*HEADER    DNA BINDING PROTEIN                     31-JAN-17   5UNK              
*TITLE     NMR STRUCTURE OF THE RED SUBDOMAIN OF THE SLEEPING BEAUTY TRANSPOSASE 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UNCHARACTERIZED PROTEIN;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ONCORHYNCHUS MYKISS;                            
*SOURCE   3 ORGANISM_COMMON: RAINBOW TROUT;                                      
*SOURCE   4 ORGANISM_TAXID: 8022;                                                
*SOURCE   5 GENE: GSONMT00020475001;                                             
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    HELICAL, HELIX-TURN-HELIX, DNA-BINDING, TRANSPOSASE, DNA BINDING      
*KEYWDS   2 PROTEIN                                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    T.A.KONNOVA,C.M.SINGER,I.V.NESMELOVA                                  
*REVDAT   1   07-JUN-17 5UNK    0                                                
# Restraints file 1: red_dihe.tbl
assign (resid    5 and name C    ) (resid    6 and name N    )
       (resid    6 and name CA   ) (resid    6 and name C    )    1.0  -87.5   58.3 2
assign (resid    6 and name N    ) (resid    6 and name CA   )
       (resid    6 and name C    ) (resid    7 and name N    )    1.0  143.7   36.5 2
assign (resid    6 and name C    ) (resid    7 and name N    )
       (resid    7 and name CA   ) (resid    7 and name C    )    1.0  -57.6   20.8 2
assign (resid    7 and name N    ) (resid    7 and name CA   )
       (resid    7 and name C    ) (resid    8 and name N    )    1.0  -31.6   20.0 2
assign (resid    7 and name C    ) (resid    8 and name N    )
       (resid    8 and name CA   ) (resid    8 and name C    )    1.0  -74.8   30.4 2
assign (resid    8 and name N    ) (resid    8 and name CA   )
       (resid    8 and name C    ) (resid    9 and name N    )    1.0  -26.1   35.1 2
assign (resid    8 and name C    ) (resid    9 and name N    )
       (resid    9 and name CA   ) (resid    9 and name C    )    1.0  -66.7   20.0 2
assign (resid    9 and name N    ) (resid    9 and name CA   )
       (resid    9 and name C    ) (resid   10 and name N    )    1.0  -38.5   20.0 2
assign (resid    9 and name C    ) (resid   10 and name N    )
       (resid   10 and name CA   ) (resid   10 and name C    )    1.0  -62.7   20.0 2
assign (resid   10 and name N    ) (resid   10 and name CA   )
       (resid   10 and name C    ) (resid   11 and name N    )    1.0  -41.9   20.0 2
assign (resid   10 and name C    ) (resid   11 and name N    )
       (resid   11 and name CA   ) (resid   11 and name C    )    1.0  -68.4   20.0 2
assign (resid   11 and name N    ) (resid   11 and name CA   )
       (resid   11 and name C    ) (resid   12 and name N    )    1.0  -49.0   36.0 2
assign (resid   11 and name C    ) (resid   12 and name N    )
       (resid   12 and name CA   ) (resid   12 and name C    )    1.0  -67.6   28.3 2
assign (resid   12 and name N    ) (resid   12 and name CA   )
       (resid   12 and name C    ) (resid   13 and name N    )    1.0  -45.5   28.6 2
assign (resid   12 and name C    ) (resid   13 and name N    )
       (resid   13 and name CA   ) (resid   13 and name C    )    1.0  -63.1   20.0 2
assign (resid   13 and name N    ) (resid   13 and name CA   )
       (resid   13 and name C    ) (resid   14 and name N    )    1.0  -44.6   20.0 2
assign (resid   13 and name C    ) (resid   14 and name N    )
       (resid   14 and name CA   ) (resid   14 and name C    )    1.0  -66.8   20.0 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
       (resid   14 and name C    ) (resid   15 and name N    )    1.0  -42.5   20.0 2
assign (resid   14 and name C    ) (resid   15 and name N    )
       (resid   15 and name CA   ) (resid   15 and name C    )    1.0  -64.7   20.0 2
assign (resid   15 and name N    ) (resid   15 and name CA   )
       (resid   15 and name C    ) (resid   16 and name N    )    1.0  -49.2   20.0 2
assign (resid   15 and name C    ) (resid   16 and name N    )
       (resid   16 and name CA   ) (resid   16 and name C    )    1.0  -65.9   21.8 2
assign (resid   16 and name N    ) (resid   16 and name CA   )
       (resid   16 and name C    ) (resid   17 and name N    )    1.0  -43.8   24.8 2
assign (resid   16 and name C    ) (resid   17 and name N    )
       (resid   17 and name CA   ) (resid   17 and name C    )    1.0  -69.2   21.9 2
assign (resid   17 and name N    ) (resid   17 and name CA   )
       (resid   17 and name C    ) (resid   18 and name N    )    1.0  -40.0   20.0 2
assign (resid   17 and name C    ) (resid   18 and name N    )
       (resid   18 and name CA   ) (resid   18 and name C    )    1.0  -63.5   20.0 2
assign (resid   18 and name N    ) (resid   18 and name CA   )
       (resid   18 and name C    ) (resid   19 and name N    )    1.0  -40.0   20.0 2
assign (resid   18 and name C    ) (resid   19 and name N    )
       (resid   19 and name CA   ) (resid   19 and name C    )    1.0  -59.8   25.1 2
assign (resid   19 and name N    ) (resid   19 and name CA   )
       (resid   19 and name C    ) (resid   20 and name N    )    1.0  -44.5   31.7 2
assign (resid   19 and name C    ) (resid   20 and name N    )
       (resid   20 and name CA   ) (resid   20 and name C    )    1.0 -127.5   35.0 2
assign (resid   20 and name N    ) (resid   20 and name CA   )
       (resid   20 and name C    ) (resid   21 and name N    )    1.0   81.7   34.4 2
assign (resid   21 and name C    ) (resid   22 and name N    )
       (resid   22 and name CA   ) (resid   22 and name C    )    1.0  -88.9   20.0 2
assign (resid   22 and name N    ) (resid   22 and name CA   )
       (resid   22 and name C    ) (resid   23 and name N    )    1.0   -2.1   20.1 2
assign (resid   23 and name C    ) (resid   24 and name N    )
       (resid   24 and name CA   ) (resid   24 and name C    )    1.0  -91.4   38.9 2
assign (resid   24 and name N    ) (resid   24 and name CA   )
       (resid   24 and name C    ) (resid   25 and name N    )    1.0  161.6   20.0 2
assign (resid   24 and name C    ) (resid   25 and name N    )
       (resid   25 and name CA   ) (resid   25 and name C    )    1.0  -59.3   20.0 2
assign (resid   25 and name N    ) (resid   25 and name CA   )
       (resid   25 and name C    ) (resid   26 and name N    )    1.0  -49.4   20.0 2
assign (resid   25 and name C    ) (resid   26 and name N    )
       (resid   26 and name CA   ) (resid   26 and name C    )    1.0  -62.7   20.0 2
assign (resid   26 and name N    ) (resid   26 and name CA   )
       (resid   26 and name C    ) (resid   27 and name N    )    1.0  -42.4   20.0 2
assign (resid   26 and name C    ) (resid   27 and name N    )
       (resid   27 and name CA   ) (resid   27 and name C    )    1.0  -64.0   20.0 2
assign (resid   27 and name N    ) (resid   27 and name CA   )
       (resid   27 and name C    ) (resid   28 and name N    )    1.0  -43.7   20.0 2
assign (resid   27 and name C    ) (resid   28 and name N    )
       (resid   28 and name CA   ) (resid   28 and name C    )    1.0  -65.7   20.0 2
assign (resid   28 and name N    ) (resid   28 and name CA   )
       (resid   28 and name C    ) (resid   29 and name N    )    1.0  -42.1   20.0 2
assign (resid   28 and name C    ) (resid   29 and name N    )
       (resid   29 and name CA   ) (resid   29 and name C    )    1.0  -62.1   20.0 2
assign (resid   29 and name N    ) (resid   29 and name CA   )
       (resid   29 and name C    ) (resid   30 and name N    )    1.0  -44.5   20.0 2
assign (resid   29 and name C    ) (resid   30 and name N    )
       (resid   30 and name CA   ) (resid   30 and name C    )    1.0  -65.7   20.0 2
assign (resid   30 and name N    ) (resid   30 and name CA   )
       (resid   30 and name C    ) (resid   31 and name N    )    1.0  -48.3   24.1 2
assign (resid   30 and name C    ) (resid   31 and name N    )
       (resid   31 and name CA   ) (resid   31 and name C    )    1.0  -66.7   20.0 2
assign (resid   31 and name N    ) (resid   31 and name CA   )
       (resid   31 and name C    ) (resid   32 and name N    )    1.0  -40.2   20.0 2
assign (resid   31 and name C    ) (resid   32 and name N    )
       (resid   32 and name CA   ) (resid   32 and name C    )    1.0  -67.2   20.0 2
assign (resid   32 and name N    ) (resid   32 and name CA   )
       (resid   32 and name C    ) (resid   33 and name N    )    1.0  -46.6   20.0 2
assign (resid   32 and name C    ) (resid   33 and name N    )
       (resid   33 and name CA   ) (resid   33 and name C    )    1.0  -63.8   20.0 2
assign (resid   33 and name N    ) (resid   33 and name CA   )
       (resid   33 and name C    ) (resid   34 and name N    )    1.0  -41.7   20.0 2
assign (resid   33 and name C    ) (resid   34 and name N    )
       (resid   34 and name CA   ) (resid   34 and name C    )    1.0  -69.8   20.0 2
assign (resid   34 and name N    ) (resid   34 and name CA   )
       (resid   34 and name C    ) (resid   35 and name N    )    1.0  -43.8   26.8 2
assign (resid   34 and name C    ) (resid   35 and name N    )
       (resid   35 and name CA   ) (resid   35 and name C    )    1.0  -96.1   20.0 2
assign (resid   35 and name N    ) (resid   35 and name CA   )
       (resid   35 and name C    ) (resid   36 and name N    )    1.0    0.3   30.4 2
assign (resid   35 and name C    ) (resid   36 and name N    )
       (resid   36 and name CA   ) (resid   36 and name C    )    1.0   84.3   20.0 2
assign (resid   36 and name N    ) (resid   36 and name CA   )
       (resid   36 and name C    ) (resid   37 and name N    )    1.0    3.6   33.3 2
assign (resid   36 and name C    ) (resid   37 and name N    )
       (resid   37 and name CA   ) (resid   37 and name C    )    1.0  -92.2   46.1 2
assign (resid   37 and name N    ) (resid   37 and name CA   )
       (resid   37 and name C    ) (resid   38 and name N    )    1.0  135.1   28.9 2
assign (resid   37 and name C    ) (resid   38 and name N    )
       (resid   38 and name CA   ) (resid   38 and name C    )    1.0  -95.6   39.4 2
assign (resid   38 and name N    ) (resid   38 and name CA   )
       (resid   38 and name C    ) (resid   39 and name N    )    1.0  128.7   39.3 2
assign (resid   38 and name C    ) (resid   39 and name N    )
       (resid   39 and name CA   ) (resid   39 and name C    )    1.0 -125.8   26.9 2
assign (resid   39 and name N    ) (resid   39 and name CA   )
       (resid   39 and name C    ) (resid   40 and name N    )    1.0  156.7   20.6 2
assign (resid   39 and name C    ) (resid   40 and name N    )
       (resid   40 and name CA   ) (resid   40 and name C    )    1.0  -84.9   20.0 2
assign (resid   40 and name N    ) (resid   40 and name CA   )
       (resid   40 and name C    ) (resid   41 and name N    )    1.0  167.6   20.0 2
assign (resid   40 and name C    ) (resid   41 and name N    )
       (resid   41 and name CA   ) (resid   41 and name C    )    1.0  -57.4   20.0 2
assign (resid   41 and name N    ) (resid   41 and name CA   )
       (resid   41 and name C    ) (resid   42 and name N    )    1.0  -40.3   20.0 2
assign (resid   41 and name C    ) (resid   42 and name N    )
       (resid   42 and name CA   ) (resid   42 and name C    )    1.0  -63.8   20.0 2
assign (resid   42 and name N    ) (resid   42 and name CA   )
       (resid   42 and name C    ) (resid   43 and name N    )    1.0  -37.0   20.0 2
assign (resid   42 and name C    ) (resid   43 and name N    )
       (resid   43 and name CA   ) (resid   43 and name C    )    1.0  -67.7   20.0 2
assign (resid   43 and name N    ) (resid   43 and name CA   )
       (resid   43 and name C    ) (resid   44 and name N    )    1.0  -41.1   20.0 2
assign (resid   43 and name C    ) (resid   44 and name N    )
       (resid   44 and name CA   ) (resid   44 and name C    )    1.0  -64.1   20.0 2
assign (resid   44 and name N    ) (resid   44 and name CA   )
       (resid   44 and name C    ) (resid   45 and name N    )    1.0  -43.8   20.0 2
assign (resid   44 and name C    ) (resid   45 and name N    )
       (resid   45 and name CA   ) (resid   45 and name C    )    1.0  -60.8   20.0 2
assign (resid   45 and name N    ) (resid   45 and name CA   )
       (resid   45 and name C    ) (resid   46 and name N    )    1.0  -40.1   20.0 2
assign (resid   45 and name C    ) (resid   46 and name N    )
       (resid   46 and name CA   ) (resid   46 and name C    )    1.0  -63.4   20.0 2
assign (resid   46 and name N    ) (resid   46 and name CA   )
       (resid   46 and name C    ) (resid   47 and name N    )    1.0  -42.5   20.0 2
assign (resid   46 and name C    ) (resid   47 and name N    )
       (resid   47 and name CA   ) (resid   47 and name C    )    1.0  -64.0   20.0 2
assign (resid   47 and name N    ) (resid   47 and name CA   )
       (resid   47 and name C    ) (resid   48 and name N    )    1.0  -40.2   20.0 2
assign (resid   47 and name C    ) (resid   48 and name N    )
       (resid   48 and name CA   ) (resid   48 and name C    )    1.0  -58.4   21.2 2
assign (resid   48 and name N    ) (resid   48 and name CA   )
       (resid   48 and name C    ) (resid   49 and name N    )    1.0  -45.4   23.2 2
assign (resid   48 and name C    ) (resid   49 and name N    )
       (resid   49 and name CA   ) (resid   49 and name C    )    1.0  -59.6   28.4 2
assign (resid   49 and name N    ) (resid   49 and name CA   )
       (resid   49 and name C    ) (resid   50 and name N    )    1.0  -46.2   20.6 2
assign (resid   52 and name C    ) (resid   53 and name N    )
       (resid   53 and name CA   ) (resid   53 and name C    )    1.0  -55.8   41.0 2
assign (resid   53 and name N    ) (resid   53 and name CA   )
       (resid   53 and name C    ) (resid   54 and name N    )    1.0  -45.0   43.4 2
assign (resid   53 and name C    ) (resid   54 and name N    )
       (resid   54 and name CA   ) (resid   54 and name C    )    1.0  -54.4   40.3 2
assign (resid   54 and name N    ) (resid   54 and name CA   )
       (resid   54 and name C    ) (resid   55 and name N    )    1.0   49.3   41.3 2
assign (resid   54 and name C    ) (resid   55 and name N    )
       (resid   55 and name CA   ) (resid   55 and name C    )    1.0  -83.5   70.0 2
assign (resid   55 and name N    ) (resid   55 and name CA   )
       (resid   55 and name C    ) (resid   56 and name N    )    1.0  157.6   53.3 2
# Restraints file 2: red_noe.tbl
REMARK NOE RED FILE

! SET ECHO=OFF MESSAGE=OFF END

! hbonds

! helix 1

assign (resid 15 and name   O ) (resid 19 and name   HN )  2.15 0.35 0.55
assign (resid 15 and name   O ) (resid 19 and name    N )  2.90 0.40 0.60
assign (resid 14 and name   O ) (resid 18 and name   HN )  2.15 0.35 0.55
assign (resid 14 and name   O ) (resid 18 and name    N )  2.90 0.40 0.60
assign (resid 13 and name   O ) (resid 17 and name   HN )  2.15 0.35 0.55
assign (resid 13 and name   O ) (resid 17 and name    N )  2.90 0.40 0.60
assign (resid 12 and name   O ) (resid 16 and name   HN )  2.15 0.35 0.55
assign (resid 12 and name   O ) (resid 16 and name    N )  2.90 0.40 0.60
assign (resid 11 and name   O ) (resid 15 and name   HN )  2.15 0.35 0.55
assign (resid 11 and name   O ) (resid 15 and name    N )  2.90 0.40 0.60
assign (resid 10 and name   O ) (resid 14 and name   HN )  2.15 0.35 0.55
assign (resid 10 and name   O ) (resid 14 and name    N )  2.90 0.40 0.60
assign (resid 9 and name    O ) (resid 13 and name   HN )  2.15 0.35 0.55
assign (resid 9 and name    O ) (resid 13 and name    N )  2.90 0.40 0.60
assign (resid 8 and name    O ) (resid 12 and name   HN )  2.15 0.35 0.55
assign (resid 8 and name    O ) (resid 12 and name    N )  2.90 0.40 0.60


! helix 2
!assign (resid 31 and name   O ) (resid 35 and name   HN )  2.15 0.35 0.55
!assign (resid 31 and name   O ) (resid 35 and name    N )  2.90 0.40 0.60
assign (resid 30 and name   O ) (resid 34 and name   HN )  2.15 0.35 0.55
assign (resid 30 and name   O ) (resid 34 and name    N )  2.90 0.40 0.60
assign (resid 29 and name   O ) (resid 33 and name   HN )  2.15 0.35 0.55
assign (resid 29 and name   O ) (resid 33 and name    N )  2.90 0.40 0.60
assign (resid 28 and name   O ) (resid 32 and name   HN )  2.15 0.35 0.55
assign (resid 28 and name   O ) (resid 32 and name    N )  2.90 0.40 0.60
assign (resid 27 and name   O ) (resid 31 and name   HN )  2.15 0.35 0.55
assign (resid 27 and name   O ) (resid 31 and name    N )  2.90 0.40 0.60
assign (resid 26 and name   O ) (resid 30 and name   HN )  2.15 0.35 0.55
assign (resid 26 and name   O ) (resid 30 and name    N )  2.90 0.40 0.60
assign (resid 25 and name   O ) (resid 29 and name   HN )  2.15 0.35 0.55
assign (resid 25 and name   O ) (resid 29 and name    N )  2.90 0.40 0.60

! helix 3
assign (resid 51 and name   O ) (resid 55 and name   HN )  2.15 0.35 0.55
assign (resid 51 and name   O ) (resid 55 and name    N )  2.90 0.40 0.60
assign (resid 50 and name   O ) (resid 54 and name   HN )  2.15 0.35 0.55
assign (resid 50 and name   O ) (resid 54 and name    N )  2.90 0.40 0.60
assign (resid 49 and name   O ) (resid 53 and name   HN )  2.15 0.35 0.55
assign (resid 49 and name   O ) (resid 53 and name    N )  2.90 0.40 0.60
assign (resid 48 and name   O ) (resid 52 and name   HN )  2.15 0.35 0.55
assign (resid 48 and name   O ) (resid 52 and name    N )  2.90 0.40 0.60
assign (resid 47 and name   O ) (resid 51 and name   HN )  2.15 0.35 0.55
assign (resid 47 and name   O ) (resid 51 and name    N )  2.90 0.40 0.60
assign (resid 46 and name   O ) (resid 50 and name   HN )  2.15 0.35 0.55
assign (resid 46 and name   O ) (resid 50 and name    N )  2.90 0.40 0.60
assign (resid 45 and name   O ) (resid 49 and name   HN )  2.15 0.35 0.55
assign (resid 45 and name   O ) (resid 49 and name    N )  2.90 0.40 0.60
assign (resid 43 and name   O ) (resid 47 and name   HN )  2.15 0.35 0.55
assign (resid 43 and name   O ) (resid 47 and name    N )  2.90 0.40 0.60
assign (resid 42 and name   O ) (resid 46 and name   HN )  2.15 0.35 0.55
assign (resid 42 and name   O ) (resid 46 and name    N )  2.90 0.40 0.60
assign (resid 41 and name   O ) (resid 45 and name   HN )  2.15 0.35 0.55
assign (resid 41 and name   O ) (resid 45 and name    N )  2.90 0.40 0.60

! Other H-bonds

!assign (resid 20 and name   O ) (resid 23 and name   HN )  2.15 0.35 0.55
!assign (resid 20 and name   O ) (resid 23 and name    N )  2.90 0.40 0.60

!resid 1 ALA

!assign (resid 1  and name HA)   (resid 1  and name HN)   3.6 2.2 1.0
!assign (resid 1  and name HB#)  (resid 1  and name HN)   3.6 2.2 2.0

!resid23 SER

assign (resid 2  and name HA)   (resid 2  and name HN)   3.6 2.2 1.0
assign (resid 2  and name HB#)  (resid 2  and name HN)   3.6 2.2 2.0
assign (resid 1  and name HA)   (resid 2  and name HN)   3.6 2.2 2.0

!resid 3 MET

assign (resid 3  and name HA)   (resid 3  and name HN)   3.6 2.2 1.0
assign (resid 2  and name HA)   (resid 3  and name HN)   3.6 2.2 1.0

!resid 4 VAL

assign (resid 4  and name HA)  (resid 4  and name HN)   3.6 2.2 1.0
assign (resid 4  and name HB)  (resid 4  and name HN)   3.6 2.2 2.0
assign (resid 4  and name HG#)  (resid 4  and name HN)   3.6 2.2 2.0
assign (resid 3  and name HA)   (resid 4  and name HN)   3.6 2.2 2.0

!resid 5 LEU

assign (resid 5  and name HA)   (resid 5  and name HN)   3.6 2.2 1.0
assign (resid 5  and name HB#)  (resid 5  and name HN)   3.6 2.2 2.0
assign (resid 4  and name HA)   (resid 5  and name HN)   3.6 2.2 1.0

!resid 6 SER

assign (resid 6  and name HA)   (resid 6  and name HN)   3.6 2.2 1.0
assign (resid 5  and name HA)   (resid 6  and name HN)   3.6 2.2 1.0

!resid 7 PRO 

assign (resid 7  and name HB#)  (resid 7  and name HA)   3.6 2.2 2.0
assign (resid 7  and name HG#)  (resid 7  and name HA)   3.6 2.2 2.0
assign (resid 7  and name HD#)  (resid 7  and name HA)   3.6 2.2 2.0
assign (resid 7  and name HG#)  (resid 7  and name HD#)  3.6 2.2 1.0
assign (resid 7  and name HG#)  (resid 7  and name HB#)  3.6 2.2 2.0

!resid 8 ARG

assign (resid 8  and name HA)   (resid 8  and name HN)   3.6 2.2 1.0
assign (resid 8  and name HB#)  (resid 8  and name HN)   3.6 2.2 2.0
assign (resid 8  and name HG#)  (resid 8  and name HN)   3.6 2.2 2.0
assign (resid 7  and name HA)   (resid 8  and name HN)   3.6 2.2 1.0
assign (resid 7  and name HB#)  (resid 8  and name HN)   3.6 2.2 2.0
assign (resid 7  and name HG#)  (resid 8  and name HN)   3.6 2.2 2.0

!resid 9 ASP

assign (resid 9  and name HA)   (resid 9  and name HN)   3.6 2.2 1.0
assign (resid 9  and name HB1)  (resid 9  and name HN)   3.6 2.2 2.0
assign (resid 9  and name HB2)  (resid 9  and name HN)   3.6 2.2 2.0
assign (resid 8  and name HN)   (resid 9  and name HN)   2.8 0.8 1.0
assign (resid 8  and name HA)   (resid 9  and name HN)   3.6 2.2 1.0
assign (resid 8  and name HB#)  (resid 9  and name HN)   3.6 2.2 2.0
assign (resid 8  and name HG#)  (resid 9  and name HN)   3.6 2.2 2.0
assign (resid 12 and name HB)  (resid 9  and name HA)   3.6 2.2 2.0

