          2HB       PRO  35   8.565  -3.956  -9.677
  260   1HG   PRO  35          1HG       PRO  35   9.691  -1.663  -8.838
  261   2HG   PRO  35          2HG       PRO  35   8.480  -2.526  -7.872
  262   1HD   PRO  35          1HD       PRO  35  11.464  -2.488  -7.575
  263   2HD   PRO  35          2HD       PRO  35  10.208  -2.396  -6.322
  264    HA   PRO  36           HA       PRO  36   8.734  -6.252 -10.370
  265   1HB   PRO  36          1HB       PRO  36   9.149  -8.940 -11.291
  266   2HB   PRO  36          2HB       PRO  36   8.837  -7.490 -12.248
  267   1HG   PRO  36          1HG       PRO  36  11.205  -8.859 -12.296
  268   2HG   PRO  36          2HG       PRO  36  11.059  -7.128 -12.651
  269   1HD   PRO  36          1HD       PRO  36  11.894  -8.476 -10.109
  270   2HD   PRO  36          2HD       PRO  36  12.598  -7.057 -10.917
  271    H    TYR  37           H        TYR  37   7.215  -8.267 -10.254
  272    HA   TYR  37           HA       TYR  37   7.620  -9.734  -7.728
  273   1HB   TYR  37          1HB       TYR  37   5.097  -8.234  -8.495
  274   2HB   TYR  37          2HB       TYR  37   5.259  -9.296  -7.104
  275    HD1  TYR  37           HD1      TYR  37   5.768  -5.971  -8.402
  276    HD2  TYR  37           HD2      TYR  37   6.794  -8.618  -5.226
  277    HE1  TYR  37           HE1      TYR  37   6.466  -4.049  -7.034
  278    HE2  TYR  37           HE2      TYR  37   7.496  -6.703  -3.853
  279    HH   TYR  37           HH       TYR  37   6.779  -3.481  -4.673
  280    H    VAL  38           H        VAL  38   5.779 -11.411  -7.526
  281    HA   VAL  38           HA       VAL  38   5.027 -12.462 -10.164
  282    HB   VAL  38           HB       VAL  38   6.294 -14.158  -7.987
  283   1HG1  VAL  38          1HG1      VAL  38   5.404 -14.857 -10.788
  284   2HG1  VAL  38          2HG1      VAL  38   4.623 -15.358  -9.287
  285   3HG1  VAL  38          3HG1      VAL  38   6.241 -15.943  -9.678
  286   1HG2  VAL  38          1HG2      VAL  38   8.185 -14.448  -9.524
  287   2HG2  VAL  38          2HG2      VAL  38   7.986 -12.761  -9.049
  288   3HG2  VAL  38          3HG2      VAL  38   7.450 -13.299 -10.641
  289    H    VAL  39           H        VAL  39   2.941 -13.112 -10.105
  290    HA   VAL  39           HA       VAL  39   1.669 -12.570  -7.531
  291    HB   VAL  39           HB       VAL  39   2.390 -10.610  -9.343
  292   1HG1  VAL  39          1HG1      VAL  39   0.678 -11.198 -10.933
  293   2HG1  VAL  39          2HG1      VAL  39   0.302  -9.642 -10.197
  294   3HG1  VAL  39          3HG1      VAL  39  -0.564 -11.090  -9.686
  295   1HG2  VAL  39          1HG2      VAL  39   1.068  -9.114  -7.934
  296   2HG2  VAL  39          2HG2      VAL  39   2.017 -10.273  -7.002
  297   3HG2  VAL  39          3HG2      VAL  39   0.283 -10.516  -7.209
  298    H    ARG  40           H        ARG  40  -0.800 -12.439  -7.916
  299    HA   ARG  40           HA       ARG  40  -1.649 -14.065 -10.192
  300   1HB   ARG  40          1HB       ARG  40  -2.209 -14.585  -7.280
  301   2HB   ARG  40          2HB       ARG  40  -3.318 -15.133  -8.524
  302   1HG   ARG  40          1HG       ARG  40  -1.760 -16.615  -9.430
  303   2HG   ARG  40          2HG       ARG  40  -0.412 -15.841  -8.594
  304   1HD   ARG  40          1HD       ARG  40  -1.246 -18.088  -7.694
  305   2HD   ARG  40          2HD       ARG  40  -0.994 -16.782  -6.540