!resid 10 GLU

assign (resid 10 and name HA)   (resid 10 and name HN)   3.6 2.2 1.0
assign (resid 10 and name HB#)  (resid 10 and name HN)   3.6 2.2 2.0
assign (resid 10 and name HG#)  (resid 10 and name HN)   3.6 2.2 2.0
assign (resid 10 and name HB#)  (resid 10 and name HA)   3.6 2.2 2.0
assign (resid 10 and name HG#)  (resid 10 and name HA)   3.6 2.2 2.0
assign (resid 9  and name HN)   (resid 10 and name HN)   2.8 0.8 1.0
assign (resid 9  and name HA)   (resid 10 and name HN)   3.6 2.2 1.0
assign (resid 9  and name HB1)  (resid 10 and name HN)   3.6 2.2 2.0
assign (resid 9  and name HB2)  (resid 10 and name HN)   3.6 2.2 2.0

!resid 11 ARG

assign (resid 11 and name HA)   (resid 11 and name HN)   3.6 2.2 1.0
assign (resid 11 and name HB#)  (resid 11 and name HN)   3.6 2.2 2.0
assign (resid 11 and name HG#)  (resid 11 and name HN)   3.6 2.2 2.0
assign (resid 10 and name HN)   (resid 11 and name HN)   2.8 0.8 1.0
assign (resid 10 and name HA)   (resid 11 and name HN)   3.6 2.2 1.0
assign (resid 10 and name HB#)  (resid 11 and name HN)   3.6 2.2 2.0
assign (resid 9 and name HA)    (resid 11 and name HN)   3.6 2.2 1.0 
assign (resid 4 and name HA)    (resid 11 and name HN)   3.6 2.2 2.0
assign (resid 9 and name HN)    (resid 11 and name HN)   3.6 2.2 1.0

!resid 12 THR 

assign (resid 12 and name HA)   (resid 12 and name HN)   3.6 2.2 1.0
assign (resid 12 and name HB)  (resid 12 and name HN)   3.6 2.2 2.0
assign (resid 12 and name HG2#) (resid 12 and name HN)   3.6 2.2 2.0
assign (resid 11 and name HN)   (resid 12 and name HN)   2.8 0.8 1.0
assign (resid 11 and name HB#)  (resid 12 and name HN)   3.6 2.2 2.0
assign (resid 9 and name HA)    (resid 12 and name HN)   3.6 2.2 1.0
assign (resid 9  and name HA)   (resid 12 and name HB)   3.6 2.2 2.0 
assign (resid 16 and name HD#)  (resid 12 and name HG2#) 3.6 2.2 2.0

!resid 13 LEU

assign (resid 13 and name HA)   (resid 13 and name HN)   3.6 2.2 1.0
assign (resid 13 and name HB#)  (resid 13 and name HN)   3.6 2.2 2.0
assign (resid 13 and name HG)  (resid 13 and name HN)   3.6 2.2 2.0
assign (resid 12 and name HG2#) (resid 13 and name HN)   3.6 2.2 2.0
assign (resid 13 and name HD#)  (resid 13 and name HN)   3.6 2.2 2.0
assign (resid 12 and name HN)   (resid 13 and name HN)   2.8 0.8 1.0
assign (resid 12 and name HA)   (resid 13 and name HN)   3.6 2.2 1.0
assign (resid 10 and name HA)   (resid 13 and name HN)   3.6 2.2 2.0
assign (resid 10 and name HA)   (resid 13 and name HB#)  3.6 2.2 2.0
assign (resid 17 and name HG#)  (resid 13 and name HD#)  3.6 2.2 2.0
assign (resid 11 and name HN)   (resid 13 and name HN)   3.6 2.2 1.0

!resid 14 VAL

assign (resid 14 and name HA)   (resid 14 and name HN)   3.6 2.2 1.0
assign (resid 14 and name HB)   (resid 14 and name HN)   3.6 2.2 2.0
assign (resid 14 and name HG#)  (resid 14 and name HN)   3.6 2.2 2.0
assign (resid 13 and name HN)   (resid 14 and name HN)   2.8 0.8 1.0
assign (resid 13 and name HA)   (resid 14 and name HN)   3.6 2.2 1.0
assign (resid 13 and name HB#)  (resid 14 and name HN)   3.6 2.2 2.0
assign (resid 13 and name HG)  (resid 14 and name HN)   3.6 2.2 2.0
!assign (resid 48 and name HG)  (resid 14 and name HA)   3.6 2.2 2.0
assign (resid 11 and name HA)   (resid 14 and name HB)   3.6 2.2 2.0
!assign (resid 48 and name HD2#) (resid 14 and name HN)   3.6 2.2 2.0
assign (resid 10 and name HG#)  (resid 14 and name HG#)  3.6 2.2 2.0
assign (resid 12 and name HN)   (resid 14 and name HN)   3.6 2.2 2.0

!resid 15 ARG

assign (resid 15 and name HA)   (resid 15 and name HN)   3.6 2.2 1.0
assign (resid 15 and name HB#)  (resid 15 and name HN)   3.6 2.2 2.0
assign (resid 14 and name HN)   (resid 15 and name HN)   2.8 0.8 1.0
assign (resid 14 and name HA)   (resid 15 and name HN)   3.6 2.2 1.0
assign (resid 14 and name HB)   (resid 15 and name HN)   3.6 2.2 2.0
assign (resid 12 and name HA)   (resid 15 and name HN)   3.6 2.2 1.0
assign (resid 11 and name HA)   (resid 15 and name HN)   3.6 2.2 2.0
assign (resid 12 and name HA)   (resid 15 and name HB#)  3.6 2.2 2.0

!resid 16 LYS

assign (resid 16 and name HB#) (resid 16 and name HN)   3.6 2.2 2.0
assign (resid 16 and name HG#) (resid 16 and name HN)   3.6 2.2 2.0
assign (resid 16 and name HD#) (resid 16 and name HN)   3.6 2.2 2.0
assign (resid 16 and name HE#) (resid 16 and name HN)   3.6 2.2 2.0
assign (resid 13 and name HA)   (resid 16 and name HN)   3.6 2.2 1.0
assign (resid 16 and name HA)   (resid 16 and name HN)   3.6 2.2 1.0
assign (resid 12 and name HA)   (resid 16 and name HN)   3.6 2.2 1.0
assign (resid 15 and name HA)   (resid 16 and name HN)   2.8 2.2 1.0
assign (resid 15 and name HN)   (resid 16 and name HN)   2.8 0.8 1.0
assign (resid 13 and name HA)   (resid 16 and name HB#)  3.6 2.2 1.0

!resid 17 VAL

assign (resid 17 and name HG#)  (resid 17 and name HN)   3.6 2.2 2.0
assign (resid 17 and name HB)   (resid 17 and name HN)   3.6 2.2 2.0
assign (resid 14 and name HA)   (resid 17 and name HN)   3.6 2.2 1.0
assign (resid 17 and name HA)   (resid 17 and name HN)   3.6 2.2 1.0
assign (resid 16 and name HA)   (resid 17 and name HN)   2.8 2.2 1.0
assign (resid 16 and name HN)   (resid 17 and name HN)   2.8 0.8 1.0
assign (resid 14 and name HA)   (resid 17 and name HB)   3.6 2.2 2.0
assign (resid 28 and name HD#)  (resid 17 and name HG#)  3.6 2.2 2.0

!resid 18 GLN

assign (resid 18 and name HA)   (resid 18 and name HN)   3.6 2.2 1.0
assign (resid 18 and name HB1)  (resid 18 and name HE21) 3.6 2.2 2.0
assign (resid 18 and name HB2)  (resid 18 and name HE22) 3.6 2.2 2.0
assign (resid 18 and name HG1)  (resid 18 and name HE21) 3.6 2.2 2.0
assign (resid 18 and name HG2)  (resid 18 and name HE22) 3.6 2.2 2.0
assign (resid 17 and name HA)   (resid 18 and name HN)   3.6 2.2 1.0
assign (resid 17 and name HN)   (resid 18 and name HN)   2.8 0.8 1.0
assign (resid 17 and name HG#)  (resid 18 and name HN)   3.6 2.2 2.0
assign (resid 17 and name HB)   (resid 18 and name HN)   3.6 2.2 2.0 
assign (resid 14 and name HG#)  (resid 18 and name HE21) 3.6 2.2 2.0
assign (resid 14 and name HG#)  (resid 18 and name HE22) 3.6 2.2 2.0

!resid 19 ILE

assign (resid 18 and name HA)   (resid 19 and name HN)   3.6 2.2 1.0
assign (resid 18 and name HN)   (resid 19 and name HN)   2.8 2.2 1.0
assign (resid 19 and name HD#)  (resid 19 and name HA)   3.6 2.2 2.0
assign (resid 19 and name HG2#) (resid 19 and name HA)   3.6 2.2 2.0
assign (resid 19 and name HG2#) (resid 19 and name HB)   3.6 2.2 2.0
assign (resid 19 and name HG12) (resid 19 and name HA)   3.6 2.2 2.0
assign (resid 19 and name HG13) (resid 19 and name HA)   3.6 2.2 2.0
assign (resid 16 and name HA)   (resid 19 and name HN)   3.6 2.2 1.0
assign (resid 15 and name HD#)  (resid 19 and name HG12) 3.6 2.2 2.0
assign (resid 16 and name HA)   (resid 19 and name HB)   3.6 2.2 2.0
assign (resid 17 and name HN)   (resid 19 and name HN)   3.6 2.2 2.0

!resid 20
assign (resid 20 and name HA)   (resid 20 and name HN)   3.6 2.2 1.0
assign (resid 20 and name HB1)  (resid 20 and name HN)   3.6 2.2 2.0
assign (resid 20 and name HB2)  (resid 20 and name HN)   3.6 2.2 2.0
assign (resid 20 and name HB1)  (resid 20 and name HA)   3.6 2.2 2.0
assign (resid 20 and name HB2)  (resid 20 and name HA)   3.6 2.2 2.0
assign (resid 21 and name HD#)  (resid 20 and name HA)   3.6 2.2 1.0
assign (resid 17 and name HA)   (resid 20 and name HB#)  3.6 2.2 2.0
assign (resid 19 and name HN)   (resid 20 and name HN)   3.6 2.2 1.0
assign (resid 19 and name HA)   (resid 20 and name HN)   3.6 2.2 1.0
assign (resid 16 and name HD#)  (resid 20 and name HB#)  3.6 2.2 2.0
assign (resid 20 and name HA)   (resid 20 and name HD21) 3.6 2.2 2.0
assign (resid 20 and name HA)   (resid 20 and name HD22) 3.6 2.2 2.0
assign (resid 20 and name HB#)  (resid 20 and name HD21) 3.6 2.2 2.0
assign (resid 20 and name HB#)  (resid 20 and name HD22) 3.6 2.2 2.0

!resid 21 PRO

assign (resid 21 and name HB1)  (resid 21 and name HA)   3.6 2.2 1.0
assign (resid 21 and name HB2)  (resid 21 and name HA)   3.6 2.2 1.0
assign (resid 17 and name HG#)  (resid 21 and name HA)   3.6 2.2 2.0

!resid 22 ARG

assign (resid 22 and name HG#)  (resid 22 and name HN)   3.6 2.2 2.0
assign (resid 22 and name HB1)  (resid 22 and name HN)   3.6 2.2 2.0  
assign (resid 22 and name HB2)  (resid 22 and name HN)   3.6 2.2 2.0 
assign (resid 22 and name HA)   (resid 22 and name HN)   3.6 2.2 1.0
assign (resid 21 and name HB1)  (resid 22 and name HN)   3.6 2.2 2.0
assign (resid 21 and name HB2)  (resid 22 and name HN)   3.6 2.2 2.0
assign (resid 21 and name HA)   (resid 22 and name HN)   3.6 2.2 1.0
assign (resid 21 and name HD1)  (resid 22 and name HN)   3.6 2.2 2.0
assign (resid 21 and name HD2)  (resid 22 and name HN)   3.6 2.2 2.0

!resid 23 THR

assign (resid 23 and name HG2#) (resid 23 and name HN)  3.6 2.2 2.0 
assign (resid 23 and name HA)   (resid 23 and name HN)  3.6 2.2 1.0
assign (resid 23 and name HB)   (resid 23 and name HN)  3.6 2.2 2.0
assign (resid 22 and name HG#)  (resid 23 and name HN)  3.6 2.2 2.0
assign (resid 22 and name HB1)  (resid 23 and name HN)  3.6 2.2 2.0 
assign (resid 22 and name HB2)  (resid 23 and name HN)  3.6 2.2 2.0 
assign (resid 22 and name HA)   (resid 23 and name HN)  3.6 2.2 1.0
assign (resid 22 and name HN)   (resid 23 and name HN)  2.8 2.2 1.0
assign (resid 17 and name HG)   (resid 23 and name HB)  3.6 2.2 2.0
assign (resid 21 and name HD1)  (resid 23 and name HN)  3.6 2.2 2.0
assign (resid 21 and name HA)   (resid 23 and name HN)  3.6 2.2 2.0

!resid 24 THR

assign (resid 24 and name HA)   (resid 24 and name HN)   3.6 2.2 1.0
assign (resid 23 and name HA)   (resid 24 and name HN)   2.5 1.7 0.8
assign (resid 23 and name HN)   (resid 24 and name HN)   3.6 2.2 2.0
assign (resid 27 and name HB1)  (resid 24 and name HN)   3.6 2.2 2.0
assign (resid 27 and name HB2)  (resid 24 and name HN)   3.6 2.2 2.0


!resid 25 ALA

assign (resid 25 and name HB#)  (resid 25 and name HN)   3.6 2.2 2.0  
assign (resid 25 and name HA)   (resid 25 and name HN)   3.6 2.2 1.0
assign (resid 25 and name HB#)  (resid 25 and name HN)   3.6 2.2 2.0
assign (resid 44 and name HG#)  (resid 25 and name HB#)  3.6 2.2 2.0
assign (resid 41 and name HD#)  (resid 25 and name HB#)  3.6 2.2 2.0 
assign (resid 24 and name HA)   (resid 25 and name HN)   3.6 2.2 1.0
assign (resid 28 and name HD#)  (resid 25 and name HA)   3.6 2.2 2.0
assign (resid 44 and name HB)   (resid 25 and name HA)   3.6 2.2 2.0

!resid 26 LYS

assign (resid 26 and name HB#)  (resid 26 and name HN)   3.6 2.2 2.0 
assign (resid 26 and name HA)   (resid 26 and name HN)   3.6 2.2 1.0 
assign (resid 25 and name HB#)  (resid 26 and name HN)   3.6 2.2 2.0 
assign (resid 25 and name HN)   (resid 26 and name HN)   2.8 2.2 1.0 

!resid 27 ASP

assign (resid 27 and name HB1)  (resid 27 and name HN)   3.6 2.2 2.0 
assign (resid 27 and name HB2)  (resid 27 and name HN)   3.6 2.2 2.0 
assign (resid 27 and name HA)   (resid 27 and name HN)   3.6 2.2 1.0
assign (resid 26 and name HB#)  (resid 27 and name HN)   3.6 2.2 2.0 
assign (resid 26 and name HA)   (resid 27 and name HN)   3.6 2.2 1.0
assign (resid 26 and name HN)   (resid 27 and name HN)   2.8 2.2 1.0
assign (resid 23 and name HA)   (resid 27 and name HN)   3.6 2.2 2.0
assign (resid 24 and name HA)   (resid 27 and name HB2)  3.6 2.2 2.0
assign (resid 23 and name HG2#) (resid 27 and name HB#)  3.6 2.2 2.0

!resid 28 LEU

assign (resid 28 and name HB1)  (resid 28 and name HN)   3.6 2.2 2.0
assign (resid 28 and name HB2)  (resid 28 and name HN)   3.6 2.2 2.0
assign (resid 28 and name HA)   (resid 28 and name HN)   3.6 2.2 1.0
assign (resid 27 and name HB1)  (resid 28 and name HN)   3.6 2.2 2.0
assign (resid 27 and name HB2)  (resid 28 and name HN)   3.6 2.2 2.0
assign (resid 27 and name HA)   (resid 28 and name HN)   3.6 2.2 1.0
assign (resid 27 and name HN)   (resid 28 and name HN)   2.8 2.2 1.0
assign (resid 26 and name HB#)  (resid 28 and name HN)   3.6 2.2 2.0 
assign (resid 44 and name HG#)  (resid 28 and name HD#)  3.6 2.2 2.0
assign (resid 13 and name HD#)  (resid 28 and name HB#)  3.6 2.2 2.0
assign (resid 25 and name HA)   (resid 28 and name HB1)  3.6 2.2 2.0

!resid 29 VAL

assign (resid 29 and name HA)   (resid 29 and name HN)   3.6 2.2 1.0
assign (resid 28 and name HB2)  (resid 29 and name HN)   3.6 2.2 2.0
assign (resid 28 and name HN)   (resid 29 and name HN)   2.8 2.2 1.0
assign (resid 26 and name HA)   (resid 29 and name HN)   3.6 2.2 1.0
assign (resid 26 and name HA)   (resid 29 and name HB)   3.6 2.2 2.0

!resid 30 LYS

assign (resid 30 and name HA)  (resid 30 and name HN)   3.6 2.2 1.0
assign (resid 29 and name HA)  (resid 30 and name HN)   3.6 2.2 1.0
assign (resid 29 and name HN)  (resid 30 and name HN)   2.8 2.2 1.0
assign (resid 28 and name HB2) (resid 30 and name HN)   3.6 2.2 2.0
assign (resid 27 and name HA)  (resid 30 and name HN)   3.6 2.2 1.0
assign (resid 26 and name HA)  (resid 30 and name HN)   3.6 2.2 1.0
assign (resid 27 and name HA)  (resid 30 and name HB#)  3.6 2.2 2.0

!resid 31 MET

assign (resid 31 and name HA)  (resid 31 and name HN)   3.6 2.2 1.0
assign (resid 30 and name HN)  (resid 31 and name HN)   2.8 2.2 1.0
assign (resid 28 and name HA)  (resid 31 and name HN)   3.6 2.2 1.0
assign (resid 27 and name HA)  (resid 31 and name HN)   3.6 2.2 1.0
assign (resid 28 and name HA)  (resid 31 and name HB#)  3.6 2.2 2.0
assign (resid 13 and name HD#) (resid 31 and name HE#)  3.6 2.2 2.0

!resid 32 LEU

assign (resid 32 and name HB#) (resid 32 and name HN)   3.6 2.2 2.0
assign (resid 32 and name HA)  (resid 32 and name HN)   3.6 2.2 1.0
assign (resid 31 and name HA)  (resid 32 and name HN)   3.6 2.2 1.0
assign (resid 31 and name HN)  (resid 32 and name HN)   2.8 2.2 1.0
assign (resid 29 and name HA)  (resid 32 and name HN)   3.6 2.2 1.0
assign (resid 29 and name HA)  (resid 32 and name HB#)  3.6 2.2 2.0
assign (resid 9  and name HB#) (resid 32 and name HD#)  3.6 2.2 2.0
assign (resid 41 and name HD#) (resid 32 and name HD#)  3.6 2.2 2.0

!resid 33 GLU

assign (resid 33 and name HA)  (resid 33 and name HN)   3.6 2.2 1.0
assign (resid 33 and name HB#) (resid 33 and name HN)   3.6 2.2 2.0
assign (resid 33 and name HG#) (resid 33 and name HN)   3.6 2.2 2.0
assign (resid 32 and name HB#) (resid 33 and name HN)   3.6 2.2 2.0
assign (resid 32 and name HN)  (resid 33 and name HN)   2.8 2.2 1.0
assign (resid 32 and name HG)  (resid 33 and name HN)   3.6 2.2 2.0
assign (resid 30 and name HA)  (resid 33 and name HN)   3.6 2.2 1.0
assign (resid 29 and name HA)  (resid 33 and name HN)   3.6 2.2 1.0

!resid 34 GLU

assign (resid 34 and name HA)  (resid 34 and name HN)   3.6 2.2 1.0
assign (resid 34 and name HB#) (resid 34 and name HN)   3.6 2.2 2.0
assign (resid 34 and name HG#) (resid 34 and name HN)   3.6 2.2 2.0
assign (resid 33 and name HN)  (resid 34 and name HN)   2.8 2.2 1.0
assign (resid 31 and name HA)  (resid 34 and name HN)   3.6 2.2 1.0
assign (resid 34 and name HB#) (resid 34 and name HA)   3.6 2.2 2.0
assign (resid 34 and name HG#) (resid 34 and name HA)   3.6 2.2 2.0
assign (resid 30 and name HA)  (resid 34 and name HB#)  3.6 2.2 2.0


!resid 35 THR

assign (resid 35 and name HA)  (resid 35 and name HN)   3.6 2.2 1.0
assign (resid 34 and name HA)  (resid 35 and name HN)   3.6 2.2 1.0
assign (resid 34 and name HN)  (resid 35 and name HN)   2.8 2.2 1.0
assign (resid 31 and name HA)  (resid 35 and name HN)   3.6 2.2 1.0

!resid 36 GLY

assign (resid 36 and name HA1)  (resid 36 and name HN)   3.6 2.2 1.0
assign (resid 36 and name HA2)  (resid 36 and name HN)   3.6 2.2 1.0
assign (resid 35 and name HA)   (resid 36 and name HN)   3.6 2.2 1.0
assign (resid 35 and name HN)   (resid 36 and name HN)   2.8 2.2 1.0

!resid 37 THR

assign (resid 37 and name HG2#) (resid 37 and name HN)   3.6 2.2 2.0
assign (resid 37 and name HB)   (resid 37 and name HN)   3.6 2.2 2.0
assign (resid 37 and name HA)   (resid 37 and name HN)   3.6 2.2 1.0
assign (resid 36 and name HN)   (resid 37 and name HN)   2.8 2.2 1.0
assign (resid 35 and name HN)   (resid 37 and name HN)   3.6 2.2 2.0
assign (resid 39 and name HG#)  (resid 37 and name HG2#) 3.6 2.2 2.0

!resid 38 LYS

assign (resid 38 and name HG#)  (resid 38 and name HN)   3.6 2.2 2.0
assign (resid 38 and name HB#)  (resid 38 and name HN)   3.6 2.2 2.0
assign (resid 38 and name HA)   (resid 38 and name HN)   3.6 2.2 1.0
assign (resid 37 and name HG2#) (resid 38 and name HN)   3.6 2.2 2.0

!resid 39 VAL

assign (resid 39 and name HA)   (resid 39 and name HN)   3.6 2.2 1.0
assign (resid 39 and name HB)   (resid 39 and name HN)   3.6 2.2 2.0
assign (resid 39 and name HG#)  (resid 39 and name HN)   3.6 2.2 2.0
assign (resid 38 and name HN)   (resid 39 and name HN)   3.6 2.2 2.0
assign (resid 38 and name HB#)  (resid 39 and name HN)   3.6 2.2 2.0
assign (resid 38 and name HG#)  (resid 39 and name HN)   3.6 2.2 2.0
assign (resid 37 and name HA)   (resid 39 and name HN)   3.6 2.2 2.0
assign (resid 37 and name HN)   (resid 39 and name HN)   3.6 2.2 2.0
assign (resid 38 and name HA)   (resid 39 and name HN)   3.6 2.2 1.0
assign (resid 37 and name HG2#) (resid 39 and name HN)   3.6 2.2 2.0
assign (resid 32 and name HD#)  (resid 39 and name HB)   3.6 2.2 2.0

!resid 40 SER

assign (resid 40 and name HB#)  (resid 40 and name HN)   3.6 2.2 2.0 
assign (resid 40 and name HA)   (resid 40 and name HN)   3.6 2.2 1.0
assign (resid 39 and name HA)   (resid 40 and name HN)   3.6 2.2 1.0
assign (resid 39 and name HB)   (resid 40 and name HN)   3.6 2.2 2.0
assign (resid 39 and name HG#)  (resid 40 and name HN)   3.6 2.2 2.0
assign (resid 41 and name HG12) (resid 40 and name HN)   3.6 2.2 2.0
assign (resid 43 and name HN)   (resid 40 and name HN)   3.6 2.2 2.0
assign (resid 44 and name HN)   (resid 40 and name HN)   3.6 2.2 2.0

!resid 41 ILE

assign (resid 41 and name HD#)  (resid 41 and name HN)   3.6 2.2 2.0
assign (resid 41 and name HG11) (resid 41 and name HN)   3.6 2.2 2.0
assign (resid 41 and name HG12) (resid 41 and name HN)   3.6 2.2 2.0
assign (resid 41 and name HB)   (resid 41 and name HN)   3.6 2.2 2.0
assign (resid 41 and name HA)   (resid 41 and name HN)   3.6 2.2 1.0
assign (resid 40 and name HB#)  (resid 41 and name HN)   3.6 2.2 2.0
assign (resid 40 and name HA)   (resid 41 and name HN)   3.6 2.2 1.0
!assign (resid 40 and name HN)   (resid 41 and name HN)   2.8 2.2 1.0
assign (resid 26 and name HA)   (resid 41 and name HD#)  3.6 2.2 2.0 
assign (resid 44 and name HB)   (resid 41 and name HA)   3.6 2.2 2.0 

!resid 42 SER

assign (resid 42 and name HA)    (resid 42 and name HN)   3.6 2.2 1.0
assign (resid 42 and name HB2)   (resid 42 and name HN)   3.6 2.2 2.0 
assign (resid 42 and name HB1)   (resid 42 and name HN)   3.6 2.2 2.0
assign (resid 41 and name HD#)   (resid 42 and name HN)   3.6 2.2 2.0
assign (resid 41 and name HG11)  (resid 42 and name HN)   3.6 2.2 2.0
assign (resid 41 and name HG12)  (resid 42 and name HN)   3.6 2.2 2.0
assign (resid 41 and name HB)    (resid 42 and name HN)   3.6 2.2 2.0
assign (resid 41 and name HA)    (resid 42 and name HN)   3.6 2.2 1.0
assign (resid 41 and name HN)    (resid 42 and name HN)   2.8 2.2 1.0
assign (resid 44 and name HN)    (resid 42 and name HN)   2.8 2.2 1.0

!resid 43 THR

assign (resid 43 and name HG2#) (resid 43 and name HN)   3.6 2.2 2.0 
assign (resid 43 and name HB)   (resid 43 and name HN)   3.6 2.2 2.0
assign (resid 43 and name HA)   (resid 43 and name HN)   3.6 2.2 1.0
assign (resid 42 and name HB1)  (resid 43 and name HN)   3.6 2.2 2.0 
assign (resid 42 and name HB2)  (resid 43 and name HN)   3.6 2.2 2.0 
assign (resid 42 and name HA)   (resid 43 and name HN)   3.6 2.2 1.0
assign (resid 42 and name HN)   (resid 43 and name HN)   2.8 2.2 1.0
assign (resid 41 and name HN)   (resid 43 and name HN)   3.6 2.2 1.0
assign (resid 46 and name HB#)  (resid 43 and name HA)   3.6 2.2 2.0
assign (resid 46 and name HG#)  (resid 43 and name HA)   3.6 2.2 2.0

!resid 44 VAL

assign (resid 44 and name HA)   (resid 44 and name HN)   3.6 2.2 1.0
assign (resid 44 and name HB)   (resid 44 and name HN)   3.6 2.2 2.0
assign (resid 44 and name HB)   (resid 44 and name HN)   3.6 2.2 2.0 
assign (resid 43 and name HG2#) (resid 44 and name HN)   3.6 2.2 2.0
assign (resid 43 and name HA)   (resid 44 and name HN)   3.6 2.2 1.0
assign (resid 43 and name HN)   (resid 44 and name HN)   2.8 2.2 1.0
assign (resid 41 and name HA)   (resid 44 and name HN)   3.6 2.2 1.0 
assign (resid 41 and name HA)   (resid 44 and name HB)   3.6 2.2 1.0
assign (resid 25 and name HB#)  (resid 44 and name HG#)  3.6 2.2 2.0

!resid 45 LYS

assign (resid 45 and name HA)  (resid 45 and name HN)   3.6 2.2 1.0
assign (resid 45 and name HB#) (resid 45 and name HN)   3.6 2.2 2.0
assign (resid 45 and name HG#) (resid 45 and name HN)   3.6 2.2 2.0
assign (resid 45 and name HD#) (resid 45 and name HB#)  3.6 2.2 2.0
assign (resid 45 and name HE#) (resid 45 and name HB#)  3.6 2.2 2.0
assign (resid 44 and name HB)  (resid 45 and name HN)   3.6 2.2 2.0
assign (resid 44 and name HG#) (resid 45 and name HN)   3.6 2.2 2.0
assign (resid 44 and name HA)  (resid 45 and name HN)   3.6 2.2 1.0
assign (resid 44 and name HN)  (resid 45 and name HN)   2.8 2.2 1.0
assign (resid 42 and name HA)  (resid 45 and name HB#)  3.6 2.2 2.0
assign (resid 25 and name HB#) (resid 45 and name HE#)  3.6 2.2 2.0

!resid 46 ARG

assign (resid 46 and name HG#) (resid 46 and name HN)   3.6 2.2 2.0
assign (resid 46 and name HB#) (resid 46 and name HN)   3.6 2.2 2.0
assign (resid 46 and name HA)  (resid 46 and name HN)   3.6 2.2 1.0
assign (resid 45 and name HA)  (resid 46 and name HN)   3.6 2.2 1.0
assign (resid 45 and name HN)  (resid 46 and name HN)   2.8 2.2 1.0
assign (resid 43 and name HA)  (resid 46 and name HB#)  3.6 2.2 2.0
assign (resid 44 and name HN)  (resid 46 and name HN)   2.8 2.2 2.0

!resid 47 VAL

assign (resid 47 and name HG#) (resid 47 and name HN)   3.6 2.2 2.0
assign (resid 47 and name HB)  (resid 47 and name HN)   3.6 2.2 2.0
assign (resid 47 and name HA)  (resid 47 and name HN)   3.6 2.2 1.0
assign (resid 46 and name HB#) (resid 47 and name HN)   3.6 2.2 2.0
assign (resid 46 and name HA)  (resid 47 and name HN)   3.6 2.2 1.0
assign (resid 46 and name HN)  (resid 47 and name HN)   2.8 2.2 1.0
assign (resid 44 and name HA)  (resid 47 and name HN)   3.6 2.2 1.0
assign (resid 46 and name HG#) (resid 47 and name HN)   3.6 2.2 2.0 
assign (resid 44 and name HA)  (resid 47 and name HB)   3.6 2.2 2.0
assign (resid 44 and name HN)  (resid 47 and name HN)   2.8 2.2 2.0
assign (resid 13 and name HD#) (resid 47 and name HG1#) 3.6 2.2 2.0

!resid 48 LEU

assign (resid 48 and name HB#) (resid 48 and name HN)   3.6 2.2 2.0
assign (resid 48 and name HA)  (resid 48 and name HN)   3.6 2.2 1.0
assign (resid 47 and name HB)  (resid 48 and name HN)   3.6 2.2 2.0
assign (resid 47 and name HA)  (resid 48 and name HN)   3.6 2.2 1.0
assign (resid 47 and name HN)  (resid 48 and name HN)   2.8 2.2 1.0
!assign (resid 14 and name HG#) (resid 48 and name HD1#)  3.6 2.2 2.0
!assign (resid 14 and name HG#) (resid 48 and name HD2#)  3.6 2.2 2.0
assign (resid 44 and name HG#) (resid 48 and name HD1#)  3.6 2.2 2.0
assign (resid 25 and name HB#) (resid 48 and name HD1#)  3.6 2.2 2.0

!resid 49 TYR

assign (resid 49 and name HB#) (resid 49 and name HN)   3.6 2.2 2.0
assign (resid 49 and name HA)  (resid 49 and name HN)   3.6 2.2 1.0
assign (resid 48 and name HB#) (resid 49 and name HN)   3.6 2.2 2.0
assign (resid 48 and name HN)  (resid 49 and name HN)   2.8 2.2 1.0
assign (resid 46 and name HA)  (resid 49 and name HN)   3.6 2.2 1.0
assign (resid 46 and name HA)  (resid 49 and name HB#)  3.6 2.2 2.0

!resid 50 ARG

assign (resid 50 and name HA)  (resid 50 and name HN)   3.6 2.2 1.0
assign (resid 49 and name HB#) (resid 50 and name HN)   3.6 2.2 2.0
assign (resid 49 and name HA)  (resid 50 and name HN)   3.6 2.2 1.0
assign (resid 47 and name HA)  (resid 50 and name HN)   3.6 2.2 1.0
assign (resid 47 and name HA)  (resid 50 and name HB#)  3.6 2.2 2.0
assign (resid 49 and name HN)  (resid 50 and name HN)   3.6 2.2 1.0
assign (resid 49 and name HD#) (resid 50 and name HN)   3.6 2.2 2.0
assign (resid 47 and name HN)  (resid 50 and name HN)   3.6 2.2 2.0

!resid 51 HIS

assign (resid 50 and name HN)  (resid 51 and name HN)   3.6 2.2 1.0
assign (resid 48 and name HA)  (resid 51 and name HB#)  3.6 2.2 2.0

!resid 52 ASN

assign (resid 52 and name HB1) (resid 52 and name HN)   3.6 2.2 2.0
assign (resid 52 and name HB2) (resid 52 and name HN)   3.6 2.2 2.0
assign (resid 52 and name HA)  (resid 52 and name HN)   3.6 2.2 1.0
assign (resid 49 and name HA)  (resid 52 and name HB#)  3.6 2.2 2.0
assign (resid 52 and name HB#) (resid 52 and name HD21) 3.6 2.2 2.0
assign (resid 52 and name HB#) (resid 52 and name HD22) 3.6 2.2 2.0
assign (resid 53 and name HN)  (resid 52 and name HN)   3.6 2.2 1.0

!resid 53 LEU

assign (resid 53 and name HD#) (resid 53 and name HN)   3.6 2.2 2.0
assign (resid 53 and name HB#) (resid 53 and name HN)   3.6 2.2 2.0
assign (resid 53 and name HA)  (resid 53 and name HN)   3.6 2.2 1.0
assign (resid 50 and name HA)  (resid 53 and name HN)   3.6 2.2 2.0
assign (resid 52 and name HA)  (resid 53 and name HN)   3.6 2.2 1.0
assign (resid 50 and name HA)  (resid 53 and name HB#)  3.6 2.2 2.0

!resid 54 LYS

assign (resid 54 and name HG#)  (resid 54 and name HN)   3.6 2.2 2.0
assign (resid 54 and name HD#)  (resid 54 and name HN)   3.6 2.2 2.0
assign (resid 54 and name HB#)  (resid 54 and name HN)   3.6 2.2 2.0
assign (resid 54 and name HA)   (resid 54 and name HN)   3.6 2.2 1.0

!resid 55 GLY

assign (resid 55 and name HA1)  (resid 55 and name HN)   3.6 2.2 1.0
assign (resid 55 and name HA2)  (resid 55 and name HN)   3.6 2.2 1.0
assign (resid 54 and name HG#)  (resid 55 and name HN)   3.6 2.2 2.0
assign (resid 54 and name HD#)  (resid 55 and name HN)   3.6 2.2 2.0
assign (resid 54 and name HB#)  (resid 55 and name HN)   3.6 2.2 2.0
assign (resid 54 and name HA)   (resid 55 and name HN)   3.6 2.2 1.0
assign (resid 53 and name HA)   (resid 55 and name HN)   3.6 2.2 1.0
assign (resid 54 and name HN)   (resid 55 and name HN)   3.6 2.2 1.0

!resid 56 ARG

assign (resid 56 and name HB#)  (resid 56 and name HN)   3.6 2.2 2.0
assign (resid 56 and name HA)   (resid 56 and name HN)   3.6 2.2 1.0
assign (resid 55 and name HA1)  (resid 56 and name HN)   3.6 2.2 1.0
assign (resid 55 and name HA2)  (resid 56 and name HN)   3.6 2.2 1.0
assign (resid 55 and name HN)   (resid 56 and name HN)   3.6 2.2 1.0
!assign (resid 53 and name HA)   (resid 56 and name HN)   3.6 2.2 1.0
assign (resid 55 and name HN)   (resid 56 and name HN)   3.6 2.2 1.0
assign (resid 54 and name HN)   (resid 56 and name HN)   3.6 2.2 2.0
assign (resid 54 and name HD#)  (resid 56 and name HN)   3.6 2.2 2.0
assign (resid 54 and name HB#)  (resid 56 and name HN)   3.6 2.2 2.0


!resid 57 SER

assign (resid 57 and name HB#) (resid 57 and name HN)   3.6 2.2 2.0
assign (resid 57 and name HA)  (resid 57 and name HN)   3.6 2.2 1.0
assign (resid 56 and name HA)  (resid 57 and name HN)   3.6 2.2 1.0
assign (resid 56 and name HB#) (resid 57 and name HN)   3.6 2.2 2.0

!resid 58 ALA

assign (resid 58 and name HB#) (resid 58 and name HN)   3.6 2.2 2.0
assign (resid 58 and name HA)  (resid 58 and name HN)   3.6 2.2 1.0
assign (resid 57 and name HB#) (resid 58 and name HN)   3.6 2.2 2.0
assign (resid 57 and name HA)  (resid 58 and name HN)   3.6 2.2 1.0
assign (resid 57 and name HN)  (resid 58 and name HN)   3.6 2.2 1.0
assign (resid 57 and name HB#) (resid 58 and name HN)   3.6 2.2 2.0 

!resid 59 ARG

assign (resid 59 and name HD#) (resid 59 and name HN)   3.6 2.2 2.0
assign (resid 59 and name HG#) (resid 59 and name HN)   3.6 2.2 2.0
assign (resid 59 and name HB#) (resid 59 and name HN)   3.6 2.2 2.0
assign (resid 59 and name HA)  (resid 59 and name HN)   3.6 2.2 1.0
assign (resid 58 and name HB#) (resid 59 and name HN)   3.6 2.2 2.0
assign (resid 58 and name HA)  (resid 59 and name HN)   3.6 2.2 1.0

!resid 60 LYS

assign (resid 60 and name HG#) (resid 60 and name HN)   3.6 2.2 2.0
assign (resid 60 and name HB#) (resid 60 and name HN)   3.6 2.2 2.0
assign (resid 60 and name HA)  (resid 60 and name HN)   3.6 2.2 1.0
assign (resid 59 and name HA)  (resid 60 and name HN)   3.6 2.2 1.0

!resid 61 LYS

!resid 62 LEU

assign (resid 62 and name HB1) (resid 62 and name HN)   3.6 2.2 2.0
assign (resid 62 and name HB2) (resid 62 and name HN)   3.6 2.2 2.0
assign (resid 62 and name HA)  (resid 62 and name HN)   3.6 2.2 1.0