  306    HE   ARG  40           HE       ARG  40  -3.422 -16.469  -6.527
  307   1HH1  ARG  40          1HH1      ARG  40  -2.248 -19.449  -7.938
  308   2HH1  ARG  40          2HH1      ARG  40  -3.631 -20.377  -7.434
  309   1HH2  ARG  40          1HH2      ARG  40  -5.245 -17.683  -5.857
  310   2HH2  ARG  40          2HH2      ARG  40  -5.326 -19.377  -6.243
  311    H    TRP  41           H        TRP  41  -3.467 -13.310 -11.136
  312    HA   TRP  41           HA       TRP  41  -4.914 -11.105  -9.902
  313   1HB   TRP  41          1HB       TRP  41  -5.719 -12.580 -12.414
  314   2HB   TRP  41          2HB       TRP  41  -6.202 -10.972 -11.913
  315    HD1  TRP  41           HD1      TRP  41  -4.461 -12.312 -14.567
  316    HE1  TRP  41           HE1      TRP  41  -2.569 -10.826 -15.460
  317    HE3  TRP  41           HE3      TRP  41  -3.833  -9.272 -10.504
  318    HZ2  TRP  41           HZ2      TRP  41  -1.012  -8.671 -14.567
  319    HZ3  TRP  41           HZ3      TRP  41  -2.112  -7.521 -10.619
  320    HH2  TRP  41           HH2      TRP  41  -0.733  -7.228 -12.607
  321    H    LEU  42           H        LEU  42  -5.757 -12.156  -8.057
  322    HA   LEU  42           HA       LEU  42  -6.553 -14.865  -8.083
  323   1HB   LEU  42          1HB       LEU  42  -7.753 -12.970  -6.126
  324   2HB   LEU  42          2HB       LEU  42  -7.232 -14.624  -5.891
  325    HG   LEU  42           HG       LEU  42  -5.505 -12.172  -6.068
  326   1HD1  LEU  42          1HD1      LEU  42  -6.652 -12.553  -3.974
  327   2HD1  LEU  42          2HD1      LEU  42  -4.919 -12.836  -3.807
  328   3HD1  LEU  42          3HD1      LEU  42  -6.031 -14.203  -3.919
  329   1HD2  LEU  42          1HD2      LEU  42  -4.678 -15.065  -5.882
  330   2HD2  LEU  42          2HD2      LEU  42  -3.609 -13.673  -5.694
  331   3HD2  LEU  42          3HD2      LEU  42  -4.390 -13.983  -7.245
  332    H    VAL  43           H        VAL  43  -8.670 -12.100  -7.479
  333    HA   VAL  43           HA       VAL  43 -11.041 -13.566  -7.712
  334    HB   VAL  43           HB       VAL  43 -11.993 -11.139  -8.098
  335   1HG1  VAL  43          1HG1      VAL  43 -12.252 -12.442  -6.051
  336   2HG1  VAL  43          2HG1      VAL  43 -11.860 -10.765  -5.668
  337   3HG1  VAL  43          3HG1      VAL  43 -10.615 -12.009  -5.560
  338   1HG2  VAL  43          1HG2      VAL  43  -9.838 -10.106  -8.640
  339   2HG2  VAL  43          2HG2      VAL  43  -9.211 -10.600  -7.068
  340   3HG2  VAL  43          3HG2      VAL  43 -10.517  -9.420  -7.162
  341    H    ASN  44           H        ASN  44  -9.192 -11.729 -10.046
  342    HA   ASN  44           HA       ASN  44 -10.930 -11.906 -12.229
  343   1HB   ASN  44          1HB       ASN  44  -7.910 -11.870 -12.150
  344   2HB   ASN  44          2HB       ASN  44  -8.861 -11.701 -13.624
  345   1HD2  ASN  44          1HD2      ASN  44  -7.892 -10.198 -10.646
  346   2HD2  ASN  44          2HD2      ASN  44  -8.456  -8.610 -11.034
  347    H    GLY  45           H        GLY  45  -8.425 -14.145 -11.101
  348   1HA   GLY  45          1HA       GLY  45  -8.806 -16.518 -11.190
  349   2HA   GLY  45          2HA       GLY  45  -9.741 -16.274 -12.658
  350    H    HIS  46           H        HIS  46  -6.526 -14.949 -11.877
  351    HA   HIS  46           HA       HIS  46  -5.357 -16.733 -13.893
  352   1HB   HIS  46          1HB       HIS  46  -5.141 -13.719 -13.954