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1           HT1      ALA   1  61.250   8.618   0.071
    2    H2   ALA   1           HT2      ALA   1  62.177   8.603   1.494
    3    H3   ALA   1           HT3      ALA   1  60.666   9.377   1.474
    4    HA   ALA   1           HA       ALA   1  59.543   7.278   1.131
    5    HB1  ALA   1           HB1      ALA   1  61.381   6.306  -0.236
    6    HB2  ALA   1           HB2      ALA   1  62.398   6.127   1.235
    7    HB3  ALA   1           HB3      ALA   1  60.885   5.159   1.058
    8    H    SER   2           HN       SER   2  62.442   6.860   3.256
    9    HA   SER   2           HA       SER   2  61.021   5.414   5.125
   10    HB2  SER   2           HB1      SER   2  63.440   5.107   4.740
   11    HB3  SER   2           HB2      SER   2  63.795   6.770   5.305
   12    HG   SER   2           HG       SER   2  64.128   4.969   6.823
   13    H    MET   3           HN       MET   3  61.861   8.848   5.101
   14    HA   MET   3           HA       MET   3  61.351   9.489   7.749
   15    HB2  MET   3           HB1      MET   3  62.649  10.812   6.029
   16    HB3  MET   3           HB2      MET   3  61.132  11.196   5.177
   17    HG2  MET   3           HG1      MET   3  61.748  13.171   6.472
   18    HG3  MET   3           HG2      MET   3  60.367  12.425   7.340
   19    HE1  MET   3           HE1      MET   3  61.483  11.915  10.809
   20    HE2  MET   3           HE2      MET   3  60.325  12.764   9.729
   21    HE3  MET   3           HE3      MET   3  60.575  10.992   9.563
   22    H    VAL   4           HN       VAL   4  59.147   8.608   5.317
   23    HA   VAL   4           HA       VAL   4  56.958   8.695   4.898
   24    HB   VAL   4           HB       VAL   4  56.527  10.075   7.538
   25   HG11  VAL   4          HG11      VAL   4  54.162   9.185   7.205
   26   HG12  VAL   4          HG12      VAL   4  54.613  10.365   5.937
   27   HG13  VAL   4          HG13      VAL   4  54.623   8.598   5.569
   28   HG21  VAL   4          HG21      VAL   4  55.859   7.700   8.285
   29   HG22  VAL   4          HG22      VAL   4  56.425   7.068   6.695
   30   HG23  VAL   4          HG23      VAL   4  57.594   7.802   7.852
   31    H    LEU   5           HN       LEU   5  57.762   9.945   3.219
   32    HA   LEU   5           HA       LEU   5  58.293  12.677   3.376
   33    HB2  LEU   5           HB1      LEU   5  59.368  10.997   1.852
   34    HB3  LEU   5           HB2      LEU   5  57.819  10.735   1.017
   35    HG   LEU   5           HG       LEU   5  57.898  13.179   0.244
   36   HD11  LEU   5          HD11      LEU   5  60.166  14.337   0.436
   37   HD12  LEU   5          HD12      LEU   5  59.401  14.079   2.046
   38   HD13  LEU   5          HD13      LEU   5  60.743  13.006   1.500
   39   HD21  LEU   5          HD21      LEU   5  59.662  12.784  -1.489
   40   HD22  LEU   5          HD22      LEU   5  60.322  11.409  -0.547
   41   HD23  LEU   5          HD23      LEU   5  58.659  11.310  -1.230
   42    H    SER   6           HN       SER   6  55.471  10.844   2.038
   43    HA   SER   6           HA       SER   6  53.996  13.373   1.938
   44    HB2  SER   6           HB1      SER   6  53.447  10.615   0.617
   45    HB3  SER   6           HB2      SER   6  52.329  12.007   0.472
   46    HG   SER   6           HG       SER   6  53.884  11.616  -1.310
   47    HA   PRO   7           HA       PRO   7  52.869  11.371   5.688
   48    HB2  PRO   7           HB2      PRO   7  51.417  13.272   6.997
   49    HB3  PRO   7           HB1      PRO   7  53.187  13.422   6.662
   50    HG2  PRO   7           HG2      PRO   7  51.006  14.656   4.950
   51    HG3  PRO   7           HG1      PRO   7  52.468  15.453   5.668
   52    HD2  PRO   7           HD2      PRO   7  52.482  14.405   3.101
   53    HD3  PRO   7           HD1      PRO   7  53.968  14.409   4.171
   54    H    ARG   8           HN       ARG   8  50.104  12.459   3.512
   55    HA   ARG   8           HA       ARG   8  48.411  10.620   4.964
   56    HB2  ARG   8           HB1      ARG   8  48.153  12.014   2.251
   57    HB3  ARG   8           HB2      ARG   8  46.906  10.892   2.846
   58    HG2  ARG   8           HG1      ARG   8  46.753  12.488   4.949
   59    HG3  ARG   8           HG2      ARG   8  47.766  13.624   4.040
   60    HD2  ARG   8           HD1      ARG   8  45.392  14.252   3.707
   61    HD3  ARG   8           HD2      ARG   8  46.087  13.706   2.126
   62    HE   ARG   8           HE       ARG   8  44.877  11.580   3.763
   63   HH11  ARG   8          HH11      ARG   8  42.885  13.307   0.594
   64   HH12  ARG   8          HH12      ARG   8  44.067  14.172   1.545
   65   HH21  ARG   8          HH21      ARG   8  42.504  11.003   1.115
   66   HH22  ARG   8          HH22      ARG   8  43.442  10.283   2.379
   67    H    ASP   9           HN       ASP   9  50.326  10.501   1.820
   68    HA   ASP   9           HA       ASP   9  48.864   8.177   1.118
   69    HB2  ASP   9           HB1      ASP   9  51.196   9.718  -0.194
   70    HB3  ASP   9           HB2      ASP   9  50.398   8.309  -0.975
   71    H    GLU  10           HN       GLU  10  52.344   8.835   2.080
   72    HA   GLU  10           HA       GLU  10  53.136   6.170   1.631
   73    HB2  GLU  10           HB1      GLU  10  54.702   8.145   1.735
   74    HB3  GLU  10           HB2      GLU  10  54.335   8.343   3.463
   75    HG2  GLU  10           HG1      GLU  10  56.479   7.185   3.281
   76    HG3  GLU  10           HG2      GLU  10  55.301   5.937   3.838
   77    H    ARG  11           HN       ARG  11  51.914   7.934   4.442
   78    HA   ARG  11           HA       ARG  11  52.400   5.965   6.402
   79    HB2  ARG  11           HB1      ARG  11  51.905   8.499   6.626
   80    HB3  ARG  11           HB2      ARG  11  50.186   8.120   6.365
   81    HG2  ARG  11           HG1      ARG  11  50.251   8.138   8.705
   82    HG3  ARG  11           HG2      ARG  11  50.582   6.418   8.435
   83    HD2  ARG  11           HD1      ARG  11  53.099   6.864   8.425
   84    HD3  ARG  11           HD2      ARG  11  52.781   8.575   8.926
   85    HE   ARG  11           HE       ARG  11  51.390   6.665  10.596
   86   HH11  ARG  11          HH11      ARG  11  53.781   7.122  13.271
   87   HH12  ARG  11          HH12      ARG  11  52.199   6.539  12.814
   88   HH21  ARG  11          HH21      ARG  11  55.116   8.154  11.581
   89   HH22  ARG  11          HH22      ARG  11  54.482   8.245   9.974
   90    H    THR  12           HN       THR  12  49.419   6.698   4.463
   91    HA   THR  12           HA       THR  12  47.909   4.595   5.501
   92    HB   THR  12           HB       THR  12  47.802   6.002   2.809
   93    HG1  THR  12           HG1      THR  12  46.053   7.081   3.820
   94   HG21  THR  12          HG21      THR  12  45.402   5.158   2.644
   95   HG22  THR  12          HG22      THR  12  46.477   3.739   2.879
   96   HG23  THR  12          HG23      THR  12  45.526   4.385   4.265
   97    H    LEU  13           HN       LEU  13  50.152   4.696   2.640
   98    HA   LEU  13           HA       LEU  13  49.427   2.211   1.657
   99    HB2  LEU  13           HB1      LEU  13  50.665   3.967   0.388
  100    HB3  LEU  13           HB2      LEU  13  52.059   3.823   1.485
  101    HG   LEU  13           HG       LEU  13  51.102   1.417  -0.089
  102   HD11  LEU  13          HD11      LEU  13  52.656   2.178  -2.027
  103   HD12  LEU  13          HD12      LEU  13  51.211   3.231  -1.802
  104   HD13  LEU  13          HD13      LEU  13  52.824   3.768  -1.202
  105   HD21  LEU  13          HD21      LEU  13  53.547   0.818  -0.225
  106   HD22  LEU  13          HD22      LEU  13  53.976   2.293   0.697
  107   HD23  LEU  13          HD23      LEU  13  52.990   1.006   1.477
  108    H    VAL  14           HN       VAL  14  52.098   3.073   4.024
  109    HA   VAL  14           HA       VAL  14  53.092   0.448   4.066
  110    HB   VAL  14           HB       VAL  14  54.381   1.063   6.016
  111   HG11  VAL  14          HG11      VAL  14  55.696   2.899   4.786
  112   HG12  VAL  14          HG12      VAL  14  55.231   1.564   3.689
  113   HG13  VAL  14          HG13      VAL  14  54.309   3.115   3.663
  114   HG21  VAL  14          HG21      VAL  14  54.381   3.426   6.852
  115   HG22  VAL  14          HG22      VAL  14  52.885   3.749   5.902
  116   HG23  VAL  14          HG23      VAL  14  52.871   2.546   7.242
  117    H    ARG  15           HN       ARG  15  50.640   2.133   6.139
  118    HA   ARG  15           HA       ARG  15  50.293  -0.030   7.910
  119    HB2  ARG  15           HB1      ARG  15  49.473   2.264   8.347
  120    HB3  ARG  15           HB2      ARG  15  48.382   2.202   6.942
  121    HG2  ARG  15           HG1      ARG  15  47.010   1.885   8.911
  122    HG3  ARG  15           HG2      ARG  15  47.108   0.291   8.140
  123    HD2  ARG  15           HD1      ARG  15  47.381  -0.156  10.470
  124    HD3  ARG  15           HD2      ARG  15  49.041  -0.336   9.769
  125    HE   ARG  15           HE       ARG  15  49.714   1.703  10.687
  126   HH11  ARG  15          HH11      ARG  15  48.150   3.272  13.524
  127   HH12  ARG  15          HH12      ARG  15  49.636   2.992  12.649
  128   HH21  ARG  15          HH21      ARG  15  46.190   2.143  12.781
  129   HH22  ARG  15          HH22      ARG  15  46.301   1.125  11.387
  130    H    LYS  16           HN       LYS  16  48.477   0.736   4.786
  131    HA   LYS  16           HA       LYS  16  46.757  -1.420   5.213
  132    HB2  LYS  16           HB1      LYS  16  47.387   0.224   2.752
  133    HB3  LYS  16           HB2      LYS  16  46.234  -1.134   2.686
  134    HG2  LYS  16           HG1      LYS  16  44.978   0.021   4.685
  135    HG3  LYS  16           HG2      LYS  16  46.063   1.430   4.440
  136    HD2  LYS  16           HD1      LYS  16  45.202   1.724   2.128
  137    HD3  LYS  16           HD2      LYS  16  44.233   0.218   2.265
  138    HE2  LYS  16           HE1      LYS  16  42.933   1.308   4.210
  139    HE3  LYS  16           HE2      LYS  16  43.810   2.846   3.861
  140    HZ1  LYS  16           HZ1      LYS  16  41.682   2.745   2.743
  141    HZ2  LYS  16           HZ2      LYS  16  42.945   2.762   1.608
  142    HZ3  LYS  16           HZ3      LYS  16  42.123   1.317   1.939
  143    H    VAL  17           HN       VAL  17  49.835  -1.277   3.178
  144    HA   VAL  17           HA       VAL  17  49.291  -3.731   1.962
  145    HB   VAL  17           HB       VAL  17  50.778  -2.005   1.059
  146   HG11  VAL  17          HG11      VAL  17  53.196  -1.998   1.784
  147   HG12  VAL  17          HG12      VAL  17  52.120  -1.361   3.064
  148   HG13  VAL  17          HG13      VAL  17  52.777  -3.036   3.191
  149   HG21  VAL  17          HG21      VAL  17  52.441  -3.673   0.140
  150   HG22  VAL  17          HG22      VAL  17  51.882  -4.869   1.367
  151   HG23  VAL  17          HG23      VAL  17  50.751  -4.266   0.102
  152    H    GLN  18           HN       GLN  18  51.067  -2.966   5.031
  153    HA   GLN  18           HA       GLN  18  51.919  -5.637   5.342
  154    HB2  GLN  18           HB1      GLN  18  51.849  -3.179   7.130
  155    HB3  GLN  18           HB2      GLN  18  52.495  -4.731   7.722
  156    HG2  GLN  18           HG1      GLN  18  54.214  -4.741   5.800
  157    HG3  GLN  18           HG2      GLN  18  53.525  -3.209   5.168
  158   HE21  GLN  18          HE21      GLN  18  54.963  -1.316   7.973
  159   HE22  GLN  18          HE22      GLN  18  53.398  -1.485   7.203
  160    H    ILE  19           HN       ILE  19  49.131  -3.725   6.839
  161    HA   ILE  19           HA       ILE  19  48.332  -5.917   8.390
  162    HB   ILE  19           HB       ILE  19  46.951  -3.433   7.404
  163   HG12  ILE  19          HG11      ILE  19  48.745  -2.949   8.982
  164   HG13  ILE  19          HG12      ILE  19  47.163  -2.630   9.761
  165   HG21  ILE  19          HG21      ILE  19  45.065  -3.917   9.035
  166   HG22  ILE  19          HG22      ILE  19  45.228  -5.323   7.936
  167   HG23  ILE  19          HG23      ILE  19  45.892  -5.408   9.608
  168   HD11  ILE  19          HD11      ILE  19  48.692  -3.672  11.367
  169   HD12  ILE  19          HD12      ILE  19  47.341  -4.809  11.012
  170   HD13  ILE  19          HD13      ILE  19  48.966  -5.078  10.281
  171    H    ASN  20           HN       ASN  20  47.279  -4.850   5.040
  172    HA   ASN  20           HA       ASN  20  45.720  -7.313   4.972
  173    HB2  ASN  20           HB1      ASN  20  45.509  -4.688   3.340
  174    HB3  ASN  20           HB2      ASN  20  44.484  -6.118   3.002
  175   HD21  ASN  20          HD21      ASN  20  42.575  -5.674   6.130
  176   HD22  ASN  20          HD22      ASN  20  43.294  -6.950   5.180
  177    HA   PRO  21           HA       PRO  21  49.180  -8.163   2.118
  178    HB2  PRO  21           HB2      PRO  21  49.048 -10.892   2.030
  179    HB3  PRO  21           HB1      PRO  21  49.631 -10.003   3.492
  180    HG2  PRO  21           HG2      PRO  21  46.802 -11.057   3.068
  181    HG3  PRO  21           HG1      PRO  21  47.895 -11.316   4.492
  182    HD2  PRO  21           HD2      PRO  21  46.037  -9.264   4.433
  183    HD3  PRO  21           HD1      PRO  21  47.645  -9.114   5.295
  184    H    ARG  22           HN       ARG  22  45.864  -8.671   1.772
  185    HA   ARG  22           HA       ARG  22  45.542  -9.569  -0.860
  186    HB2  ARG  22           HB1      ARG  22  43.783  -9.467   0.883
  187    HB3  ARG  22           HB2      ARG  22  43.855  -7.689   0.915
  188    HG2  ARG  22           HG1      ARG  22  43.050  -7.685  -1.518
  189    HG3  ARG  22           HG2      ARG  22  42.951  -9.455  -1.472
  190    HD2  ARG  22           HD1      ARG  22  41.341  -9.395   0.470
  191    HD3  ARG  22           HD2      ARG  22  41.306  -7.586   0.400
  192    HE   ARG  22           HE       ARG  22  40.832  -8.621  -2.209
  193   HH11  ARG  22          HH11      ARG  22  37.697  -8.289   0.474
  194   HH12  ARG  22          HH12      ARG  22  39.365  -8.407   0.980
  195   HH21  ARG  22          HH21      ARG  22  37.237  -8.355  -1.869
  196   HH22  ARG  22          HH22      ARG  22  38.571  -8.473  -2.965
  197    H    THR  23           HN       THR  23  46.330  -6.302   0.379
  198    HA   THR  23           HA       THR  23  45.408  -4.871  -1.805
  199    HB   THR  23           HB       THR  23  47.596  -4.269   0.233
  200    HG1  THR  23           HG1      THR  23  45.908  -3.050   1.194
  201   HG21  THR  23          HG21      THR  23  47.237  -1.807  -0.274
  202   HG22  THR  23          HG22      THR  23  47.636  -2.639  -1.814
  203   HG23  THR  23          HG23      THR  23  45.929  -2.199  -1.447
  204    H    THR  24           HN       THR  24  46.215  -4.186  -3.757
  205    HA   THR  24           HA       THR  24  48.930  -5.005  -4.405
  206    HB   THR  24           HB       THR  24  47.371  -6.758  -5.169
  207    HG1  THR  24           HG1      THR  24  47.960  -6.717  -7.367
  208   HG21  THR  24          HG21      THR  24  45.683  -6.272  -6.977
  209   HG22  THR  24          HG22      THR  24  45.341  -5.235  -5.551
  210   HG23  THR  24          HG23      THR  24  46.154  -4.534  -6.997
  211    H    ALA  25           HN       ALA  25  49.330  -4.112  -6.824
  212    HA   ALA  25           HA       ALA  25  49.832  -1.390  -6.425
  213    HB1  ALA  25           HB1      ALA  25  51.242  -2.921  -7.788
  214    HB2  ALA  25           HB2      ALA  25  49.932  -3.051  -9.010
  215    HB3  ALA  25           HB3      ALA  25  50.762  -1.472  -8.737
  216    H    LYS  26           HN       LYS  26  47.240  -2.969  -8.278
  217    HA   LYS  26           HA       LYS  26  46.261  -0.731  -9.602
  218    HB2  LYS  26           HB1      LYS  26  44.913  -3.297  -8.605
  219    HB3  LYS  26           HB2      LYS  26  44.085  -2.140  -9.679
  220    HG2  LYS  26           HG1      LYS  26  45.992  -2.467 -11.391
  221    HG3  LYS  26           HG2      LYS  26  46.717  -3.688 -10.295
  222    HD2  LYS  26           HD1      LYS  26  44.470  -4.972 -10.465
  223    HD3  LYS  26           HD2      LYS  26  43.998  -3.806 -11.746
  224    HE2  LYS  26           HE1      LYS  26  46.181  -4.471 -13.006
  225    HE3  LYS  26           HE2      LYS  26  46.360  -5.812 -11.811
  226    HZ1  LYS  26           HZ1      LYS  26  45.189  -6.516 -13.792
  227    HZ2  LYS  26           HZ2      LYS  26  44.163  -6.590 -12.441
  228    HZ3  LYS  26           HZ3      LYS  26  43.998  -5.330 -13.562
  229    H    ASP  27           HN       ASP  27  45.437  -2.012  -6.267
  230    HA   ASP  27           HA       ASP  27  43.469  -0.100  -5.764
  231    HB2  ASP  27           HB1      ASP  27  45.471  -1.625  -3.934
  232    HB3  ASP  27           HB2      ASP  27  44.088  -0.682  -3.280
  233    H    LEU  28           HN       LEU  28  47.009  -0.109  -5.292
  234    HA   LEU  28           HA       LEU  28  47.133   2.189  -3.738
  235    HB2  LEU  28           HB1      LEU  28  49.138   0.658  -5.465
  236    HB3  LEU  28           HB2      LEU  28  49.644   2.034  -4.458
  237    HG   LEU  28           HG       LEU  28  48.099  -0.394  -3.337
  238   HD11  LEU  28          HD11      LEU  28  50.365  -1.264  -2.493
  239   HD12  LEU  28          HD12      LEU  28  50.255  -1.269  -4.291
  240   HD13  LEU  28          HD13      LEU  28  51.187   0.022  -3.447
  241   HD21  LEU  28          HD21      LEU  28  49.089   0.301  -1.135
  242   HD22  LEU  28          HD22      LEU  28  49.896   1.696  -1.918
  243   HD23  LEU  28          HD23      LEU  28  48.099   1.610  -1.874
  244    H    VAL  29           HN       VAL  29  47.611   1.794  -7.372
  245    HA   VAL  29           HA       VAL  29  48.242   4.474  -7.786
  246    HB   VAL  29           HB       VAL  29  48.748   2.733  -9.388
  247   HG11  VAL  29          HG11      VAL  29  46.957   1.955 -10.995
  248   HG12  VAL  29          HG12      VAL  29  46.671   1.342  -9.339
  249   HG13  VAL  29          HG13      VAL  29  45.701   2.727  -9.967
  250   HG21  VAL  29          HG21      VAL  29  48.113   4.098 -11.429
  251   HG22  VAL  29          HG22      VAL  29  47.009   5.080 -10.399
  252   HG23  VAL  29          HG23      VAL  29  48.785   5.093 -10.100
  253    H    LYS  30           HN       LYS  30  45.042   2.827  -7.631
  254    HA   LYS  30           HA       LYS  30  43.531   4.991  -8.512
  255    HB2  LYS  30           HB1      LYS  30  42.795   2.635  -8.463
  256    HB3  LYS  30           HB2      LYS  30  42.818   2.639  -6.680
  257    HG2  LYS  30           HG1      LYS  30  40.961   4.279  -6.600
  258    HG3  LYS  30           HG2      LYS  30  41.084   4.583  -8.365
  259    HD2  LYS  30           HD1      LYS  30  40.597   1.970  -8.573
  260    HD3  LYS  30           HD2      LYS  30  40.045   2.106  -6.869
  261    HE2  LYS  30           HE1      LYS  30  38.935   3.949  -9.092
  262    HE3  LYS  30           HE2      LYS  30  38.201   2.345  -8.711
  263    HZ1  LYS  30           HZ1      LYS  30  37.141   4.131  -7.510
  264    HZ2  LYS  30           HZ2      LYS  30  37.921   3.077  -6.433
  265    HZ3  LYS  30           HZ3      LYS  30  38.611   4.583  -6.792
  266    H    MET  31           HN       MET  31  44.475   4.046  -5.087
  267    HA   MET  31           HA       MET  31  43.189   6.204  -3.907
  268    HB2  MET  31           HB1      MET  31  45.624   4.576  -3.086
  269    HB3  MET  31           HB2      MET  31  44.959   5.852  -2.036
  270    HG2  MET  31           HG1      MET  31  42.660   4.578  -2.151
  271    HG3  MET  31           HG2      MET  31  43.522   3.267  -3.018
  272    HE1  MET  31           HE1      MET  31  46.001   1.872  -0.346
  273    HE2  MET  31           HE2      MET  31  45.331   1.712  -2.007
  274    HE3  MET  31           HE3      MET  31  46.337   3.138  -1.575
  275    H    LEU  32           HN       LEU  32  46.569   6.028  -5.320
  276    HA   LEU  32           HA       LEU  32  47.387   8.461  -4.284
  277    HB2  LEU  32           HB1      LEU  32  48.135   6.889  -6.816
  278    HB3  LEU  32           HB2      LEU  32  49.018   8.364  -6.357
  279    HG   LEU  32           HG       LEU  32  48.715   5.902  -4.530
  280   HD11  LEU  32          HD11      LEU  32  51.102   5.303  -5.267
  281   HD12  LEU  32          HD12      LEU  32  49.900   5.183  -6.603
  282   HD13  LEU  32          HD13      LEU  32  51.010   6.600  -6.511
  283   HD21  LEU  32          HD21      LEU  32  50.722   6.834  -3.338
  284   HD22  LEU  32          HD22      LEU  32  50.731   8.257  -4.428
  285   HD23  LEU  32          HD23      LEU  32  49.336   7.982  -3.324
  286    H    GLU  33           HN       GLU  33  45.801   7.785  -7.546
  287    HA   GLU  33           HA       GLU  33  45.813  10.498  -8.266
  288    HB2  GLU  33           HB1      GLU  33  44.291   9.898 -10.053
  289    HB3  GLU  33           HB2      GLU  33  45.663   8.768  -9.988
  290    HG2  GLU  33           HG1      GLU  33  44.193   7.059  -8.849
  291    HG3  GLU  33           HG2      GLU  33  42.793   8.193  -8.948
  292    H    GLU  34           HN       GLU  34  43.467   8.551  -6.320
  293    HA   GLU  34           HA       GLU  34  41.393  10.423  -6.336
  294    HB2  GLU  34           HB1      GLU  34  41.149   8.037  -5.663
  295    HB3  GLU  34           HB2      GLU  34  42.184   8.310  -4.243
  296    HG2  GLU  34           HG1      GLU  34  40.488   9.851  -3.251
  297    HG3  GLU  34           HG2      GLU  34  39.451   9.727  -4.722
  298    H    THR  35           HN       THR  35  44.185  10.027  -3.998
  299    HA   THR  35           HA       THR  35  43.561  12.307  -2.515
  300    HB   THR  35           HB       THR  35  46.243  11.012  -3.132
  301    HG1  THR  35           HG1      THR  35  45.971  10.177  -1.023
  302   HG21  THR  35          HG21      THR  35  47.106  12.221  -1.051
  303   HG22  THR  35          HG22      THR  35  46.412  13.450  -2.161
  304   HG23  THR  35          HG23      THR  35  45.470  12.901  -0.728
  305    H    GLY  36           HN       GLY  36  45.537  11.913  -5.510
  306    HA2  GLY  36           HA2      GLY  36  45.542  13.547  -7.144
  307    HA3  GLY  36           HA1      GLY  36  45.285  14.801  -5.856
  308    H    THR  37           HN       THR  37  47.686  12.286  -5.298
  309    HA   THR  37           HA       THR  37  49.744  14.344  -5.581
  310    HB   THR  37           HB       THR  37  49.715  11.669  -4.087