  353   2HB   HIS  46          2HB       HIS  46  -4.120 -14.796 -14.898
  354    HD1  HIS  46           HD1      HIS  46  -7.355 -13.097 -14.940
  355    HD2  HIS  46           HD2      HIS  46  -5.597 -16.320 -16.885
  356    HE1  HIS  46           HE1      HIS  46  -8.803 -13.548 -16.942
  357    HE2  HIS  46           HE2      HIS  46  -7.641 -15.403 -18.186
  358    H    GLU  47           H        GLU  47  -2.912 -16.388 -14.010
  359    HA   GLU  47           HA       GLU  47  -1.728 -15.568 -11.451
  360   1HB   GLU  47          1HB       GLU  47  -1.235 -18.234 -12.812
  361   2HB   GLU  47          2HB       GLU  47  -0.267 -17.601 -11.487
  362   1HG   GLU  47          1HG       GLU  47  -2.307 -17.565 -10.083
  363   2HG   GLU  47          2HG       GLU  47  -3.182 -18.330 -11.401
  364    H    THR  48           H        THR  48   0.228 -14.530 -11.712
  365    HA   THR  48           HA       THR  48   1.035 -14.096 -14.505
  366    HB   THR  48           HB       THR  48   0.567 -11.659 -12.911
  367    HG1  THR  48           HG1      THR  48  -1.722 -12.812 -14.054
  368   1HG2  THR  48          1HG2      THR  48  -0.387 -10.864 -15.027
  369   2HG2  THR  48          2HG2      THR  48  -0.210 -12.479 -15.713
  370   3HG2  THR  48          3HG2      THR  48   1.221 -11.549 -15.266
  371    H    THR  49           H        THR  49   2.731 -12.310 -14.595
  372    HA   THR  49           HA       THR  49   4.296 -11.896 -12.153
  373    HB   THR  49           HB       THR  49   5.512 -12.484 -14.875
  374    HG1  THR  49           HG1      THR  49   4.833 -14.112 -12.778
  375   1HG2  THR  49          1HG2      THR  49   7.668 -12.389 -13.701
  376   2HG2  THR  49          2HG2      THR  49   6.838 -11.967 -12.203
  377   3HG2  THR  49          3HG2      THR  49   6.809 -10.854 -13.571
  378    H    VAL  50           H        VAL  50   4.752  -9.666 -11.944
  379    HA   VAL  50           HA       VAL  50   3.837  -8.039 -14.215
  380    HB   VAL  50           HB       VAL  50   1.888  -8.722 -12.754
  381   1HG1  VAL  50          1HG1      VAL  50   1.553  -7.487 -10.664
  382   2HG1  VAL  50          2HG1      VAL  50   3.187  -6.839 -10.797
  383   3HG1  VAL  50          3HG1      VAL  50   2.942  -8.573 -10.586
  384   1HG2  VAL  50          1HG2      VAL  50   0.845  -6.506 -12.804
  385   2HG2  VAL  50          2HG2      VAL  50   1.739  -6.843 -14.286
  386   3HG2  VAL  50          3HG2      VAL  50   2.427  -5.771 -13.067
  387    H    TYR  51           H        TYR  51   4.020  -5.723 -13.830
  388    HA   TYR  51           HA       TYR  51   5.987  -4.888 -11.824
  389   1HB   TYR  51          1HB       TYR  51   6.196  -3.689 -14.552
  390   2HB   TYR  51          2HB       TYR  51   7.451  -3.958 -13.354
  391    HD1  TYR  51           HD1      TYR  51   8.686  -6.054 -13.300
  392    HD2  TYR  51           HD2      TYR  51   5.567  -5.434 -16.126
  393    HE1  TYR  51           HE1      TYR  51   9.459  -8.008 -14.579
  394    HE2  TYR  51           HE2      TYR  51   6.327  -7.389 -17.404
  395    HH   TYR  51           HH       TYR  51   8.658  -9.600 -16.169
  396    HA   PRO  52           HA       PRO  52   2.374  -2.067 -11.768
  397   1HB   PRO  52          1HB       PRO  52   2.858  -1.150  -9.256
  398   2HB   PRO  52          2HB       PRO  52   2.050  -2.688  -9.575
  399   1HG   PRO  52          1HG       PRO  52   4.905  -2.162  -8.846
  400   2HG   PRO  52          2HG       PRO  52   3.810  -3.421  -8.243