  311    HG1  THR  37           HG1      THR  37  49.796  12.987  -2.222
  312   HG21  THR  37          HG21      THR  37  51.921  12.448  -3.045
  313   HG22  THR  37          HG22      THR  37  52.084  12.549  -4.830
  314   HG23  THR  37          HG23      THR  37  51.783  14.043  -3.871
  315    H    LYS  38           HN       LYS  38  51.317  14.126  -7.209
  316    HA   LYS  38           HA       LYS  38  51.051  11.779  -8.843
  317    HB2  LYS  38           HB1      LYS  38  52.963  14.180  -8.924
  318    HB3  LYS  38           HB2      LYS  38  52.972  12.891 -10.156
  319    HG2  LYS  38           HG1      LYS  38  50.555  13.478 -10.741
  320    HG3  LYS  38           HG2      LYS  38  50.582  14.768  -9.493
  321    HD2  LYS  38           HD1      LYS  38  52.482  15.886 -10.743
  322    HD3  LYS  38           HD2      LYS  38  52.417  14.585 -11.979
  323    HE2  LYS  38           HE1      LYS  38  50.101  15.253 -12.634
  324    HE3  LYS  38           HE2      LYS  38  50.062  16.497 -11.325
  325    HZ1  LYS  38           HZ1      LYS  38  50.663  17.449 -13.460
  326    HZ2  LYS  38           HZ2      LYS  38  51.958  17.574 -12.369
  327    HZ3  LYS  38           HZ3      LYS  38  51.994  16.404 -13.596
  328    H    VAL  39           HN       VAL  39  52.014   9.909  -8.422
  329    HA   VAL  39           HA       VAL  39  54.706   9.877  -7.253
  330    HB   VAL  39           HB       VAL  39  52.375   8.045  -6.524
  331   HG11  VAL  39          HG11      VAL  39  54.003   7.078  -4.832
  332   HG12  VAL  39          HG12      VAL  39  54.554   6.806  -6.512
  333   HG13  VAL  39          HG13      VAL  39  55.314   8.103  -5.514
  334   HG21  VAL  39          HG21      VAL  39  52.645   9.062  -4.194
  335   HG22  VAL  39          HG22      VAL  39  53.834  10.235  -4.870
  336   HG23  VAL  39          HG23      VAL  39  52.117  10.266  -5.411
  337    H    SER  40           HN       SER  40  56.107   8.543  -8.466
  338    HA   SER  40           HA       SER  40  55.110   7.432 -10.835
  339    HB2  SER  40           HB1      SER  40  57.443   8.276 -10.653
  340    HB3  SER  40           HB2      SER  40  57.826   7.076  -9.379
  341    HG   SER  40           HG       SER  40  58.495   6.597 -11.617
  342    H    ILE  41           HN       ILE  41  54.876   5.233 -11.529
  343    HA   ILE  41           HA       ILE  41  53.902   3.431  -9.644
  344    HB   ILE  41           HB       ILE  41  54.751   3.144 -12.507
  345   HG12  ILE  41          HG11      ILE  41  52.860   4.631 -12.312
  346   HG13  ILE  41          HG12      ILE  41  52.259   3.071 -12.957
  347   HG21  ILE  41          HG21      ILE  41  53.533   0.904 -12.526
  348   HG22  ILE  41          HG22      ILE  41  54.769   0.853 -11.230
  349   HG23  ILE  41          HG23      ILE  41  53.038   1.117 -10.811
  350   HD11  ILE  41          HD11      ILE  41  50.662   3.968 -11.320
  351   HD12  ILE  41          HD12      ILE  41  51.393   2.458 -10.668
  352   HD13  ILE  41          HD13      ILE  41  51.932   4.064 -10.051
  353    H    SER  42           HN       SER  42  57.215   3.779 -11.074
  354    HA   SER  42           HA       SER  42  58.080   1.253 -10.412
  355    HB2  SER  42           HB1      SER  42  59.638   3.902 -10.630
  356    HB3  SER  42           HB2      SER  42  60.452   2.308 -10.550
  357    HG   SER  42           HG       SER  42  60.001   3.240 -12.724
  358    H    THR  43           HN       THR  43  58.243   4.290  -8.333
  359    HA   THR  43           HA       THR  43  59.623   2.973  -6.289
  360    HB   THR  43           HB       THR  43  59.673   5.351  -6.478
  361    HG1  THR  43           HG1      THR  43  59.243   5.826  -4.294
  362   HG21  THR  43          HG21      THR  43  57.743   6.791  -5.778
  363   HG22  THR  43          HG22      THR  43  57.230   5.744  -7.145
  364   HG23  THR  43          HG23      THR  43  56.723   5.342  -5.464
  365    H    VAL  44           HN       VAL  44  56.066   3.232  -6.932
  366    HA   VAL  44           HA       VAL  44  55.216   1.971  -4.582
  367    HB   VAL  44           HB       VAL  44  54.047   2.026  -7.399
  368   HG11  VAL  44          HG11      VAL  44  51.850   1.367  -6.307
  369   HG12  VAL  44          HG12      VAL  44  53.067   0.061  -6.184
  370   HG13  VAL  44          HG13      VAL  44  52.709   1.096  -4.751
  371   HG21  VAL  44          HG21      VAL  44  52.502   3.774  -6.359
  372   HG22  VAL  44          HG22      VAL  44  53.460   3.677  -4.836
  373   HG23  VAL  44          HG23      VAL  44  54.222   4.279  -6.352
  374    H    LYS  45           HN       LYS  45  56.197   0.617  -7.792
  375    HA   LYS  45           HA       LYS  45  55.618  -2.037  -7.155
  376    HB2  LYS  45           HB1      LYS  45  55.917  -1.001  -9.444
  377    HB3  LYS  45           HB2      LYS  45  57.665  -0.847  -9.130
  378    HG2  LYS  45           HG1      LYS  45  57.682  -2.823 -10.361
  379    HG3  LYS  45           HG2      LYS  45  57.451  -3.535  -8.729
  380    HD2  LYS  45           HD1      LYS  45  55.096  -2.802 -10.585
  381    HD3  LYS  45           HD2      LYS  45  55.952  -4.379 -10.693
  382    HE2  LYS  45           HE1      LYS  45  55.336  -4.816  -8.250
  383    HE3  LYS  45           HE2      LYS  45  54.344  -3.309  -8.283
  384    HZ1  LYS  45           HZ1      LYS  45  53.032  -5.267  -8.812
  385    HZ2  LYS  45           HZ2      LYS  45  53.113  -4.228 -10.153
  386    HZ3  LYS  45           HZ3      LYS  45  54.047  -5.643 -10.119
  387    H    ARG  46           HN       ARG  46  58.755  -0.191  -6.862
  388    HA   ARG  46           HA       ARG  46  60.196  -2.357  -5.814
  389    HB2  ARG  46           HB1      ARG  46  60.592   0.625  -5.592
  390    HB3  ARG  46           HB2      ARG  46  61.710  -0.510  -4.799
  391    HG2  ARG  46           HG1      ARG  46  61.866  -1.647  -7.226
  392    HG3  ARG  46           HG2      ARG  46  61.099  -0.166  -7.825
  393    HD2  ARG  46           HD1      ARG  46  62.908   1.275  -6.878
  394    HD3  ARG  46           HD2      ARG  46  63.794  -0.188  -6.281
  395    HE   ARG  46           HE       ARG  46  63.496   0.703  -9.065
  396   HH11  ARG  46          HH11      ARG  46  65.408  -2.787  -7.957
  397   HH12  ARG  46          HH12      ARG  46  64.471  -1.842  -6.826
  398   HH21  ARG  46          HH21      ARG  46  65.582  -1.992 -10.198
  399   HH22  ARG  46          HH22      ARG  46  64.743  -0.540 -10.625
  400    H    VAL  47           HN       VAL  47  58.234   0.169  -3.913
  401    HA   VAL  47           HA       VAL  47  59.164  -0.816  -1.463
  402    HB   VAL  47           HB       VAL  47  58.199   1.408  -1.791
  403   HG11  VAL  47          HG11      VAL  47  55.710   1.663  -1.503
  404   HG12  VAL  47          HG12      VAL  47  56.121   0.912  -3.073
  405   HG13  VAL  47          HG13      VAL  47  55.502  -0.109  -1.720
  406   HG21  VAL  47          HG21      VAL  47  57.125   1.404   0.494
  407   HG22  VAL  47          HG22      VAL  47  57.137  -0.398   0.468
  408   HG23  VAL  47          HG23      VAL  47  58.684   0.523   0.439
  409    H    LEU  48           HN       LEU  48  56.423  -1.965  -3.578
  410    HA   LEU  48           HA       LEU  48  55.380  -3.763  -1.750
  411    HB2  LEU  48           HB1      LEU  48  55.589  -3.802  -4.800
  412    HB3  LEU  48           HB2      LEU  48  54.738  -5.091  -3.918
  413    HG   LEU  48           HG       LEU  48  54.062  -2.086  -3.719
  414   HD11  LEU  48          HD11      LEU  48  52.059  -2.660  -5.218
  415   HD12  LEU  48          HD12      LEU  48  53.639  -2.869  -6.057
  416   HD13  LEU  48          HD13      LEU  48  52.740  -4.309  -5.451
  417   HD21  LEU  48          HD21      LEU  48  51.879  -2.871  -2.752
  418   HD22  LEU  48          HD22      LEU  48  52.438  -4.573  -2.827
  419   HD23  LEU  48          HD23      LEU  48  53.285  -3.398  -1.758
  420    H    TYR  49           HN       TYR  49  58.193  -4.262  -4.096
  421    HA   TYR  49           HA       TYR  49  58.647  -6.876  -3.261
  422    HB2  TYR  49           HB1      TYR  49  60.534  -4.735  -4.410
  423    HB3  TYR  49           HB2      TYR  49  61.118  -6.383  -4.027
  424    HD1  TYR  49           HD1      TYR  49  60.126  -4.361  -6.636
  425    HD2  TYR  49           HD2      TYR  49  59.152  -8.225  -5.013
  426    HE1  TYR  49           HE1      TYR  49  59.430  -5.143  -8.886
  427    HE2  TYR  49           HE2      TYR  49  58.424  -8.977  -7.248
  428    HH   TYR  49           HH       TYR  49  58.259  -8.464  -9.433
  429    H    ARG  50           HN       ARG  50  59.893  -3.760  -1.856
  430    HA   ARG  50           HA       ARG  50  61.610  -4.959   0.010
  431    HB2  ARG  50           HB1      ARG  50  59.981  -2.376   0.093
  432    HB3  ARG  50           HB2      ARG  50  61.089  -2.802   1.419
  433    HG2  ARG  50           HG1      ARG  50  62.999  -2.879  -0.302
  434    HG3  ARG  50           HG2      ARG  50  61.854  -2.411  -1.572
  435    HD2  ARG  50           HD1      ARG  50  63.020  -0.379  -0.914
  436    HD3  ARG  50           HD2      ARG  50  61.317  -0.228  -0.314
  437    HE   ARG  50           HE       ARG  50  62.922  -1.515   1.671
  438   HH11  ARG  50          HH11      ARG  50  62.781   2.615   1.489
  439   HH12  ARG  50          HH12      ARG  50  62.430   1.598   0.113
  440   HH21  ARG  50          HH21      ARG  50  63.388   1.537   3.542
  441   HH22  ARG  50          HH22      ARG  50  63.411  -0.192   3.582
  442    H    HIS  51           HN       HIS  51  58.053  -4.177   0.351
  443    HA   HIS  51           HA       HIS  51  58.073  -5.149   3.010
  444    HB2  HIS  51           HB1      HIS  51  55.794  -4.440   1.131
  445    HB3  HIS  51           HB2      HIS  51  55.548  -5.006   2.806
  446    HD1  HIS  51           HD1      HIS  51  57.958  -3.385   4.156
  447    HD2  HIS  51           HD2      HIS  51  55.191  -1.702   1.487
  448    HE1  HIS  51           HE1      HIS  51  57.786  -0.874   4.655
  449    H    ASN  52           HN       ASN  52  57.589  -6.844  -0.171
  450    HA   ASN  52           HA       ASN  52  56.671  -9.179   1.044
  451    HB2  ASN  52           HB1      ASN  52  58.354  -8.644  -1.474
  452    HB3  ASN  52           HB2      ASN  52  57.892 -10.314  -1.025
  453   HD21  ASN  52          HD21      ASN  52  54.305  -8.625  -1.564
  454   HD22  ASN  52          HD22      ASN  52  55.176  -8.628  -0.051
  455    H    LEU  53           HN       LEU  53  60.139  -8.022   0.476
  456    HA   LEU  53           HA       LEU  53  61.240 -10.261   1.682
  457    HB2  LEU  53           HB1      LEU  53  62.263  -7.504   1.048
  458    HB3  LEU  53           HB2      LEU  53  63.234  -8.522   2.139
  459    HG   LEU  53           HG       LEU  53  63.990  -8.594  -0.150
  460   HD11  LEU  53          HD11      LEU  53  64.019 -11.185  -0.428
  461   HD12  LEU  53          HD12      LEU  53  64.413 -10.590   1.225
  462   HD13  LEU  53          HD13      LEU  53  62.780 -11.265   0.875
  463   HD21  LEU  53          HD21      LEU  53  62.782  -9.802  -2.017
  464   HD22  LEU  53          HD22      LEU  53  61.303  -9.882  -1.008
  465   HD23  LEU  53          HD23      LEU  53  61.957  -8.283  -1.513
  466    H    LYS  54           HN       LYS  54  60.488  -6.977   3.288
  467    HA   LYS  54           HA       LYS  54  60.245  -8.656   5.643
  468    HB2  LYS  54           HB1      LYS  54  61.187  -6.941   7.132
  469    HB3  LYS  54           HB2      LYS  54  62.414  -7.655   6.056
  470    HG2  LYS  54           HG1      LYS  54  62.478  -5.619   4.673
  471    HG3  LYS  54           HG2      LYS  54  61.037  -4.945   5.503
  472    HD2  LYS  54           HD1      LYS  54  62.258  -4.535   7.532
  473    HD3  LYS  54           HD2      LYS  54  63.560  -5.691   7.089
  474    HE2  LYS  54           HE1      LYS  54  64.370  -4.129   5.291
  475    HE3  LYS  54           HE2      LYS  54  63.044  -2.970   5.688
  476    HZ1  LYS  54           HZ1      LYS  54  65.112  -2.387   6.782
  477    HZ2  LYS  54           HZ2      LYS  54  63.934  -2.808   7.930
  478    HZ3  LYS  54           HZ3      LYS  54  65.178  -3.897   7.554
  479    H    GLY  55           HN       GLY  55  58.324  -8.498   6.542
  480    HA2  GLY  55           HA2      GLY  55  56.870  -5.943   6.345
  481    HA3  GLY  55           HA1      GLY  55  56.188  -7.567   6.789
  482    H    ARG  56           HN       ARG  56  56.862  -4.626   8.080
  483    HA   ARG  56           HA       ARG  56  58.069  -5.693  10.567
  484    HB2  ARG  56           HB1      ARG  56  59.184  -3.812   9.176
  485    HB3  ARG  56           HB2      ARG  56  57.775  -2.788   9.538
  486    HG2  ARG  56           HG1      ARG  56  59.610  -4.041  11.688
  487    HG3  ARG  56           HG2      ARG  56  59.921  -2.452  10.967
  488    HD2  ARG  56           HD1      ARG  56  57.444  -3.130  12.640
  489    HD3  ARG  56           HD2      ARG  56  58.863  -2.138  13.170
  490    HE   ARG  56           HE       ARG  56  56.730  -1.352  11.314
  491   HH11  ARG  56          HH11      ARG  56  59.955   1.043  12.272
  492   HH12  ARG  56          HH12      ARG  56  59.876  -0.638  12.739
  493   HH21  ARG  56          HH21      ARG  56  58.115   1.950  11.060
  494   HH22  ARG  56          HH22      ARG  56  56.798   0.905  10.656
  495    H    SER  57           HN       SER  57  56.711  -5.854  12.447
  496    HA   SER  57           HA       SER  57  54.147  -4.619  12.141
  497    HB2  SER  57           HB1      SER  57  53.972  -6.664  10.696
  498    HB3  SER  57           HB2      SER  57  54.585  -7.696  12.027
  499    HG   SER  57           HG       SER  57  52.243  -7.627  11.641
  500    H    ALA  58           HN       ALA  58  52.972  -4.480  14.008
  501    HA   ALA  58           HA       ALA  58  54.099  -5.624  16.505
  502    HB1  ALA  58           HB1      ALA  58  54.607  -3.168  16.373
  503    HB2  ALA  58           HB2      ALA  58  52.883  -2.823  16.006
  504    HB3  ALA  58           HB3      ALA  58  53.352  -3.477  17.621
  505    H    ARG  59           HN       ARG  59  52.233  -7.007  14.939
  506    HA   ARG  59           HA       ARG  59  49.748  -6.613  16.465
  507    HB2  ARG  59           HB1      ARG  59  49.524  -5.512  14.251
  508    HB3  ARG  59           HB2      ARG  59  49.993  -7.014  13.419
  509    HG2  ARG  59           HG1      ARG  59  47.577  -6.782  13.265
  510    HG3  ARG  59           HG2      ARG  59  47.893  -8.127  14.375
  511    HD2  ARG  59           HD1      ARG  59  46.200  -7.005  15.535
  512    HD3  ARG  59           HD2      ARG  59  47.673  -6.330  16.347
  513    HE   ARG  59           HE       ARG  59  45.990  -4.964  14.314
  514   HH11  ARG  59          HH11      ARG  59  48.808  -3.119  16.697
  515   HH12  ARG  59          HH12      ARG  59  48.603  -4.853  16.703
  516   HH21  ARG  59          HH21      ARG  59  47.401  -1.835  15.286
  517   HH22  ARG  59          HH22      ARG  59  46.253  -2.658  14.286
  518    H    LYS  60           HN       LYS  60  48.510  -8.425  16.734
  519    HA   LYS  60           HA       LYS  60  48.091 -10.459  17.422
  520    HB2  LYS  60           HB1      LYS  60  49.820 -11.361  15.082
  521    HB3  LYS  60           HB2      LYS  60  48.717 -12.421  16.000
  522    HG2  LYS  60           HG1      LYS  60  46.811 -10.713  15.312
  523    HG3  LYS  60           HG2      LYS  60  48.008 -10.022  14.167
  524    HD2  LYS  60           HD1      LYS  60  48.270 -12.420  13.212
  525    HD3  LYS  60           HD2      LYS  60  46.875 -12.892  14.240
  526    HE2  LYS  60           HE1      LYS  60  45.419 -11.190  13.081
  527    HE3  LYS  60           HE2      LYS  60  46.816 -10.685  12.056
  528    HZ1  LYS  60           HZ1      LYS  60  45.403 -12.278  10.935
  529    HZ2  LYS  60           HZ2      LYS  60  46.941 -12.944  11.211
  530    HZ3  LYS  60           HZ3      LYS  60  45.628 -13.416  12.175
  531    H    LEU  61           HN       LEU  61  50.627 -12.501  16.575
  532    HA   LEU  61           HA       LEU  61  51.211 -12.904  19.237
  533    HB2  LEU  61           HB1      LEU  61  52.610 -14.736  18.513
  534    HB3  LEU  61           HB2      LEU  61  51.077 -14.735  17.609
  535    HG   LEU  61           HG       LEU  61  53.689 -13.582  16.501
  536   HD11  LEU  61          HD11      LEU  61  53.915 -15.862  15.301
  537   HD12  LEU  61          HD12      LEU  61  54.075 -15.989  17.091
  538   HD13  LEU  61          HD13      LEU  61  52.538 -16.475  16.286
  539   HD21  LEU  61          HD21      LEU  61  52.679 -14.038  14.243
  540   HD22  LEU  61          HD22      LEU  61  51.168 -14.621  15.012
  541   HD23  LEU  61          HD23      LEU  61  51.666 -12.903  15.208
  542    H    GLU  62           HN       GLU  62  53.114 -10.911  16.855
  543    HA   GLU  62           HA       GLU  62  55.427 -11.181  18.555
  544    HB2  GLU  62           HB1      GLU  62  56.663 -10.018  16.831
  545    HB3  GLU  62           HB2      GLU  62  55.784 -11.400  16.142
  546    HG2  GLU  62           HG1      GLU  62  54.039  -9.810  15.231
  547    HG3  GLU  62           HG2      GLU  62  54.983  -8.415  15.877
  Start of MODEL    2
    1    H1   ALA   1           HT1      ALA   1  58.488   0.110  10.964
    2    H2   ALA   1           HT2      ALA   1  59.437   1.463  11.353
    3    H3   ALA   1           HT3      ALA   1  58.730   1.337   9.815
    4    HA   ALA   1           HA       ALA   1  56.528   1.494  10.762
    5    HB1  ALA   1           HB1      ALA   1  57.151   0.324  12.873
    6    HB2  ALA   1           HB2      ALA   1  58.052   1.777  13.423
    7    HB3  ALA   1           HB3      ALA   1  56.260   1.843  13.230
    8    H    SER   2           HN       SER   2  59.358   3.522  11.720
    9    HA   SER   2           HA       SER   2  57.751   5.815  12.082
   10    HB2  SER   2           HB1      SER   2  60.813   5.454  11.909
   11    HB3  SER   2           HB2      SER   2  60.046   6.998  12.394
   12    HG   SER   2           HG       SER   2  60.724   5.478  14.131
   13    H    MET   3           HN       MET   3  58.716   4.428   9.190
   14    HA   MET   3           HA       MET   3  59.855   6.649   7.903
   15    HB2  MET   3           HB1      MET   3  58.601   4.012   6.954
   16    HB3  MET   3           HB2      MET   3  59.347   5.147   5.799
   17    HG2  MET   3           HG1      MET   3  61.589   4.842   6.897
   18    HG3  MET   3           HG2      MET   3  60.844   3.896   8.226
   19    HE1  MET   3           HE1      MET   3  61.374   2.473   3.788
   20    HE2  MET   3           HE2      MET   3  60.231   3.778   4.253
   21    HE3  MET   3           HE3      MET   3  62.001   4.026   4.440
   22    H    VAL   4           HN       VAL   4  58.743   8.539   7.433
   23    HA   VAL   4           HA       VAL   4  56.549   8.158   5.561
   24    HB   VAL   4           HB       VAL   4  55.435   8.664   7.676
   25   HG11  VAL   4          HG11      VAL   4  55.770  10.936   8.751
   26   HG12  VAL   4          HG12      VAL   4  57.231   9.914   8.896
   27   HG13  VAL   4          HG13      VAL   4  57.176  11.237   7.671
   28   HG21  VAL   4          HG21      VAL   4  54.150  10.666   6.884
   29   HG22  VAL   4          HG22      VAL   4  55.368  10.902   5.578
   30   HG23  VAL   4          HG23      VAL   4  54.367   9.406   5.629
   31    H    LEU   5           HN       LEU   5  56.885   9.399   3.686
   32    HA   LEU   5           HA       LEU   5  58.802  11.584   3.950
   33    HB2  LEU   5           HB1      LEU   5  58.335   9.675   1.586
   34    HB3  LEU   5           HB2      LEU   5  59.305  11.159   1.439
   35    HG   LEU   5           HG       LEU   5  59.881   8.821   3.367
   36   HD11  LEU   5          HD11      LEU   5  61.819   8.287   1.766
   37   HD12  LEU   5          HD12      LEU   5  60.199   8.072   1.007
   38   HD13  LEU   5          HD13      LEU   5  61.186   9.534   0.633
   39   HD21  LEU   5          HD21      LEU   5  62.154   9.872   3.647
   40   HD22  LEU   5          HD22      LEU   5  61.657  11.254   2.620
   41   HD23  LEU   5          HD23      LEU   5  60.829  10.964   4.192
   42    H    SER   6           HN       SER   6  55.953  10.332   2.051
   43    HA   SER   6           HA       SER   6  55.284  13.120   1.473
   44    HB2  SER   6           HB1      SER   6  54.394  10.464   0.155
   45    HB3  SER   6           HB2      SER   6  53.683  12.047  -0.291
   46    HG   SER   6           HG       SER   6  55.488  11.204  -1.627
   47    HA   PRO   7           HA       PRO   7  52.886  12.794   4.809
   48    HB2  PRO   7           HB2      PRO   7  50.950  14.725   4.645
   49    HB3  PRO   7           HB1      PRO   7  52.722  15.088   4.650
   50    HG2  PRO   7           HG2      PRO   7  51.079  14.885   2.120
   51    HG3  PRO   7           HG1      PRO   7  52.186  16.217   2.656
   52    HD2  PRO   7           HD2      PRO   7  53.076  14.136   1.060
   53    HD3  PRO   7           HD1      PRO   7  54.147  14.959   2.295
   54    H    ARG   8           HN       ARG   8  50.609  12.493   1.957
   55    HA   ARG   8           HA       ARG   8  48.893  10.842   3.727
   56    HB2  ARG   8           HB2      ARG   8  48.463  12.020   0.891
   57    HB3  ARG   8           HB1      ARG   8  47.324  10.920   1.640
   58    HG2  ARG   8           HG2      ARG   8  46.952  12.617   3.532
   59    HG3  ARG   8           HG1      ARG   8  48.144  13.689   2.789
   60    HD2  ARG   8           HD2      ARG   8  46.692  13.803   0.688
   61    HD3  ARG   8           HD1      ARG   8  45.505  12.729   1.470
   62    HE   ARG   8           HE       ARG   8  45.951  14.957   3.305
   63   HH11  ARG   8          HH11      ARG   8  44.584  14.505   0.151
   64   HH12  ARG   8          HH12      ARG   8  43.482  15.953   0.339
   65   HH21  ARG   8          HH21      ARG   8  44.699  16.581   3.489
   66   HH22  ARG   8          HH22      ARG   8  43.564  17.058   2.150
   67    H    ASP   9           HN       ASP   9  50.843  10.543   0.545
   68    HA   ASP   9           HA       ASP   9  49.714   8.059   0.039
   69    HB2  ASP   9           HB1      ASP   9  50.781   9.550  -1.699
   70    HB3  ASP   9           HB2      ASP   9  52.387   9.273  -0.944
   71    H    GLU  10           HN       GLU  10  52.925   8.885   1.688
   72    HA   GLU  10           HA       GLU  10  53.570   6.175   2.013
   73    HB2  GLU  10           HB1      GLU  10  54.554   8.688   3.392
   74    HB3  GLU  10           HB2      GLU  10  55.165   7.072   3.813
   75    HG2  GLU  10           HG1      GLU  10  55.237   8.250   0.937
   76    HG3  GLU  10           HG2      GLU  10  56.630   8.323   2.081
   77    H    ARG  11           HN       ARG  11  51.712   8.482   4.100
   78    HA   ARG  11           HA       ARG  11  51.606   6.804   6.352
   79    HB2  ARG  11           HB1      ARG  11  50.996   9.223   6.335
   80    HB3  ARG  11           HB2      ARG  11  49.584   8.893   5.302
   81    HG2  ARG  11           HG1      ARG  11  48.635   7.426   7.188
   82    HG3  ARG  11           HG2      ARG  11  50.046   7.822   8.187
   83    HD2  ARG  11           HD1      ARG  11  49.529  10.273   8.115
   84    HD3  ARG  11           HD2      ARG  11  48.025   9.949   7.158
   85    HE   ARG  11           HE       ARG  11  47.960   8.219   9.372
   86   HH11  ARG  11          HH11      ARG  11  46.987  12.183  10.046
   87   HH12  ARG  11          HH12      ARG  11  48.014  11.676   8.728
   88   HH21  ARG  11          HH21      ARG  11  46.147  10.494  11.516
   89   HH22  ARG  11          HH22      ARG  11  46.556   8.845  11.190
   90    H    THR  12           HN       THR  12  49.232   7.039   3.539
   91    HA   THR  12           HA       THR  12  47.713   4.899   4.510
   92    HB   THR  12           HB       THR  12  48.063   5.965   1.695
   93    HG1  THR  12           HG1      THR  12  46.040   6.926   2.165
   94   HG21  THR  12          HG21      THR  12  45.825   4.800   1.215
   95   HG22  THR  12          HG22      THR  12  46.953   3.568   1.873
   96   HG23  THR  12          HG23      THR  12  45.689   4.287   2.935
   97    H    LEU  13           HN       LEU  13  50.509   4.934   2.136
   98    HA   LEU  13           HA       LEU  13  50.289   2.274   1.458
   99    HB2  LEU  13           HB1      LEU  13  51.654   3.864   0.173
  100    HB3  LEU  13           HB2      LEU  13  52.679   4.225   1.583
  101    HG   LEU  13           HG       LEU  13  53.601   1.934   1.494
  102   HD11  LEU  13          HD11      LEU  13  53.341   0.552  -0.657
  103   HD12  LEU  13          HD12      LEU  13  51.822   0.639   0.307
  104   HD13  LEU  13          HD13      LEU  13  52.015   1.654  -1.170
  105   HD21  LEU  13          HD21      LEU  13  55.018   2.309  -0.580
  106   HD22  LEU  13          HD22      LEU  13  53.875   3.579  -1.122
  107   HD23  LEU  13          HD23      LEU  13  54.796   3.797   0.410
  108    H    VAL  14           HN       VAL  14  52.277   3.726   4.177
  109    HA   VAL  14           HA       VAL  14  53.497   1.303   4.838
  110    HB   VAL  14           HB       VAL  14  53.031   3.865   6.365
  111   HG11  VAL  14          HG11      VAL  14  54.807   3.042   7.972
  112   HG12  VAL  14          HG12      VAL  14  53.316   2.057   8.072
  113   HG13  VAL  14          HG13      VAL  14  54.758   1.422   7.192
  114   HG21  VAL  14          HG21      VAL  14  55.562   4.076   5.850
  115   HG22  VAL  14          HG22      VAL  14  55.476   2.525   4.936
  116   HG23  VAL  14          HG23      VAL  14  54.582   3.975   4.353
  117    H    ARG  15           HN       ARG  15  50.477   2.867   6.248
  118    HA   ARG  15           HA       ARG  15  49.992   0.663   7.921
  119    HB2  ARG  15           HB1      ARG  15  48.259   2.874   6.766
  120    HB3  ARG  15           HB2      ARG  15  47.516   1.614   7.781
  121    HG2  ARG  15           HG1      ARG  15  49.914   3.402   8.632
  122    HG3  ARG  15           HG2      ARG  15  48.228   3.817   8.990
  123    HD2  ARG  15           HD1      ARG  15  49.369   1.094   9.880
  124    HD3  ARG  15           HD2      ARG  15  49.472   2.560  10.939
  125    HE   ARG  15           HE       ARG  15  46.838   2.505  10.072
  126   HH11  ARG  15          HH11      ARG  15  47.835  -0.436  12.808
  127   HH12  ARG  15          HH12      ARG  15  49.009   0.294  11.739
  128   HH21  ARG  15          HH21      ARG  15  45.568   0.301  12.640
  129   HH22  ARG  15          HH22      ARG  15  45.193   1.549  11.501
  130    H    LYS  16           HN       LYS  16  48.758   1.258   4.522
  131    HA   LYS  16           HA       LYS  16  46.755  -0.688   4.808
  132    HB2  LYS  16           HB1      LYS  16  46.745   1.260   3.196
  133    HB3  LYS  16           HB2      LYS  16  48.028   0.465   2.250
  134    HG2  LYS  16           HG1      LYS  16  45.962  -0.024   1.094
  135    HG3  LYS  16           HG2      LYS  16  46.384  -1.541   1.954
  136    HD2  LYS  16           HD1      LYS  16  44.090  -1.310   2.487
  137    HD3  LYS  16           HD2      LYS  16  44.872  -0.546   3.913
  138    HE2  LYS  16           HE1      LYS  16  44.487   1.739   2.937
  139    HE3  LYS  16           HE2      LYS  16  43.745   0.998   1.468
  140    HZ1  LYS  16           HZ1      LYS  16  42.083   1.686   3.071
  141    HZ2  LYS  16           HZ2      LYS  16  42.066  -0.003   2.889
  142    HZ3  LYS  16           HZ3      LYS  16  42.765   0.693   4.268
  143    H    VAL  17           HN       VAL  17  50.007  -0.791   3.299
  144    HA   VAL  17           HA       VAL  17  49.901  -3.432   2.388
  145    HB   VAL  17           HB       VAL  17  52.214  -1.607   3.044
  146   HG11  VAL  17          HG11      VAL  17  53.587  -3.152   1.580
  147   HG12  VAL  17          HG12      VAL  17  53.051  -3.966   3.080
  148   HG13  VAL  17          HG13      VAL  17  52.214  -4.311   1.519
  149   HG21  VAL  17          HG21      VAL  17  52.167  -1.416   0.455
  150   HG22  VAL  17          HG22      VAL  17  50.705  -2.470   0.439
  151   HG23  VAL  17          HG23      VAL  17  50.643  -0.839   1.199
  152    H    GLN  18           HN       GLN  18  50.929  -2.032   5.588
  153    HA   GLN  18           HA       GLN  18  52.094  -4.377   6.541
  154    HB2  GLN  18           HB1      GLN  18  52.170  -1.932   7.469
  155    HB3  GLN  18           HB2      GLN  18  50.560  -2.234   8.174
  156    HG2  GLN  18           HG1      GLN  18  52.266  -2.571   9.946
  157    HG3  GLN  18           HG2      GLN  18  51.616  -4.192   9.530
  158   HE21  GLN  18          HE21      GLN  18  55.307  -3.183   7.861
  159   HE22  GLN  18          HE22      GLN  18  53.991  -2.028   7.819
  160    H    ILE  19           HN       ILE  19  48.694  -3.135   6.822
  161    HA   ILE  19           HA       ILE  19  47.729  -5.390   8.164
  162    HB   ILE  19           HB       ILE  19  46.467  -3.262   6.430
  163   HG12  ILE  19          HG11      ILE  19  47.398  -2.308   8.449
  164   HG13  ILE  19          HG12      ILE  19  45.612  -2.309   8.596
  165   HG21  ILE  19          HG21      ILE  19  44.195  -3.991   7.300
  166   HG22  ILE  19          HG22      ILE  19  44.985  -5.409   6.539
  167   HG23  ILE  19          HG23      ILE  19  44.952  -5.253   8.334
  168   HD11  ILE  19          HD11      ILE  19  46.628  -2.939  10.744
  169   HD12  ILE  19          HD12      ILE  19  45.734  -4.351  10.072
  170   HD13  ILE  19          HD13      ILE  19  47.534  -4.290   9.979
  171    H    ASN  20           HN       ASN  20  47.917  -4.640   4.575
  172    HA   ASN  20           HA       ASN  20  47.017  -7.381   4.195
  173    HB2  ASN  20           HB1      ASN  20  45.182  -5.584   3.844
  174    HB3  ASN  20           HB2      ASN  20  46.172  -4.896   2.520
  175   HD21  ASN  20          HD21      ASN  20  44.047  -8.441   2.122
  176   HD22  ASN  20          HD22      ASN  20  44.322  -7.714   3.686
  177    HA   PRO  21           HA       PRO  21  50.956  -6.477   2.019
  178    HB2  PRO  21           HB2      PRO  21  52.307  -8.818   2.417
  179    HB3  PRO  21           HB1      PRO  21  52.065  -7.593   3.725
  180    HG2  PRO  21           HG2      PRO  21  50.346 -10.073   3.271
  181    HG3  PRO  21           HG1      PRO  21  51.139  -9.523   4.807
  182    HD2  PRO  21           HD2      PRO  21  48.525  -8.840   4.209
  183    HD3  PRO  21           HD1      PRO  21  49.642  -7.746   5.160
  184    H    ARG  22           HN       ARG  22  48.467  -8.692   1.291
  185    HA   ARG  22           HA       ARG  22  49.436  -9.970  -1.022
  186    HB2  ARG  22           HB1      ARG  22  47.408 -10.644   0.275
  187    HB3  ARG  22           HB2      ARG  22  46.551  -9.186  -0.281
  188    HG2  ARG  22           HG1      ARG  22  46.906 -10.032  -2.712
  189    HG3  ARG  22           HG2      ARG  22  47.641 -11.505  -2.055
  190    HD2  ARG  22           HD1      ARG  22  45.455 -12.256  -2.421
  191    HD3  ARG  22           HD2      ARG  22  45.369 -11.814  -0.667
  192    HE   ARG  22           HE       ARG  22  44.086  -9.967  -1.128
  193   HH11  ARG  22          HH11      ARG  22  42.589  -9.022  -4.266
  194   HH12  ARG  22          HH12      ARG  22  42.587  -8.824  -2.530
  195   HH21  ARG  22          HH21      ARG  22  44.125 -10.577  -5.208
  196   HH22  ARG  22          HH22      ARG  22  45.205 -11.419  -4.150
  197    H    THR  23           HN       THR  23  48.119  -6.671  -0.555
  198    HA   THR  23           HA       THR  23  47.098  -6.432  -3.132
  199    HB   THR  23           HB       THR  23  46.301  -5.199  -1.144
  200    HG1  THR  23           HG1      THR  23  46.025  -3.213  -2.222
  201   HG21  THR  23          HG21      THR  23  47.525  -3.094  -0.426
  202   HG22  THR  23          HG22      THR  23  48.643  -4.491  -0.274
  203   HG23  THR  23          HG23      THR  23  48.795  -3.366  -1.671
  204    H    THR  24           HN       THR  24  47.656  -4.587  -4.729
  205    HA   THR  24           HA       THR  24  50.516  -4.611  -5.183
  206    HB   THR  24           HB       THR  24  49.592  -6.675  -6.180
  207    HG1  THR  24           HG1      THR  24  50.381  -6.304  -8.283
  208   HG21  THR  24          HG21      THR  24  48.043  -6.539  -8.165
  209   HG22  THR  24          HG22      THR  24  47.268  -5.741  -6.755
  210   HG23  THR  24          HG23      THR  24  48.007  -4.742  -8.058
  211    H    ALA  25           HN       ALA  25  50.767  -3.491  -7.557
  212    HA   ALA  25           HA       ALA  25  50.604  -0.799  -6.832
  213    HB1  ALA  25           HB1      ALA  25  52.420  -1.812  -8.194
  214    HB2  ALA  25           HB2      ALA  25  51.272  -2.057  -9.554
  215    HB3  ALA  25           HB3      ALA  25  51.704  -0.386  -9.024
  216    H    LYS  26           HN       LYS  26  48.427  -2.672  -8.936
  217    HA   LYS  26           HA       LYS  26  47.140  -0.543 -10.180
  218    HB2  LYS  26           HB1      LYS  26  46.177  -3.331  -9.348
  219    HB3  LYS  26           HB2      LYS  26  45.180  -2.244 -10.350
  220    HG2  LYS  26           HG1      LYS  26  47.072  -2.204 -12.092
  221    HG3  LYS  26           HG2      LYS  26  48.000  -3.348 -11.067
  222    HD2  LYS  26           HD1      LYS  26  46.027  -4.983 -11.266
  223    HD3  LYS  26           HD2      LYS  26  45.256  -3.831 -12.408
  224    HE2  LYS  26           HE1      LYS  26  47.234  -4.041 -13.972
  225    HE3  LYS  26           HE2      LYS  26  48.007  -5.208 -12.832
  226    HZ1  LYS  26           HZ1      LYS  26  46.803  -6.327 -14.592
  227    HZ2  LYS  26           HZ2      LYS  26  46.083  -6.646 -13.088
  228    HZ3  LYS  26           HZ3      LYS  26  45.359  -5.549 -14.158
  229    H    ASP  27           HN       ASP  27  46.435  -2.128  -6.957
  230    HA   ASP  27           HA       ASP  27  44.223  -0.516  -6.402
  231    HB2  ASP  27           HB1      ASP  27  44.789  -2.744  -5.317
  232    HB3  ASP  27           HB2      ASP  27  46.212  -1.981  -4.528
  233    H    LEU  28           HN       LEU  28  47.784  -0.091  -5.686
  234    HA   LEU  28           HA       LEU  28  47.467   2.199  -4.176
  235    HB2  LEU  28           HB1      LEU  28  49.758   1.013  -5.770
  236    HB3  LEU  28           HB2      LEU  28  49.946   2.662  -5.129
  237    HG   LEU  28           HG       LEU  28  50.973   0.844  -3.817
  238   HD11  LEU  28          HD11      LEU  28  50.119   1.738  -1.524
  239   HD12  LEU  28          HD12      LEU  28  50.508   3.010  -2.738
  240   HD13  LEU  28          HD13      LEU  28  48.792   2.562  -2.419
  241   HD21  LEU  28          HD21      LEU  28  49.626  -0.564  -2.199
  242   HD22  LEU  28          HD22      LEU  28  48.112  -0.046  -3.007
  243   HD23  LEU  28          HD23      LEU  28  49.332  -1.003  -3.921
  244    H    VAL  29           HN       VAL  29  47.982   1.985  -7.850
  245    HA   VAL  29           HA       VAL  29  48.189   4.745  -8.114
  246    HB   VAL  29           HB       VAL  29  48.989   3.234  -9.791
  247   HG11  VAL  29          HG11      VAL  29  47.396   2.288 -11.499
  248   HG12  VAL  29          HG12      VAL  29  47.186   1.515  -9.899
  249   HG13  VAL  29          HG13      VAL  29  46.004   2.757 -10.462
  250   HG21  VAL  29          HG21      VAL  29  48.158   4.613 -11.755
  251   HG22  VAL  29          HG22      VAL  29  46.887   5.319 -10.689
  252   HG23  VAL  29          HG23      VAL  29  48.630   5.613 -10.345
  253    H    LYS  30           HN       LYS  30  45.202   2.637  -8.210
  254    HA   LYS  30           HA       LYS  30  43.475   4.743  -8.821
  255    HB2  LYS  30           HB1      LYS  30  42.979   2.300  -9.037
  256    HB3  LYS  30           HB2      LYS  30  43.067   2.106  -7.267
  257    HG2  LYS  30           HG1      LYS  30  41.045   3.611  -7.018
  258    HG3  LYS  30           HG2      LYS  30  40.995   3.832  -8.799
  259    HD2  LYS  30           HD1      LYS  30  40.872   1.184  -8.892
  260    HD3  LYS  30           HD2      LYS  30  40.499   1.280  -7.138
  261    HE2  LYS  30           HE1      LYS  30  38.850   2.686  -9.354
  262    HE3  LYS  30           HE2      LYS  30  38.414   1.116  -8.577
  263    HZ1  LYS  30           HZ1      LYS  30  37.293   2.974  -7.552
  264    HZ2  LYS  30           HZ2      LYS  30  38.361   2.248  -6.449
  265    HZ3  LYS  30           HZ3      LYS  30  38.772   3.722  -7.182
  266    H    MET  31           HN       MET  31  44.554   3.429  -5.625
  267    HA   MET  31           HA       MET  31  42.936   5.061  -4.075
  268    HB2  MET  31           HB1      MET  31  43.928   2.937  -3.354
  269    HB3  MET  31           HB2      MET  31  45.573   3.612  -3.468
  270    HG2  MET  31           HG1      MET  31  45.154   5.108  -1.533
  271    HG3  MET  31           HG2      MET  31  43.401   4.733  -1.563
  272    HE1  MET  31           HE1      MET  31  46.771   1.664  -0.437
  273    HE2  MET  31           HE2      MET  31  46.446   2.209  -2.119
  274    HE3  MET  31           HE3      MET  31  47.086   3.369  -0.905
  275    H    LEU  32           HN       LEU  32  46.426   5.646  -5.168
  276    HA   LEU  32           HA       LEU  32  46.618   7.972  -3.634
  277    HB2  LEU  32           HB1      LEU  32  48.680   8.414  -4.748
  278    HB3  LEU  32           HB2      LEU  32  48.594   6.682  -4.349
  279    HG   LEU  32           HG       LEU  32  47.695   6.552  -6.883
  280   HD11  LEU  32          HD11      LEU  32  49.149   8.085  -8.356
  281   HD12  LEU  32          HD12      LEU  32  47.902   8.993  -7.426
  282   HD13  LEU  32          HD13      LEU  32  49.621   9.005  -6.883
  283   HD21  LEU  32          HD21      LEU  32  50.067   5.972  -7.558
  284   HD22  LEU  32          HD22      LEU  32  50.679   6.712  -6.044
  285   HD23  LEU  32          HD23      LEU  32  49.601   5.272  -5.965
  286    H    GLU  33           HN       GLU  33  45.458   7.472  -7.065
  287    HA   GLU  33           HA       GLU  33  45.208  10.193  -7.654
  288    HB2  GLU  33           HB1      GLU  33  43.752   7.722  -8.699
  289    HB3  GLU  33           HB2      GLU  33  43.435   9.348  -9.342
  290    HG2  GLU  33           HG1      GLU  33  45.875   9.560 -10.015
  291    HG3  GLU  33           HG2      GLU  33  46.209   7.909  -9.365
  292    H    GLU  34           HN       GLU  34  42.821   7.875  -6.133
  293    HA   GLU  34           HA       GLU  34  40.758   9.729  -5.870
  294    HB2  GLU  34           HB1      GLU  34  40.512   7.249  -5.642
  295    HB3  GLU  34           HB2      GLU  34  41.511   7.266  -4.170
  296    HG2  GLU  34           HG1      GLU  34  39.134   7.067  -3.559
  297    HG3  GLU  34           HG2      GLU  34  39.693   8.696  -3.019
  298    H    THR  35           HN       THR  35  43.497   8.936  -3.638
  299    HA   THR  35           HA       THR  35  42.716  10.656  -1.594
  300    HB   THR  35           HB       THR  35  45.465   9.662  -2.435
  301    HG1  THR  35           HG1      THR  35  45.124   8.213  -0.700
  302   HG21  THR  35          HG21      THR  35  46.189  10.173  -0.036
  303   HG22  THR  35          HG22      THR  35  45.507  11.679  -0.738
  304   HG23  THR  35          HG23      THR  35  44.518  10.686   0.394
  305    H    GLY  36           HN       GLY  36  44.874  11.269  -4.445
  306    HA2  GLY  36           HA2      GLY  36  44.810  13.338  -5.482
  307    HA3  GLY  36           HA1      GLY  36  44.496  14.101  -3.864
  308    H    THR  37           HN       THR  37  47.023  11.668  -3.954
  309    HA   THR  37           HA       THR  37  49.027  13.808  -4.073
  310    HB   THR  37           HB       THR  37  49.052  11.122  -2.602
  311    HG1  THR  37           HG1      THR  37  49.221  12.444  -0.743
  312   HG21  THR  37          HG21      THR  37  51.298  11.841  -1.641
  313   HG22  THR  37          HG22      THR  37  51.398  11.934  -3.432
  314   HG23  THR  37          HG23      THR  37  51.179  13.437  -2.465
  315    H    LYS  38           HN       LYS  38  50.522  13.647  -5.763
  316    HA   LYS  38           HA       LYS  38  50.376  11.143  -7.238
  317    HB2  LYS  38           HB1      LYS  38  51.645  13.853  -7.896
  318    HB3  LYS  38           HB2      LYS  38  51.771  12.436  -8.969
  319    HG2  LYS  38           HG1      LYS  38  49.200  12.401  -9.120
  320    HG3  LYS  38           HG2      LYS  38  49.156  13.880  -8.105
  321    HD2  LYS  38           HD1      LYS  38  50.472  15.115  -9.848
  322    HD3  LYS  38           HD2      LYS  38  50.601  13.616 -10.829
  323    HE2  LYS  38           HE1      LYS  38  48.068  13.575 -11.071
  324    HE3  LYS  38           HE2      LYS  38  47.974  15.124 -10.150
  325    HZ1  LYS  38           HZ1      LYS  38  47.995  15.489 -12.533
  326    HZ2  LYS  38           HZ2      LYS  38  49.394  16.139 -11.824
  327    HZ3  LYS  38           HZ3      LYS  38  49.479  14.682 -12.686
  328    H    VAL  39           HN       VAL  39  51.924   9.625  -7.156
  329    HA   VAL  39           HA       VAL  39  54.691  10.418  -6.648
  330    HB   VAL  39           HB       VAL  39  55.135   8.334  -5.447
  331   HG11  VAL  39          HG11      VAL  39  54.028   9.020  -3.244
  332   HG12  VAL  39          HG12      VAL  39  54.737  10.423  -4.099
  333   HG13  VAL  39          HG13      VAL  39  52.955  10.144  -4.149
  334   HG21  VAL  39          HG21      VAL  39  53.161   7.023  -4.487
  335   HG22  VAL  39          HG22      VAL  39  52.038   8.039  -5.463
  336   HG23  VAL  39          HG23      VAL  39  53.217   6.948  -6.276
  337    H    SER  40           HN       SER  40  56.247   8.802  -7.636
  338    HA   SER  40           HA       SER  40  55.318   7.853 -10.096
  339    HB2  SER  40           HB1      SER  40  57.870   7.194  -8.490
  340    HB3  SER  40           HB2      SER  40  57.644   6.705 -10.200
  341    HG   SER  40           HG       SER  40  58.807   8.763  -9.757
  342    H    ILE  41           HN       ILE  41  55.032   5.723 -10.921
  343    HA   ILE  41           HA       ILE  41  53.832   3.906  -9.185
  344    HB   ILE  41           HB       ILE  41  54.837   3.752 -12.023
  345   HG12  ILE  41          HG11      ILE  41  53.037   5.367 -11.775
  346   HG13  ILE  41          HG12      ILE  41  52.426   3.939 -12.671
  347   HG21  ILE  41          HG21      ILE  41  53.474   1.621 -12.300
  348   HG22  ILE  41          HG22      ILE  41  54.616   1.381 -10.940
  349   HG23  ILE  41          HG23      ILE  41  52.882   1.736 -10.605
  350   HD11  ILE  41          HD11      ILE  41  50.720   4.727 -11.091
  351   HD12  ILE  41          HD12      ILE  41  51.302   3.103 -10.574
  352   HD13  ILE  41          HD13      ILE  41  51.857   4.584  -9.706
  353    H    SER  42           HN       SER  42  57.184   3.987 -10.554
  354    HA   SER  42           HA       SER  42  57.762   1.354  -9.963
  355    HB2  SER  42           HB1      SER  42  59.616   3.799 -10.211
  356    HB3  SER  42           HB2      SER  42  60.233   2.117 -10.160
  357    HG   SER  42           HG       SER  42  59.825   3.109 -12.319
  358    H    THR  43           HN       THR  43  58.269   4.320  -7.870
  359    HA   THR  43           HA       THR  43  59.761   2.890  -5.984
  360    HB   THR  43           HB       THR  43  59.912   5.296  -6.242
  361    HG1  THR  43           HG1      THR  43  59.878   5.757  -4.009
  362   HG21  THR  43          HG21      THR  43  58.195   6.821  -5.225
  363   HG22  THR  43          HG22      THR  43  57.408   5.810  -6.483
  364   HG23  THR  43          HG23      THR  43  57.177   5.418  -4.741
  365    H    VAL  44           HN       VAL  44  56.125   3.428  -6.194
  366    HA   VAL  44           HA       VAL  44  55.708   2.297  -3.640
  367    HB   VAL  44           HB       VAL  44  53.374   2.111  -4.206
  368   HG11  VAL  44          HG11      VAL  44  53.055   4.636  -4.570
  369   HG12  VAL  44          HG12      VAL  44  54.313   4.292  -3.346
  370   HG13  VAL  44          HG13      VAL  44  54.790   4.772  -5.018
  371   HG21  VAL  44          HG21      VAL  44  52.481   3.035  -6.355
  372   HG22  VAL  44          HG22      VAL  44  54.156   3.085  -7.019
  373   HG23  VAL  44          HG23      VAL  44  53.396   1.511  -6.585
  374    H    LYS  45           HN       LYS  45  55.832   0.892  -6.976
  375    HA   LYS  45           HA       LYS  45  55.206  -1.725  -6.249
  376    HB2  LYS  45           HB1      LYS  45  55.255  -0.887  -8.588
  377    HB3  LYS  45           HB2      LYS  45  57.018  -0.642  -8.491
  378    HG2  LYS  45           HG1      LYS  45  57.308  -3.161  -8.120
  379    HG3  LYS  45           HG2      LYS  45  55.529  -3.365  -8.245
  380    HD2  LYS  45           HD1      LYS  45  57.240  -2.147 -10.497
  381    HD3  LYS  45           HD2      LYS  45  57.007  -3.919 -10.312
  382    HE2  LYS  45           HE1      LYS  45  54.492  -3.584 -10.495
  383    HE3  LYS  45           HE2      LYS  45  54.771  -1.823 -10.776