  401   1HD   PRO  52          1HD       PRO  52   5.681  -3.902 -10.143
  402   2HD   PRO  52          2HD       PRO  52   4.128  -4.758 -10.091
  403    H    GLY  53           H        GLY  53   2.791  -0.284 -13.015
  404   1HA   GLY  53          1HA       GLY  53   5.171   1.298 -12.724
  405   2HA   GLY  53          2HA       GLY  53   3.809   1.647 -13.779
  406    H    SER  54           H        SER  54   5.032   1.932 -10.497
  407    HA   SER  54           HA       SER  54   4.009   4.470  -9.965
  408   1HB   SER  54          1HB       SER  54   1.791   3.403 -10.071
  409   2HB   SER  54          2HB       SER  54   2.299   2.193  -8.901
  410    HG   SER  54           HG       SER  54   2.302   4.968  -8.302
  411    H    ASP  55           H        ASP  55   3.949   4.756  -7.389
  412    HA   ASP  55           HA       ASP  55   6.282   3.559  -6.254
  413   1HB   ASP  55          1HB       ASP  55   5.443   5.798  -5.554
  414   2HB   ASP  55          2HB       ASP  55   4.040   5.018  -4.831
  415    H    ALA  56           H        ALA  56   3.034   2.648  -6.634
  416    HA   ALA  56           HA       ALA  56   2.113   0.598  -6.423
  417   1HB   ALA  56          1HB       ALA  56   4.332  -0.428  -6.598
  418   2HB   ALA  56          2HB       ALA  56   3.296  -1.297  -5.464
  419   3HB   ALA  56          3HB       ALA  56   4.563  -0.228  -4.860
  420    H    VAL  57           H        VAL  57   1.054  -0.724  -4.679
  421    HA   VAL  57           HA       VAL  57   0.824   0.739  -2.144
  422    HB   VAL  57           HB       VAL  57  -1.604  -0.047  -3.787
  423   1HG1  VAL  57          1HG1      VAL  57  -2.040   0.012  -1.405
  424   2HG1  VAL  57          2HG1      VAL  57  -2.842   1.367  -2.204
  425   3HG1  VAL  57          3HG1      VAL  57  -1.351   1.632  -1.297
  426   1HG2  VAL  57          1HG2      VAL  57  -1.950   2.345  -4.209
  427   2HG2  VAL  57          2HG2      VAL  57  -0.461   1.751  -4.942
  428   3HG2  VAL  57          3HG2      VAL  57  -0.395   2.694  -3.454
  429    H    VAL  58           H        VAL  58  -0.669  -0.585  -0.631
  430    HA   VAL  58           HA       VAL  58  -0.381  -3.473  -1.099
  431    HB   VAL  58           HB       VAL  58   0.392  -2.120   1.497
  432   1HG1  VAL  58          1HG1      VAL  58   1.288  -4.325   2.091
  433   2HG1  VAL  58          2HG1      VAL  58   0.675  -4.976   0.571
  434   3HG1  VAL  58          3HG1      VAL  58  -0.448  -4.372   1.789
  435   1HG2  VAL  58          1HG2      VAL  58   2.707  -2.668   0.970
  436   2HG2  VAL  58          2HG2      VAL  58   2.025  -1.574  -0.233
  437   3HG2  VAL  58          3HG2      VAL  58   2.211  -3.288  -0.606
  438    H    VAL  59           H        VAL  59  -2.159  -4.539  -0.537
  439    HA   VAL  59           HA       VAL  59  -4.103  -3.314   1.252
  440    HB   VAL  59           HB       VAL  59  -5.697  -4.370  -0.606
  441   1HG1  VAL  59          1HG1      VAL  59  -4.521  -1.603  -0.748
  442   2HG1  VAL  59          2HG1      VAL  59  -5.847  -2.100   0.303
  443   3HG1  VAL  59          3HG1      VAL  59  -6.062  -2.103  -1.448
  444   1HG2  VAL  59          1HG2      VAL  59  -4.887  -3.752  -2.833
  445   2HG2  VAL  59          2HG2      VAL  59  -3.916  -5.020  -2.085
  446   3HG2  VAL  59          3HG2      VAL  59  -3.322  -3.361  -2.126
  447    H    THR  60           H        THR  60  -6.001  -4.946   1.419