  384    HZ1  LYS  45           HZ1      LYS  45  54.566  -3.047 -12.845
  385    HZ2  LYS  45           HZ2      LYS  45  56.129  -2.403 -12.692
  386    HZ3  LYS  45           HZ3      LYS  45  55.865  -4.057 -12.425
  387    H    ARG  46           HN       ARG  46  58.355  -0.028  -6.289
  388    HA   ARG  46           HA       ARG  46  60.023  -2.189  -5.650
  389    HB2  ARG  46           HB1      ARG  46  60.744   0.086  -6.464
  390    HB3  ARG  46           HB2      ARG  46  60.191   0.832  -4.945
  391    HG2  ARG  46           HG1      ARG  46  62.020  -0.852  -3.877
  392    HG3  ARG  46           HG2      ARG  46  62.670  -0.859  -5.527
  393    HD2  ARG  46           HD1      ARG  46  62.354   1.791  -5.505
  394    HD3  ARG  46           HD2      ARG  46  62.338   1.631  -3.701
  395    HE   ARG  46           HE       ARG  46  64.526   0.150  -4.633
  396   HH11  ARG  46          HH11      ARG  46  66.819   2.988  -4.508
  397   HH12  ARG  46          HH12      ARG  46  66.668   1.249  -4.566
  398   HH21  ARG  46          HH21      ARG  46  64.820   4.280  -4.447
  399   HH22  ARG  46          HH22      ARG  46  63.301   3.453  -4.503
  400    H    VAL  47           HN       VAL  47  58.345   0.137  -3.426
  401    HA   VAL  47           HA       VAL  47  59.324  -0.951  -1.055
  402    HB   VAL  47           HB       VAL  47  56.843   0.643  -1.731
  403   HG11  VAL  47          HG11      VAL  47  56.678   1.130   0.753
  404   HG12  VAL  47          HG12      VAL  47  56.356  -0.593   0.395
  405   HG13  VAL  47          HG13      VAL  47  57.953  -0.095   1.075
  406   HG21  VAL  47          HG21      VAL  47  58.274   2.484  -0.611
  407   HG22  VAL  47          HG22      VAL  47  59.609   1.289  -0.424
  408   HG23  VAL  47          HG23      VAL  47  59.071   1.802  -2.064
  409    H    LEU  48           HN       LEU  48  56.249  -1.747  -2.901
  410    HA   LEU  48           HA       LEU  48  55.413  -3.711  -1.138
  411    HB2  LEU  48           HB1      LEU  48  55.106  -3.306  -4.171
  412    HB3  LEU  48           HB2      LEU  48  54.286  -4.655  -3.351
  413    HG   LEU  48           HG       LEU  48  53.880  -1.705  -2.514
  414   HD11  LEU  48          HD11      LEU  48  51.760  -1.800  -3.939
  415   HD12  LEU  48          HD12      LEU  48  53.250  -1.934  -4.941
  416   HD13  LEU  48          HD13      LEU  48  52.275  -3.403  -4.575
  417   HD21  LEU  48          HD21      LEU  48  51.743  -2.585  -1.560
  418   HD22  LEU  48          HD22      LEU  48  52.145  -4.244  -2.108
  419   HD23  LEU  48          HD23      LEU  48  53.167  -3.438  -0.864
  420    H    TYR  49           HN       TYR  49  57.584  -3.990  -4.034
  421    HA   TYR  49           HA       TYR  49  57.794  -6.765  -3.957
  422    HB2  TYR  49           HB1      TYR  49  58.366  -5.310  -5.947
  423    HB3  TYR  49           HB2      TYR  49  59.751  -4.615  -5.051
  424    HD1  TYR  49           HD1      TYR  49  58.282  -7.759  -6.438
  425    HD2  TYR  49           HD2      TYR  49  61.864  -5.860  -5.001
  426    HE1  TYR  49           HE1      TYR  49  59.639  -9.648  -7.311
  427    HE2  TYR  49           HE2      TYR  49  63.206  -7.756  -5.859
  428    HH   TYR  49           HH       TYR  49  63.203  -9.676  -6.990
  429    H    ARG  50           HN       ARG  50  59.929  -4.209  -2.448
  430    HA   ARG  50           HA       ARG  50  61.661  -6.064  -1.264
  431    HB2  ARG  50           HB1      ARG  50  60.897  -3.235  -0.518
  432    HB3  ARG  50           HB2      ARG  50  62.050  -4.156   0.476
  433    HG2  ARG  50           HG1      ARG  50  63.292  -4.572  -1.887
  434    HG3  ARG  50           HG2      ARG  50  62.298  -3.225  -2.470
  435    HD2  ARG  50           HD1      ARG  50  63.321  -1.583  -1.152
  436    HD3  ARG  50           HD2      ARG  50  63.832  -2.736   0.148
  437    HE   ARG  50           HE       ARG  50  65.254  -2.104  -2.317
  438   HH11  ARG  50          HH11      ARG  50  66.290  -5.243   0.175
  439   HH12  ARG  50          HH12      ARG  50  64.790  -4.364   0.346
  440   HH21  ARG  50          HH21      ARG  50  67.774  -4.589  -1.564
  441   HH22  ARG  50          HH22      ARG  50  67.298  -3.300  -2.616
  442    H    HIS  51           HN       HIS  51  58.587  -4.626   0.126
  443    HA   HIS  51           HA       HIS  51  58.901  -5.889   2.608
  444    HB2  HIS  51           HB1      HIS  51  57.312  -3.946   2.017
  445    HB3  HIS  51           HB2      HIS  51  56.245  -5.157   1.253
  446    HD1  HIS  51           HD1      HIS  51  55.682  -7.285   3.230
  447    HD2  HIS  51           HD2      HIS  51  56.591  -3.421   4.585
  448    HE1  HIS  51           HE1      HIS  51  54.752  -7.029   5.605
  449    H    ASN  52           HN       ASN  52  57.330  -7.119  -0.484
  450    HA   ASN  52           HA       ASN  52  56.549  -9.516   0.682
  451    HB2  ASN  52           HB1      ASN  52  57.410  -8.732  -2.180
  452    HB3  ASN  52           HB2      ASN  52  56.816 -10.384  -1.827
  453   HD21  ASN  52          HD21      ASN  52  53.540  -8.375  -0.918
  454   HD22  ASN  52          HD22      ASN  52  54.771  -8.916   0.196
  455    H    LEU  53           HN       LEU  53  59.737  -8.606  -0.873
  456    HA   LEU  53           HA       LEU  53  60.757 -11.212  -0.792
  457    HB2  LEU  53           HB1      LEU  53  61.508  -9.355  -2.319
  458    HB3  LEU  53           HB2      LEU  53  62.162  -8.464  -0.925
  459    HG   LEU  53           HG       LEU  53  63.737  -9.502  -2.416
  460   HD11  LEU  53          HD11      LEU  53  65.321 -10.647  -0.694
  461   HD12  LEU  53          HD12      LEU  53  64.656  -9.056  -0.172
  462   HD13  LEU  53          HD13      LEU  53  63.967 -10.584   0.489
  463   HD21  LEU  53          HD21      LEU  53  64.221 -12.032  -2.316
  464   HD22  LEU  53          HD22      LEU  53  62.694 -12.240  -1.401
  465   HD23  LEU  53          HD23      LEU  53  62.651 -11.580  -3.075
  466    H    LYS  54           HN       LYS  54  61.201  -8.399   1.482
  467    HA   LYS  54           HA       LYS  54  62.298 -10.323   3.394
  468    HB2  LYS  54           HB1      LYS  54  63.397  -8.414   4.540
  469    HB3  LYS  54           HB2      LYS  54  64.038  -8.682   2.899
  470    HG2  LYS  54           HG1      LYS  54  62.793  -6.715   2.041
  471    HG3  LYS  54           HG2      LYS  54  61.918  -6.536   3.598
  472    HD2  LYS  54           HD1      LYS  54  64.007  -5.928   4.754
  473    HD3  LYS  54           HD2      LYS  54  64.980  -6.325   3.297
  474    HE2  LYS  54           HE1      LYS  54  64.790  -3.875   3.482
  475    HE3  LYS  54           HE2      LYS  54  63.826  -4.412   2.055
  476    HZ1  LYS  54           HZ1      LYS  54  62.636  -2.825   3.403
  477    HZ2  LYS  54           HZ2      LYS  54  61.848  -4.328   3.429
  478    HZ3  LYS  54           HZ3      LYS  54  62.756  -3.824   4.769
  479    H    GLY  55           HN       GLY  55  61.159 -10.752   5.203
  480    HA2  GLY  55           HA2      GLY  55  58.764  -9.220   5.732
  481    HA3  GLY  55           HA1      GLY  55  59.377 -10.702   6.586
  482    H    ARG  56           HN       ARG  56  59.241  -7.287   6.470
  483    HA   ARG  56           HA       ARG  56  61.604  -6.507   7.733
  484    HB2  ARG  56           HB1      ARG  56  60.186  -5.078   6.295
  485    HB3  ARG  56           HB2      ARG  56  58.850  -5.130   7.469
  486    HG2  ARG  56           HG1      ARG  56  59.893  -2.969   7.686
  487    HG3  ARG  56           HG2      ARG  56  60.380  -3.880   9.127
  488    HD2  ARG  56           HD1      ARG  56  62.610  -4.341   8.309
  489    HD3  ARG  56           HD2      ARG  56  62.239  -3.698   6.656
  490    HE   ARG  56           HE       ARG  56  61.548  -1.723   8.598
  491   HH11  ARG  56          HH11      ARG  56  65.495  -1.993   7.401
  492   HH12  ARG  56          HH12      ARG  56  64.411  -3.363   7.384
  493   HH21  ARG  56          HH21      ARG  56  64.619   0.109   8.139
  494   HH22  ARG  56          HH22      ARG  56  62.947   0.191   8.580
  495    H    SER  57           HN       SER  57  58.375  -7.148   9.180
  496    HA   SER  57           HA       SER  57  59.077  -6.457  11.760
  497    HB2  SER  57           HB1      SER  57  57.026  -7.815  12.395
  498    HB3  SER  57           HB2      SER  57  56.696  -6.636  11.087
  499    HG   SER  57           HG       SER  57  55.926  -8.890  10.796
  500    H    ALA  58           HN       ALA  58  60.007  -9.338   9.986
  501    HA   ALA  58           HA       ALA  58  60.594 -10.794  12.481
  502    HB1  ALA  58           HB1      ALA  58  59.221 -12.000  10.781
  503    HB2  ALA  58           HB2      ALA  58  60.501 -11.733   9.548
  504    HB3  ALA  58           HB3      ALA  58  60.826 -12.785  10.978
  505    H    ARG  59           HN       ARG  59  62.237 -10.307   9.236
  506    HA   ARG  59           HA       ARG  59  64.671  -9.587  10.569
  507    HB2  ARG  59           HB1      ARG  59  66.056 -11.426   9.806
  508    HB3  ARG  59           HB2      ARG  59  64.828 -12.064  10.924
  509    HG2  ARG  59           HG1      ARG  59  63.466 -12.792   8.853
  510    HG3  ARG  59           HG2      ARG  59  64.799 -12.235   7.824
  511    HD2  ARG  59           HD1      ARG  59  66.430 -13.765   9.070
  512    HD3  ARG  59           HD2      ARG  59  65.021 -14.520   9.920
  513    HE   ARG  59           HE       ARG  59  65.760 -14.801   7.100
  514   HH11  ARG  59          HH11      ARG  59  62.290 -16.357   8.712
  515   HH12  ARG  59          HH12      ARG  59  63.248 -15.158   9.547
  516   HH21  ARG  59          HH21      ARG  59  63.079 -17.143   6.606
  517   HH22  ARG  59          HH22      ARG  59  64.540 -16.470   5.969
  518    H    LYS  60           HN       LYS  60  66.438  -9.076   9.029
  519    HA   LYS  60           HA       LYS  60  65.563  -7.949   6.634
  520    HB2  LYS  60           HB1      LYS  60  67.551  -7.172   7.879
  521    HB3  LYS  60           HB2      LYS  60  68.375  -8.731   7.618
  522    HG2  LYS  60           HG1      LYS  60  69.278  -6.984   6.086
  523    HG3  LYS  60           HG2      LYS  60  68.463  -8.271   5.137
  524    HD2  LYS  60           HD1      LYS  60  66.462  -6.829   4.853
  525    HD3  LYS  60           HD2      LYS  60  67.166  -5.586   5.941
  526    HE2  LYS  60           HE1      LYS  60  67.418  -4.862   3.584
  527    HE3  LYS  60           HE2      LYS  60  69.050  -5.221   4.269
  528    HZ1  LYS  60           HZ1      LYS  60  68.754  -6.188   2.085
  529    HZ2  LYS  60           HZ2      LYS  60  68.933  -7.408   3.253
  530    HZ3  LYS  60           HZ3      LYS  60  67.401  -7.069   2.610
  531    H    LEU  61           HN       LEU  61  67.009 -11.074   7.346
  532    HA   LEU  61           HA       LEU  61  67.385 -12.957   6.279
  533    HB2  LEU  61           HB1      LEU  61  65.133 -12.686   5.276
  534    HB3  LEU  61           HB2      LEU  61  65.845 -11.810   3.901
  535    HG   LEU  61           HG       LEU  61  66.788 -14.622   4.602
  536   HD11  LEU  61          HD11      LEU  61  64.931 -15.506   3.034
  537   HD12  LEU  61          HD12      LEU  61  64.287 -14.779   4.551
  538   HD13  LEU  61          HD13      LEU  61  64.219 -13.853   3.006
  539   HD21  LEU  61          HD21      LEU  61  67.104 -14.863   2.121
  540   HD22  LEU  61          HD22      LEU  61  66.499 -13.196   1.860
  541   HD23  LEU  61          HD23      LEU  61  68.025 -13.461   2.777
  542    H    GLU  62           HN       GLU  62  69.443 -13.585   5.619
  543    HA   GLU  62           HA       GLU  62  71.168 -11.531   4.870
  544    HB2  GLU  62           HB1      GLU  62  71.770 -13.441   6.336
  545    HB3  GLU  62           HB2      GLU  62  71.587 -14.573   4.977
  546    HG2  GLU  62           HG1      GLU  62  73.491 -13.446   3.762
  547    HG3  GLU  62           HG2      GLU  62  73.673 -12.256   5.107
  Start of MODEL    3
    1    H1   ALA   1           HT1      ALA   1  43.095  14.409  10.693
    2    H2   ALA   1           HT2      ALA   1  42.762  13.660  12.120
    3    H3   ALA   1           HT3      ALA   1  43.166  12.768  10.789
    4    HA   ALA   1           HA       ALA   1  44.909  14.656  12.210
    5    HB1  ALA   1           HB1      ALA   1  44.567  12.628  13.527
    6    HB2  ALA   1           HB2      ALA   1  46.233  12.733  12.925
    7    HB3  ALA   1           HB3      ALA   1  45.071  11.616  12.156
    8    H    SER   2           HN       SER   2  45.424  11.861   9.895
    9    HA   SER   2           HA       SER   2  46.730  13.768   8.029
   10    HB2  SER   2           HB2      SER   2  48.558  12.079   7.711
   11    HB3  SER   2           HB1      SER   2  48.565  12.877   9.287
   12    HG   SER   2           HG       SER   2  47.536  10.277   8.735
   13    H    MET   3           HN       MET   3  46.958  12.873   5.830
   14    HA   MET   3           HA       MET   3  45.169  10.599   5.146
   15    HB2  MET   3           HB2      MET   3  44.967  13.449   4.060
   16    HB3  MET   3           HB1      MET   3  44.113  12.049   3.396
   17    HG2  MET   3           HG2      MET   3  42.918  11.730   5.523
   18    HG3  MET   3           HG1      MET   3  43.752  13.129   6.217
   19    HE1  MET   3           HE1      MET   3  40.559  12.679   6.139
   20    HE2  MET   3           HE2      MET   3  40.005  14.315   5.736
   21    HE3  MET   3           HE3      MET   3  41.323  14.088   6.914
   22    H    VAL   4          HG21      VAL   4  45.337  10.187   2.672
   23    HA   VAL   4          HG22      VAL   4  48.119   9.846   1.977
   24    HB   VAL   4          HG23      VAL   4  45.662   9.354   0.243
   25   HG11  VAL   4           HA       VAL   4  48.535   8.298   0.142
   26   HG12  VAL   4           HB       VAL   4  47.651   9.193  -1.115
   27   HG13  VAL   4           HN       VAL   4  47.174   7.552  -0.723
   28   HG21  VAL   4          HG11      VAL   4  47.097   7.500   2.187
   29   HG22  VAL   4          HG12      VAL   4  45.825   7.017   1.043
   30   HG23  VAL   4          HG13      VAL   4  45.442   8.109   2.365
   31    H    LEU   5          HD12      LEU   5  45.990  12.483   1.404
   32    HA   LEU   5          HD13      LEU   5  47.530  13.681  -0.769
   33    HB2  LEU   5          HD22      LEU   5  45.126  14.061  -0.247
   34    HB3  LEU   5          HD21      LEU   5  45.573  14.907   1.226
   35    HG   LEU   5          HD23      LEU   5  46.738  15.880  -1.395
   36   HD11  LEU   5           HA       LEU   5  43.878  16.430  -0.468
   37   HD12  LEU   5           HB1      LEU   5  44.361  15.509  -1.920
   38   HD13  LEU   5           HN       LEU   5  44.712  17.226  -1.819
   39   HD21  LEU   5           HB2      LEU   5  45.606  17.358   1.035
   40   HD22  LEU   5          HD11      LEU   5  47.331  17.071   0.729
   41   HD23  LEU   5           HG       LEU   5  46.409  18.095  -0.366
   42    H    SER   6           HN       SER   6  48.055  13.321   2.645
   43    HA   SER   6           HA       SER   6  49.751  15.709   2.970
   44    HB2  SER   6           HB2      SER   6  49.562  13.276   4.792
   45    HB3  SER   6           HB1      SER   6  50.144  14.889   5.200
   46    HG   SER   6           HG       SER   6  47.781  15.369   4.423
   47    HA   PRO   7           HA       PRO   7  53.591  13.313   2.131
   48    HB2  PRO   7           HB2      PRO   7  55.450  14.731   3.517
   49    HB3  PRO   7           HB1      PRO   7  54.692  15.347   2.028
   50    HG2  PRO   7           HG2      PRO   7  53.878  15.960   4.889
   51    HG3  PRO   7           HG1      PRO   7  54.195  17.118   3.555
   52    HD2  PRO   7           HD2      PRO   7  51.675  16.288   4.189
   53    HD3  PRO   7           HD1      PRO   7  52.153  16.588   2.497
   54    H    ARG   8           HN       ARG   8  51.945  11.984   3.519
   55    HA   ARG   8           HA       ARG   8  53.545  10.353   5.355
   56    HB2  ARG   8           HB2      ARG   8  50.777  11.553   6.072
   57    HB3  ARG   8           HB1      ARG   8  51.434  10.146   6.883
   58    HG2  ARG   8           HG2      ARG   8  53.430  11.567   7.678
   59    HG3  ARG   8           HG1      ARG   8  52.750  12.960   6.830
   60    HD2  ARG   8           HD2      ARG   8  50.634  12.739   8.278
   61    HD3  ARG   8           HD1      ARG   8  51.412  11.395   9.149
   62    HE   ARG   8           HE       ARG   8  52.125  14.317   9.421
   63   HH11  ARG   8          HH11      ARG   8  53.245  11.086   9.989
   64   HH12  ARG   8          HH12      ARG   8  54.431  11.641  11.265
   65   HH21  ARG   8          HH21      ARG   8  53.470  14.914  10.861
   66   HH22  ARG   8          HH22      ARG   8  54.534  13.712  11.719
   67    H    ASP   9           HN       ASP   9  52.547  10.315   2.576
   68    HA   ASP   9           HA       ASP   9  50.363   8.521   2.169
   69    HB2  ASP   9           HB2      ASP   9  51.294   8.393  -0.090
   70    HB3  ASP   9           HB1      ASP   9  51.239  10.069   0.464
   71    H    GLU  10           HN       GLU  10  53.949   7.980   2.096
   72    HA   GLU  10           HA       GLU  10  54.203   5.269   2.053
   73    HB2  GLU  10           HB2      GLU  10  56.073   6.787   2.210
   74    HB3  GLU  10           HB1      GLU  10  55.679   7.237   3.857
   75    HG2  GLU  10           HG2      GLU  10  56.346   4.358   3.099
   76    HG3  GLU  10           HG1      GLU  10  57.615   5.549   3.339
   77    H    ARG  11           HN       ARG  11  53.427   7.132   4.954
   78    HA   ARG  11           HA       ARG  11  53.498   4.917   6.716
   79    HB2  ARG  11           HB2      ARG  11  53.657   7.534   7.116
   80    HB3  ARG  11           HB1      ARG  11  51.897   7.463   7.249
   81    HG2  ARG  11           HG2      ARG  11  52.834   7.330   9.461
   82    HG3  ARG  11           HG1      ARG  11  52.192   5.727   9.083
   83    HD2  ARG  11           HD2      ARG  11  54.483   4.948   8.489
   84    HD3  ARG  11           HD1      ARG  11  55.104   6.582   8.767
   85    HE   ARG  11           HE       ARG  11  53.706   5.473  11.069
   86   HH11  ARG  11          HH11      ARG  11  54.888   4.992  12.896
   87   HH12  ARG  11          HH12      ARG  11  56.606   4.782  12.801
   88   HH21  ARG  11          HH21      ARG  11  56.762   5.327   9.404
   89   HH22  ARG  11          HH22      ARG  11  57.671   4.941  10.834
   90    H    THR  12           HG1      THR  12  50.959   6.118   4.726
   91    HA   THR  12          HG21      THR  12  48.859   4.431   5.969
   92    HB   THR  12          HG22      THR  12  48.689   6.071   3.423
   93    HG1  THR  12          HG23      THR  12  49.140   7.476   5.051
   94   HG21  THR  12           HA       THR  12  46.597   4.929   5.331
   95   HG22  THR  12           HB       THR  12  46.881   4.440   3.635
   96   HG23  THR  12           HN       THR  12  46.243   6.051   4.003
   97    H    LEU  13          HD12      LEU  13  50.767   4.682   2.986
   98    HA   LEU  13          HD13      LEU  13  49.763   2.580   1.458
   99    HB2  LEU  13          HD22      LEU  13  51.370   4.525   0.940
  100    HB3  LEU  13          HD21      LEU  13  52.650   3.581   1.653
  101    HG   LEU  13          HD23      LEU  13  52.791   3.539  -0.709
  102   HD11  LEU  13           HA       LEU  13  51.711   0.799   0.028
  103   HD12  LEU  13           HB1      LEU  13  53.347   1.387   0.410
  104   HD13  LEU  13           HN       LEU  13  52.833   1.213  -1.277
  105   HD21  LEU  13           HB2      LEU  13  50.022   2.317  -0.897
  106   HD22  LEU  13          HD11      LEU  13  50.361   4.046  -1.106
  107   HD23  LEU  13           HG       LEU  13  51.095   2.890  -2.201
  108    H    VAL  14          HG21      VAL  14  52.689   2.507   3.544
  109    HA   VAL  14          HG22      VAL  14  53.210  -0.274   3.228
  110    HB   VAL  14          HG23      VAL  14  54.059   1.714   5.377
  111   HG11  VAL  14           HA       VAL  14  54.333  -0.555   6.307
  112   HG12  VAL  14           HB       VAL  14  55.894   0.159   5.911
  113   HG13  VAL  14           HN       VAL  14  55.188  -1.058   4.827
  114   HG21  VAL  14          HG11      VAL  14  54.863   2.197   3.054
  115   HG22  VAL  14          HG12      VAL  14  55.543   0.564   2.956
  116   HG23  VAL  14          HG13      VAL  14  56.179   1.741   4.130
  117    H    ARG  15           HN       ARG  15  51.401   1.446   5.836
  118    HA   ARG  15           HA       ARG  15  50.967  -1.052   7.240
  119    HB2  ARG  15           HB2      ARG  15  51.089   1.118   8.406
  120    HB3  ARG  15           HB1      ARG  15  49.586   1.623   7.642
  121    HG2  ARG  15           HG2      ARG  15  49.230   0.878   9.949
  122    HG3  ARG  15           HG1      ARG  15  48.335  -0.118   8.808
  123    HD2  ARG  15           HD2      ARG  15  50.036  -1.920   9.011
  124    HD3  ARG  15           HD1      ARG  15  50.981  -0.904  10.122
  125    HE   ARG  15           HE       ARG  15  48.256  -1.255  11.020
  126   HH11  ARG  15          HH11      ARG  15  47.793  -2.496  12.805
  127   HH12  ARG  15          HH12      ARG  15  48.931  -3.677  13.346
  128   HH21  ARG  15          HH21      ARG  15  51.285  -3.072  10.932
  129   HH22  ARG  15          HH22      ARG  15  50.841  -3.991  12.339
  130    H    LYS  16           HN       LYS  16  48.969   0.698   4.850
  131    HA   LYS  16           HA       LYS  16  46.641  -0.980   5.095
  132    HB2  LYS  16           HB2      LYS  16  46.613   1.160   3.892
  133    HB3  LYS  16           HB1      LYS  16  47.740   0.532   2.688
  134    HG2  LYS  16           HG2      LYS  16  46.055  -1.162   1.988
  135    HG3  LYS  16           HG1      LYS  16  44.928  -0.545   3.222
  136    HD2  LYS  16           HD2      LYS  16  44.872   1.644   2.079
  137    HD3  LYS  16           HD1      LYS  16  46.069   1.066   0.895
  138    HE2  LYS  16           HE2      LYS  16  44.493  -0.689   0.134
  139    HE3  LYS  16           HE1      LYS  16  43.295  -0.151   1.318
  140    HZ1  LYS  16           HZ1      LYS  16  42.873   0.779  -0.912
  141    HZ2  LYS  16           HZ2      LYS  16  44.337   1.540  -0.908
  142    HZ3  LYS  16           HZ3      LYS  16  43.188   1.989   0.165
  143    H    VAL  17          HG21      VAL  17  49.522  -1.271   2.980
  144    HA   VAL  17          HG22      VAL  17  48.798  -3.787   1.796
  145    HB   VAL  17          HG23      VAL  17  51.480  -2.467   2.315
  146   HG11  VAL  17           HA       VAL  17  52.438  -3.980   0.636
  147   HG12  VAL  17           HB       VAL  17  50.901  -4.880   0.531