  448    HA   THR  60           HA       THR  60  -4.834  -7.619   1.916
  449    HB   THR  60           HB       THR  60  -6.506  -7.666   3.841
  450    HG1  THR  60           HG1      THR  60  -7.777  -6.011   4.121
  451   1HG2  THR  60          1HG2      THR  60  -4.126  -7.249   4.210
  452   2HG2  THR  60          2HG2      THR  60  -5.116  -6.305   5.324
  453   3HG2  THR  60          3HG2      THR  60  -4.381  -5.527   3.923
  454    H    ALA  61           H        ALA  61  -7.176  -8.884   2.716
  455    HA   ALA  61           HA       ALA  61  -8.065  -9.905   0.316
  456   1HB   ALA  61          1HB       ALA  61  -8.105 -11.114   2.434
  457   2HB   ALA  61          2HB       ALA  61  -9.666 -11.172   1.616
  458   3HB   ALA  61          3HB       ALA  61  -9.431 -10.091   2.988
  459    H    THR  62           H        THR  62  -9.830  -7.582   2.431
  460    HA   THR  62           HA       THR  62 -12.263  -7.748   1.040
  461    HB   THR  62           HB       THR  62 -12.353  -5.206   1.844
  462    HG1  THR  62           HG1      THR  62 -10.646  -4.736   2.966
  463   1HG2  THR  62          1HG2      THR  62 -13.348  -6.035   3.917
  464   2HG2  THR  62          2HG2      THR  62 -12.646  -7.625   3.605
  465   3HG2  THR  62          3HG2      THR  62 -13.868  -6.971   2.514
  466    H    GLU  63           H        GLU  63  -9.704  -5.347   0.754
  467    HA   GLU  63           HA       GLU  63 -10.835  -3.782  -1.253
  468   1HB   GLU  63          1HB       GLU  63  -7.876  -4.200  -1.222
  469   2HB   GLU  63          2HB       GLU  63  -8.783  -2.707  -1.378
  470   1HG   GLU  63          1HG       GLU  63  -8.325  -4.272   1.156
  471   2HG   GLU  63          2HG       GLU  63  -7.577  -2.746   0.708
  472    H    HIS  64           H        HIS  64  -9.127  -6.763  -1.334
  473    HA   HIS  64           HA       HIS  64  -8.214  -6.823  -3.942
  474   1HB   HIS  64          1HB       HIS  64  -7.287  -8.652  -3.132
  475   2HB   HIS  64          2HB       HIS  64  -8.295  -8.526  -1.706
  476    HD1  HIS  64           HD1      HIS  64 -10.359 -10.084  -1.572
  477    HD2  HIS  64           HD2      HIS  64  -7.943 -10.706  -4.894
  478    HE1  HIS  64           HE1      HIS  64 -10.980 -12.356  -2.438
  479    HE2  HIS  64           HE2      HIS  64  -9.359 -12.795  -4.309
  480    H    ALA  65           H        ALA  65 -11.493  -7.647  -2.793
  481    HA   ALA  65           HA       ALA  65 -12.143  -9.347  -4.931
  482   1HB   ALA  65          1HB       ALA  65 -13.435  -9.205  -2.855
  483   2HB   ALA  65          2HB       ALA  65 -14.459  -8.979  -4.274
  484   3HB   ALA  65          3HB       ALA  65 -13.973  -7.587  -3.304
  485    H    GLU  66           H        GLU  66 -13.592  -6.230  -4.443
  486    HA   GLU  66           HA       GLU  66 -14.459  -5.794  -7.060
  487   1HB   GLU  66          1HB       GLU  66 -14.277  -3.272  -6.001
  488   2HB   GLU  66          2HB       GLU  66 -15.619  -4.382  -5.755
  489   1HG   GLU  66          1HG       GLU  66 -14.529  -5.182  -3.673
  490   2HG   GLU  66          2HG       GLU  66 -13.256  -3.984  -3.907
  491    H    ALA  67           H        ALA  67 -11.803  -4.208  -5.364
  492    HA   ALA  67           HA       ALA  67 -10.945  -2.616  -7.459
  493   1HB   ALA  67          1HB       ALA  67 -10.302  -2.224  -5.140
  494   2HB   ALA  67          2HB       ALA  67  -8.888  -2.306  -6.191
  495   3HB   ALA  67          3HB       ALA  67  -9.306  -3.680  -5.166
  496    H    GLU  68           H        GLU  68  -9.551  -5.738  -6.366
  497    HA   GLU  68           HA       GLU  68  -7.516  -5.765  -8.277
  498   1HB   GLU  68          1HB       GLU  68  -7.503  -7.215  -6.318
  499   2HB   GLU  68          2HB       GLU  68  -8.849  -8.128  -6.976
  500   1HG   GLU  68          1HG       GLU  68  -7.468  -8.863  -8.829
  501   2HG   GLU  68          2HG       GLU  68  -6.115  -7.915  -8.202
  502    H    LYS  69           H        LYS  69 -10.883  -6.908  -8.541
  503    HA   LYS  69           HA       LYS  69 -10.577  -8.219 -10.995
  504   1HB   LYS  69          1HB       LYS  69 -12.907  -6.653  -9.900
  505   2HB   LYS  69          2HB       LYS  69 -12.979  -7.505 -11.436
  506   1HG   LYS  69          1HG       LYS  69 -12.424  -9.606 -10.251
  507   2HG   LYS  69          2HG       LYS  69 -12.493  -8.722  -8.724
  508   1HD   LYS  69          1HD       LYS  69 -14.589  -9.850  -9.075
  509   2HD   LYS  69          2HD       LYS  69 -14.839  -8.113  -9.241
  510   1HE   LYS  69          1HE       LYS  69 -16.040  -9.296 -10.976
  511   2HE   LYS  69          2HE       LYS  69 -14.731  -8.354 -11.687
  512   1HZ   LYS  69          1HZ       LYS  69 -14.975 -10.654 -12.580
  513   2HZ   LYS  69          2HZ       LYS  69 -14.517 -11.249 -11.059
  514   3HZ   LYS  69          3HZ       LYS  69 -13.435 -10.317 -11.965
  515    H    ARG  70           H        ARG  70 -11.733  -4.832 -10.588
  516    HA   ARG  70           HA       ARG  70 -11.498  -4.182 -13.345
  517   1HB   ARG  70          1HB       ARG  70 -11.196  -2.325 -10.976
  518   2HB   ARG  70          2HB       ARG  70 -11.522  -1.829 -12.629
  519   1HG   ARG  70          1HG       ARG  70 -13.671  -3.011 -12.544
  520   2HG   ARG  70          2HG       ARG  70 -13.342  -3.458 -10.868
  521   1HD   ARG  70          1HD       ARG  70 -13.185  -1.054 -10.305
  522   2HD   ARG  70          2HD       ARG  70 -13.622  -0.664 -11.967
  523    HE   ARG  70           HE       ARG  70 -15.525  -2.379 -10.654
  524   1HH1  ARG  70          1HH1      ARG  70 -14.560   0.930 -11.248
  525   2HH1  ARG  70          2HH1      ARG  70 -16.123   1.593 -10.890
  526   1HH2  ARG  70          1HH2      ARG  70 -17.577  -1.511 -10.152
  527   2HH2  ARG  70          2HH2      ARG  70 -17.834   0.202 -10.243
  528    H    ALA  71           H        ALA  71  -9.351  -3.573 -10.692
  529    HA   ALA  71           HA       ALA  71  -7.404  -2.083 -11.950
  530   1HB   ALA  71          1HB       ALA  71  -6.077  -2.533  -9.976
  531   2HB   ALA  71          2HB       ALA  71  -7.158  -3.859  -9.538
  532   3HB   ALA  71          3HB       ALA  71  -7.756  -2.198  -9.552
  533    H    ALA  72           H        ALA  72  -7.460  -5.640 -11.395
  534    HA   ALA  72           HA       ALA  72  -4.845  -6.012 -12.461
  535   1HB   ALA  72          1HB       ALA  72  -5.867  -7.679 -10.997
  536   2HB   ALA  72          2HB       ALA  72  -5.351  -8.380 -12.531
  537   3HB   ALA  72          3HB       ALA  72  -7.058  -8.041 -12.245
  538    H    ALA  73           H        ALA  73  -8.083  -6.035 -13.849
  539    HA   ALA  73           HA       ALA  73  -7.500  -6.950 -16.398
  540   1HB   ALA  73          1HB       ALA  73  -9.366  -4.694 -15.670
  541   2HB   ALA  73          2HB       ALA  73  -9.766  -6.412 -15.654
  542   3HB   ALA  73          3HB       ALA  73  -9.383  -5.610 -17.177
  543    H    ARG  74           H        ARG  74  -6.991  -3.710 -14.999
  544    HA   ARG  74           HA       ARG  74  -5.695  -2.790 -17.429
  545   1HB   ARG  74          1HB       ARG  74  -5.958  -1.621 -14.692
  546   2HB   ARG  74          2HB       ARG  74  -4.922  -0.886 -15.904
  547   1HG   ARG  74          1HG       ARG  74  -7.028  -0.943 -17.399
  548   2HG   ARG  74          2HG       ARG  74  -7.894  -1.154 -15.875
  549   1HD   ARG  74          1HD       ARG  74  -7.813   1.191 -16.409
  550   2HD   ARG  74          2HD       ARG  74  -6.783   0.885 -15.012
  551    HE   ARG  74           HE       ARG  74  -5.878   1.501 -17.746
  552   1HH1  ARG  74          1HH1      ARG  74  -5.140   0.993 -14.346
  553   2HH1  ARG  74          2HH1      ARG  74  -3.552   1.696 -14.469
  554   1HH2  ARG  74          1HH2      ARG  74  -3.766   2.389 -17.899
  555   2HH2  ARG  74          2HH2      ARG  74  -2.765   2.477 -16.475
  556    H    ALA  75           H        ALA  75  -4.447  -3.786 -14.233
  557    HA   ALA  75           HA       ALA  75  -1.757  -3.159 -14.434
  558   1HB   ALA  75          1HB       ALA  75  -2.930  -5.667 -13.229
  559   2HB   ALA  75          2HB       ALA  75  -2.802  -4.098 -12.434
  560   3HB   ALA  75          3HB       ALA  75  -1.343  -4.983 -12.880
  561    H    GLY  76           H        GLY  76  -3.289  -6.220 -15.506
  562   1HA   GLY  76          1HA       GLY  76  -0.800  -6.955 -16.874
  563   2HA   GLY  76          2HA       GLY  76  -2.199  -7.991 -16.641
  564    H    HIS  77           H        HIS  77  -2.287  -4.719 -17.869
  565    HA   HIS  77           HA       HIS  77  -2.964  -5.742 -20.550
  566   1HB   HIS  77          1HB       HIS  77  -4.987  -5.020 -19.273
  567   2HB   HIS  77          2HB       HIS  77  -4.284  -3.415 -19.127
  568    HD1  HIS  77           HD1      HIS  77  -4.544  -1.842 -21.092
  569    HD2  HIS  77           HD2      HIS  77  -5.858  -5.707 -21.892
  570    HE1  HIS  77           HE1      HIS  77  -5.790  -1.698 -23.272
  571    HE2  HIS  77           HE2      HIS  77  -6.785  -3.994 -23.591
  572    H    ALA  78           H        ALA  78  -1.984  -2.914 -18.638
  573    HA   ALA  78           HA       ALA  78  -0.837  -1.630 -20.978
  574   1HB   ALA  78          1HB       ALA  78  -0.379   0.231 -19.481
  575   2HB   ALA  78          2HB       ALA  78  -0.864  -0.745 -18.095
  576   3HB   ALA  78          3HB       ALA  78  -2.053  -0.300 -19.319
  577    H    ALA  79           H        ALA  79   0.162  -3.976 -18.906
  578    HA   ALA  79           HA       ALA  79   2.822  -3.120 -18.331
  579   1HB   ALA  79          1HB       ALA  79   1.668  -4.746 -16.920
  580   2HB   ALA  79          2HB       ALA  79   3.172  -5.413 -17.559
  581   3HB   ALA  79          3HB       ALA  79   1.624  -5.889 -18.263
  582    H    THR  80           H        THR  80   4.571  -3.236 -19.541
  583    HA   THR  80           HA       THR  80   4.458  -4.794 -22.030
  584    HB   THR  80           HB       THR  80   4.869  -2.483 -22.524
  585    HG1  THR  80           HG1      THR  80   6.832  -4.358 -22.945
  586   1HG2  THR  80          1HG2      THR  80   5.661  -1.729 -20.341
  587   2HG2  THR  80          2HG2      THR  80   6.763  -1.224 -21.623
  588   3HG2  THR  80          3HG2      THR  80   7.180  -2.591 -20.588