  148   HG13  VAL  17           HN       VAL  17  51.873  -4.897   2.023
  149   HG21  VAL  17          HG11      VAL  17  49.814  -1.335   0.727
  150   HG22  VAL  17          HG12      VAL  17  49.947  -2.778  -0.305
  151   HG23  VAL  17          HG13      VAL  17  51.366  -1.759   0.031
  152    H    GLN  18           HB1      GLN  18  50.596  -3.041   4.788
  153    HA   GLN  18           HB2      GLN  18  51.306  -5.700   5.421
  154    HB2  GLN  18           HG2      GLN  18  52.324  -3.612   6.240
  155    HB3  GLN  18           HG1      GLN  18  50.884  -3.281   7.214
  156    HG2  GLN  18          HE22      GLN  18  51.364  -5.245   8.615
  157    HG3  GLN  18          HE21      GLN  18  52.743  -5.675   7.570
  158   HE21  GLN  18           HA       GLN  18  54.819  -3.057   8.884
  159   HE22  GLN  18           HN       GLN  18  54.572  -4.095   7.478
  160    H    ILE  19          HD11      ILE  19  48.168  -4.185   5.828
  161    HA   ILE  19          HD12      ILE  19  47.266  -6.591   7.377
  162    HB   ILE  19          HD13      ILE  19  45.196  -5.423   7.832
  163   HG12  ILE  19          HG12      ILE  19  46.461  -2.931   6.641
  164   HG13  ILE  19          HG11      ILE  19  45.190  -3.857   5.864
  165   HG21  ILE  19          HG21      ILE  19  46.088  -4.021   9.586
  166   HG22  ILE  19          HG22      ILE  19  47.623  -3.804   8.706
  167   HG23  ILE  19          HG23      ILE  19  47.169  -5.396   9.367
  168   HD11  ILE  19           HA       ILE  19  44.950  -2.346   8.498
  169   HD12  ILE  19           HB       ILE  19  43.688  -3.403   7.800
  170   HD13  ILE  19           HN       ILE  19  44.209  -1.940   6.937
  171    H    ASN  20           HB1      ASN  20  46.801  -4.885   4.323
  172    HA   ASN  20           HB2      ASN  20  45.200  -7.208   3.328
  173    HB2  ASN  20          HD22      ASN  20  45.171  -4.272   2.541
  174    HB3  ASN  20          HD21      ASN  20  44.465  -5.550   1.557
  175   HD21  ASN  20           HA       ASN  20  42.300  -4.988   1.688
  176   HD22  ASN  20           HN       ASN  20  41.472  -4.995   3.245
  177    HA   PRO  21           HA       PRO  21  49.403  -7.267   1.284
  178    HB2  PRO  21           HB2      PRO  21  49.838  -9.980   1.320
  179    HB3  PRO  21           HB1      PRO  21  50.195  -8.893   2.695
  180    HG2  PRO  21           HG2      PRO  21  47.682 -10.554   2.232
  181    HG3  PRO  21           HG1      PRO  21  48.704 -10.482   3.705
  182    HD2  PRO  21           HD2      PRO  21  46.471  -8.997   3.524
  183    HD3  PRO  21           HD1      PRO  21  47.951  -8.291   4.238
  184    H    ARG  22           HN       ARG  22  46.331  -8.313   0.450
  185    HA   ARG  22           HA       ARG  22  46.953  -9.245  -2.292
  186    HB2  ARG  22           HB2      ARG  22  44.298  -8.630  -0.916
  187    HB3  ARG  22           HB1      ARG  22  44.481  -9.319  -2.533
  188    HG2  ARG  22           HG2      ARG  22  45.637 -11.293  -1.587
  189    HG3  ARG  22           HG1      ARG  22  45.434 -10.634   0.049
  190    HD2  ARG  22           HD2      ARG  22  42.951 -10.667  -0.271
  191    HD3  ARG  22           HD1      ARG  22  43.184 -11.396  -1.859
  192    HE   ARG  22           HE       ARG  22  44.050 -13.389  -0.851
  193   HH11  ARG  22          HH11      ARG  22  43.934 -14.951   0.728
  194   HH12  ARG  22          HH12      ARG  22  43.268 -14.559   2.276
  195   HH21  ARG  22          HH21      ARG  22  42.602 -11.289   1.557
  196   HH22  ARG  22          HH22      ARG  22  42.554 -12.548   2.748
  197    H    THR  23           HG1      THR  23  46.853  -6.216  -0.798
  198    HA   THR  23          HG21      THR  23  45.486  -4.642  -2.785
  199    HB   THR  23          HG22      THR  23  47.736  -3.700  -0.965
  200    HG1  THR  23          HG23      THR  23  46.302  -4.562   0.380
  201   HG21  THR  23           HA       THR  23  46.942  -2.092  -2.686
  202   HG22  THR  23           HB       THR  23  46.598  -1.552  -1.039
  203   HG23  THR  23           HN       THR  23  45.296  -2.247  -2.045
  204    H    THR  24           HG1      THR  24  46.091  -4.360  -4.877
  205    HA   THR  24          HG21      THR  24  48.902  -4.921  -5.624
  206    HB   THR  24          HG22      THR  24  48.213  -5.310  -7.782
  207    HG1  THR  24          HG23      THR  24  45.785  -4.000  -7.192
  208   HG21  THR  24           HA       THR  24  46.394  -6.860  -7.759
  209   HG22  THR  24           HB       THR  24  45.739  -6.177  -6.259
  210   HG23  THR  24           HN       THR  24  47.295  -7.037  -6.238
  211    H    ALA  25           HN       ALA  25  49.633  -3.649  -7.690
  212    HA   ALA  25           HA       ALA  25  50.005  -0.887  -6.992
  213    HB1  ALA  25           HB1      ALA  25  50.545  -2.350  -9.607
  214    HB2  ALA  25           HB2      ALA  25  51.667  -2.187  -8.235
  215    HB3  ALA  25           HB3      ALA  25  51.169  -0.747  -9.140
  216    H    LYS  26           HN       LYS  26  47.264  -2.399  -8.522
  217    HA   LYS  26           HA       LYS  26  46.477   0.117  -9.926
  218    HB2  LYS  26           HB2      LYS  26  45.401  -2.717  -9.880
  219    HB3  LYS  26           HB1      LYS  26  44.404  -1.397 -10.471
  220    HG2  LYS  26           HG2      LYS  26  47.202  -1.895 -11.558
  221    HG3  LYS  26           HG1      LYS  26  45.772  -2.691 -12.222
  222    HD2  LYS  26           HD2      LYS  26  44.750  -0.610 -12.848
  223    HD3  LYS  26           HD1      LYS  26  45.982   0.346 -12.001
  224    HE2  LYS  26           HE2      LYS  26  47.725  -0.523 -13.531
  225    HE3  LYS  26           HE1      LYS  26  46.502  -1.449 -14.409
  226    HZ1  LYS  26           HZ1      LYS  26  45.410   0.642 -14.984
  227    HZ2  LYS  26           HZ2      LYS  26  46.966   0.707 -15.476
  228    HZ3  LYS  26           HZ3      LYS  26  46.492   1.519 -14.126
  229    H    ASP  27           HN       ASP  27  45.408  -1.818  -7.112
  230    HA   ASP  27           HA       ASP  27  43.456  -0.085  -6.083
  231    HB2  ASP  27           HB2      ASP  27  45.709  -1.625  -4.720
  232    HB3  ASP  27           HB1      ASP  27  44.443  -0.797  -3.836
  233    H    LEU  28          HD12      LEU  28  46.968   0.155  -6.129
  234    HA   LEU  28          HD13      LEU  28  47.125   2.602  -4.532
  235    HB2  LEU  28          HD22      LEU  28  49.023   0.711  -5.891
  236    HB3  LEU  28          HD21      LEU  28  49.575   2.356  -5.633
  237    HG   LEU  28          HD23      LEU  28  49.223   2.230  -3.271
  238   HD11  LEU  28           HA       LEU  28  48.323  -0.642  -3.636
  239   HD12  LEU  28           HB1      LEU  28  47.295   0.699  -3.078
  240   HD13  LEU  28           HN       LEU  28  48.650   0.154  -2.083
  241   HD21  LEU  28           HB2      LEU  28  50.927   0.465  -2.758
  242   HD22  LEU  28          HD11      LEU  28  50.670  -0.231  -4.372
  243   HD23  LEU  28           HG       LEU  28  51.341   1.404  -4.204
  244    H    VAL  29          HG21      VAL  29  46.983   1.990  -8.055
  245    HA   VAL  29          HG22      VAL  29  47.563   4.722  -8.839
  246    HB   VAL  29          HG23      VAL  29  45.750   2.613 -10.081
  247   HG11  VAL  29           HA       VAL  29  44.758   4.744 -10.727
  248   HG12  VAL  29           HB       VAL  29  45.643   4.109 -12.099
  249   HG13  VAL  29           HN       VAL  29  46.349   5.417 -11.124
  250   HG21  VAL  29          HG11      VAL  29  48.300   3.876 -11.131
  251   HG22  VAL  29          HG12      VAL  29  47.426   2.486 -11.815
  252   HG23  VAL  29          HG13      VAL  29  48.268   2.329 -10.253
  253    H    LYS  30           HN       LYS  30  44.469   3.075  -8.137
  254    HA   LYS  30           HA       LYS  30  42.772   5.295  -8.056
  255    HB2  LYS  30           HB2      LYS  30  42.798   2.633  -6.567
  256    HB3  LYS  30           HB1      LYS  30  41.527   3.819  -6.318
  257    HG2  LYS  30           HG2      LYS  30  41.238   3.910  -8.825
  258    HG3  LYS  30           HG1      LYS  30  42.299   2.504  -8.954
  259    HD2  LYS  30           HD2      LYS  30  40.758   1.056  -7.993
  260    HD3  LYS  30           HD1      LYS  30  40.003   2.303  -6.998
  261    HE2  LYS  30           HE2      LYS  30  39.698   2.098 -10.017
  262    HE3  LYS  30           HE1      LYS  30  38.514   1.526  -8.832
  263    HZ1  LYS  30           HZ1      LYS  30  38.525   3.919  -7.953
  264    HZ2  LYS  30           HZ2      LYS  30  37.902   3.785  -9.490
  265    HZ3  LYS  30           HZ3      LYS  30  39.418   4.353  -9.147
  266    H    MET  31           HN       MET  31  44.327   3.913  -5.139
  267    HA   MET  31           HA       MET  31  43.463   6.035  -3.466
  268    HB2  MET  31           HB2      MET  31  44.203   3.617  -2.941
  269    HB3  MET  31           HB1      MET  31  45.847   4.237  -2.969
  270    HG2  MET  31           HG2      MET  31  45.021   5.898  -1.129
  271    HG3  MET  31           HG1      MET  31  43.566   4.926  -1.085
  272    HE1  MET  31           HE1      MET  31  47.829   3.661   0.231
  273    HE2  MET  31           HE2      MET  31  47.343   5.249  -0.393
  274    HE3  MET  31           HE3      MET  31  47.446   3.866  -1.494
  275    H    LEU  32          HD12      LEU  32  45.458   6.712  -5.877
  276    HA   LEU  32          HD13      LEU  32  46.843   8.903  -4.391
  277    HB2  LEU  32          HD22      LEU  32  47.884   7.254  -6.732
  278    HB3  LEU  32          HD21      LEU  32  48.648   8.735  -6.146
  279    HG   LEU  32          HD23      LEU  32  48.297   6.234  -4.413
  280   HD11  LEU  32           HA       LEU  32  50.742   5.913  -4.865
  281   HD12  LEU  32           HB1      LEU  32  50.619   7.154  -6.144
  282   HD13  LEU  32           HN       LEU  32  49.719   5.660  -6.279
  283   HD21  LEU  32           HB2      LEU  32  48.579   8.272  -3.119
  284   HD22  LEU  32          HD11      LEU  32  50.054   7.293  -3.038
  285   HD23  LEU  32           HG       LEU  32  49.994   8.732  -4.087
  286    H    GLU  33           HN       GLU  33  45.501   7.734  -7.449
  287    HA   GLU  33           HA       GLU  33  45.164  10.157  -8.888
  288    HB2  GLU  33           HB2      GLU  33  45.184   7.793  -9.646
  289    HB3  GLU  33           HB1      GLU  33  43.639   7.516  -8.856
  290    HG2  GLU  33           HG2      GLU  33  42.524   8.935 -10.496
  291    HG3  GLU  33           HG1      GLU  33  44.091   9.411 -11.185
  292    H    GLU  34           HN       GLU  34  42.961   8.373  -6.704
  293    HA   GLU  34           HA       GLU  34  40.802  10.256  -6.732
  294    HB2  GLU  34           HB2      GLU  34  41.544   7.987  -4.846
  295    HB3  GLU  34           HB1      GLU  34  40.019   8.846  -4.777
  296    HG2  GLU  34           HG2      GLU  34  39.228   8.036  -6.817
  297    HG3  GLU  34           HG1      GLU  34  40.821   7.601  -7.413
  298    H    THR  35           HG1      THR  35  43.845  10.728  -5.383
  299    HA   THR  35          HG21      THR  35  42.741  13.033  -3.866
  300    HB   THR  35          HG22      THR  35  44.454  12.879  -2.121
  301    HG1  THR  35          HG23      THR  35  46.020  11.597  -2.963
  302   HG21  THR  35           HA       THR  35  42.192  11.950  -1.710
  303   HG22  THR  35           HB       THR  35  43.464  11.125  -0.786
  304   HG23  THR  35           HN       THR  35  42.778  10.360  -2.237
  305    H    GLY  36           HN       GLY  36  44.366  12.414  -6.544
  306    HA2  GLY  36           HA2      GLY  36  45.803  13.616  -7.856
  307    HA3  GLY  36           HA1      GLY  36  45.569  14.979  -6.763
  308    H    THR  37           HG1      THR  37  46.984  12.099  -5.357
  309    HA   THR  37          HG21      THR  37  49.220  13.699  -4.482
  310    HB   THR  37          HG22      THR  37  48.826  10.718  -4.062
  311    HG1  THR  37          HG23      THR  37  48.139  11.696  -1.949
  312   HG21  THR  37           HA       THR  37  51.097  11.720  -3.442
  313   HG22  THR  37           HB       THR  37  50.204  11.035  -2.091
  314   HG23  THR  37           HN       THR  37  50.242  12.797  -2.327
  315    H    LYS  38           HN       LYS  38  51.124  13.986  -5.455
  316    HA   LYS  38           HA       LYS  38  51.847  12.590  -7.892
  317    HB2  LYS  38           HB2      LYS  38  53.222  14.760  -6.266
  318    HB3  LYS  38           HB1      LYS  38  53.917  14.067  -7.737
  319    HG2  LYS  38           HG2      LYS  38  51.900  14.709  -9.026
  320    HG3  LYS  38           HG1      LYS  38  51.236  15.501  -7.574
  321    HD2  LYS  38           HD2      LYS  38  53.116  17.080  -7.537
  322    HD3  LYS  38           HD1      LYS  38  53.941  16.195  -8.821
  323    HE2  LYS  38           HE2      LYS  38  52.944  18.168  -9.777
  324    HE3  LYS  38           HE1      LYS  38  52.151  16.728 -10.412
  325    HZ1  LYS  38           HZ1      LYS  38  50.535  18.423  -9.816
  326    HZ2  LYS  38           HZ2      LYS  38  51.068  18.478  -8.270
  327    HZ3  LYS  38           HZ3      LYS  38  50.336  17.126  -8.825
  328    H    VAL  39          HG21      VAL  39  51.842  10.442  -6.848
  329    HA   VAL  39          HG22      VAL  39  54.625   9.679  -5.986
  330    HB   VAL  39          HG23      VAL  39  51.934   8.569  -5.224
  331   HG11  VAL  39           HA       VAL  39  53.114   6.812  -3.936
  332   HG12  VAL  39           HB       VAL  39  54.641   7.269  -4.715
  333   HG13  VAL  39           HN       VAL  39  53.289   6.584  -5.680
  334   HG21  VAL  39          HG11      VAL  39  52.675   8.977  -2.946
  335   HG22  VAL  39          HG12      VAL  39  52.876  10.463  -3.886
  336   HG23  VAL  39          HG13      VAL  39  54.283   9.452  -3.505
  337    H    SER  40           HN       SER  40  55.717   8.242  -7.216
  338    HA   SER  40           HA       SER  40  54.542   7.529  -9.793
  339    HB2  SER  40           HB2      SER  40  56.938   8.193  -9.576
  340    HB3  SER  40           HB1      SER  40  57.236   6.684  -8.690
  341    HG   SER  40           HG       SER  40  56.667   7.118 -11.383
  342    H    ILE  41          HD11      ILE  41  53.329   5.809 -10.176
  343    HA   ILE  41          HD12      ILE  41  52.958   3.509  -8.651
  344    HB   ILE  41          HD13      ILE  41  52.924   3.583 -11.680
  345   HG12  ILE  41          HG12      ILE  41  51.640   5.505 -11.035
  346   HG13  ILE  41          HG11      ILE  41  50.539   4.235 -11.516
  347   HG21  ILE  41          HG21      ILE  41  51.360   1.906  -9.661
  348   HG22  ILE  41          HG22      ILE  41  52.608   1.327 -10.775
  349   HG23  ILE  41          HG23      ILE  41  51.066   1.931 -11.409
  350   HD11  ILE  41           HA       ILE  41  51.157   5.080  -8.635
  351   HD12  ILE  41           HB       ILE  41  50.055   3.760  -9.096
  352   HD13  ILE  41           HN       ILE  41  49.691   5.435  -9.560
  353    H    SER  42           HN       SER  42  55.645   4.270 -10.797
  354    HA   SER  42           HA       SER  42  56.769   1.593 -10.866
  355    HB2  SER  42           HB2      SER  42  58.504   2.473 -12.113
  356    HB3  SER  42           HB1      SER  42  57.126   3.475 -12.585
  357    HG   SER  42           HG       SER  42  57.907   5.109 -11.198
  358    H    THR  43           HG1      THR  43  56.863   4.034  -8.378
  359    HA   THR  43          HG21      THR  43  59.335   2.820  -7.237
  360    HB   THR  43          HG22      THR  43  59.099   5.353  -7.395
  361    HG1  THR  43          HG23      THR  43  60.185   5.411  -5.343
  362   HG21  THR  43           HA       THR  43  57.597   4.972  -4.756
  363   HG22  THR  43           HB       THR  43  56.910   5.697  -6.225
  364   HG23  THR  43           HN       THR  43  58.251   6.483  -5.410
  365    H    VAL  44          HG21      VAL  44  55.875   3.364  -6.385
  366    HA   VAL  44          HG22      VAL  44  56.007   2.004  -3.907
  367    HB   VAL  44          HG23      VAL  44  53.603   1.600  -4.091
  368   HG11  VAL  44           HA       VAL  44  52.916   3.945  -4.177
  369   HG12  VAL  44           HB       VAL  44  54.412   4.392  -5.006
  370   HG13  VAL  44           HN       VAL  44  54.462   3.799  -3.340
  371   HG21  VAL  44          HG11      VAL  44  52.342   2.523  -6.054
  372   HG22  VAL  44          HG12      VAL  44  53.321   1.110  -6.482
  373   HG23  VAL  44          HG13      VAL  44  53.877   2.750  -6.894
  374    H    LYS  45           HN       LYS  45  55.632   0.582  -7.175
  375    HA   LYS  45           HA       LYS  45  55.283  -2.103  -6.333
  376    HB2  LYS  45           HB2      LYS  45  55.622  -0.746  -8.785
  377    HB3  LYS  45           HB1      LYS  45  56.955  -1.884  -8.745
  378    HG2  LYS  45           HG2      LYS  45  54.014  -2.580  -8.357
  379    HG3  LYS  45           HG1      LYS  45  54.911  -2.744  -9.865
  380    HD2  LYS  45           HD2      LYS  45  56.420  -4.411  -8.770
  381    HD3  LYS  45           HD1      LYS  45  55.433  -4.307  -7.291
  382    HE2  LYS  45           HE2      LYS  45  53.428  -5.025  -8.551
  383    HE3  LYS  45           HE1      LYS  45  54.376  -5.099 -10.039
  384    HZ1  LYS  45           HZ1      LYS  45  55.714  -6.855  -9.043
  385    HZ2  LYS  45           HZ2      LYS  45  54.131  -7.286  -9.024
  386    HZ3  LYS  45           HZ3      LYS  45  54.855  -6.791  -7.646
  387    H    ARG  46           HN       ARG  46  58.156  -0.182  -6.111
  388    HA   ARG  46           HA       ARG  46  59.947  -2.516  -5.633
  389    HB2  ARG  46           HB2      ARG  46  60.626   0.438  -5.406
  390    HB3  ARG  46           HB1      ARG  46  61.737  -0.927  -5.505
  391    HG2  ARG  46           HG2      ARG  46  60.966  -1.375  -7.852
  392    HG3  ARG  46           HG1      ARG  46  59.855   0.001  -7.713
  393    HD2  ARG  46           HD2      ARG  46  62.058   1.353  -7.100
  394    HD3  ARG  46           HD1      ARG  46  62.863   0.015  -7.937
  395    HE   ARG  46           HE       ARG  46  60.571   1.448  -9.217
  396   HH11  ARG  46          HH11      ARG  46  60.833   2.521 -11.081
  397   HH12  ARG  46          HH12      ARG  46  62.356   2.479 -11.924
  398   HH21  ARG  46          HH21      ARG  46  64.005   0.710  -9.480
  399   HH22  ARG  46          HH22      ARG  46  64.117   1.491 -11.025
  400    H    VAL  47          HG21      VAL  47  58.397   0.149  -3.830
  401    HA   VAL  47          HG22      VAL  47  59.464  -0.467  -1.243
  402    HB   VAL  47          HG23      VAL  47  56.754   0.705  -1.983
  403   HG11  VAL  47           HA       VAL  47  56.668  -0.092   0.342
  404   HG12  VAL  47           HB       VAL  47  56.778   1.667   0.315
  405   HG13  VAL  47           HN       VAL  47  58.216   0.706   0.686
  406   HG21  VAL  47          HG11      VAL  47  59.359   2.053  -1.163
  407   HG22  VAL  47          HG12      VAL  47  57.821   2.875  -1.464
  408   HG23  VAL  47          HG13      VAL  47  58.666   2.070  -2.787
  409    H    LEU  48          HD12      LEU  48  56.474  -1.677  -2.839
  410    HA   LEU  48          HD13      LEU  48  55.588  -3.536  -0.926
  411    HB2  LEU  48          HD22      LEU  48  55.663  -3.733  -3.968
  412    HB3  LEU  48          HD21      LEU  48  54.764  -4.836  -2.940
  413    HG   LEU  48          HD23      LEU  48  54.220  -1.851  -3.122
  414   HD11  LEU  48           HA       LEU  48  52.236  -2.470  -4.391
  415   HD12  LEU  48           HB1      LEU  48  52.657  -4.193  -4.288
  416   HD13  LEU  48           HN       LEU  48  53.676  -3.072  -5.228
  417   HD21  LEU  48           HB2      LEU  48  52.085  -2.437  -2.030
  418   HD22  LEU  48          HD11      LEU  48  52.688  -4.083  -1.767
  419   HD23  LEU  48           HG       LEU  48  53.492  -2.704  -0.983
  420    H    TYR  49           HN       TYR  49  58.044  -4.091  -3.480
  421    HA   TYR  49           HA       TYR  49  58.595  -6.791  -2.725
  422    HB2  TYR  49           HB2      TYR  49  58.993  -5.756  -4.961
  423    HB3  TYR  49           HB1      TYR  49  60.314  -4.819  -4.284
  424    HD1  TYR  49           HD1      TYR  49  59.099  -8.327  -4.841
  425    HD2  TYR  49           HD2      TYR  49  62.509  -5.772  -4.179
  426    HE1  TYR  49           HE1      TYR  49  60.624 -10.212  -5.388
  427    HE2  TYR  49           HE2      TYR  49  64.034  -7.667  -4.725
  428    HH   TYR  49           HH       TYR  49  64.166  -9.883  -5.384
  429    H    ARG  50           HN       ARG  50  60.270  -3.717  -1.795
  430    HA   ARG  50           HA       ARG  50  62.315  -5.092  -0.251
  431    HB2  ARG  50           HB2      ARG  50  61.324  -2.228   0.059
  432    HB3  ARG  50           HB1      ARG  50  62.736  -2.932   0.852
  433    HG2  ARG  50           HG2      ARG  50  63.352  -3.526  -1.738
  434    HG3  ARG  50           HG1      ARG  50  62.408  -2.059  -1.989
  435    HD2  ARG  50           HD2      ARG  50  64.920  -2.396  -0.311
  436    HD3  ARG  50           HD1      ARG  50  64.763  -1.534  -1.843
  437    HE   ARG  50           HE       ARG  50  63.278  -0.594   0.596
  438   HH11  ARG  50          HH11      ARG  50  63.887   1.366   1.546
  439   HH12  ARG  50          HH12      ARG  50  65.107   2.304   0.834
  440   HH21  ARG  50          HH21      ARG  50  65.763   0.160  -1.768
  441   HH22  ARG  50          HH22      ARG  50  66.078   1.713  -1.039
  442    H    HIS  51           HN       HIS  51  59.048  -3.979   0.683
  443    HA   HIS  51           HA       HIS  51  59.386  -4.753   3.445
  444    HB2  HIS  51           HB2      HIS  51  57.548  -3.286   2.638
  445    HB3  HIS  51           HB1      HIS  51  56.812  -4.677   1.827
  446    HD1  HIS  51           HD1      HIS  51  55.714  -6.579   3.545
  447    HD2  HIS  51           HD2      HIS  51  57.114  -3.001   5.234
  448    HE1  HIS  51           HE1      HIS  51  54.788  -6.491   5.925
  449    H    ASN  52           HB1      ASN  52  58.063  -6.523   0.591
  450    HA   ASN  52           HB2      ASN  52  57.390  -8.900   1.958
  451    HB2  ASN  52          HD22      ASN  52  56.617  -8.205  -0.297
  452    HB3  ASN  52          HD21      ASN  52  58.245  -8.452  -0.946
  453   HD21  ASN  52           HA       ASN  52  55.673 -10.423   0.862
  454   HD22  ASN  52           HN       ASN  52  55.999 -11.795  -0.186
  455    H    LEU  53          HD12      LEU  53  60.491  -8.135   0.269
  456    HA   LEU  53          HD13      LEU  53  61.541 -10.777   1.001
  457    HB2  LEU  53          HD22      LEU  53  61.809  -9.821  -1.254
  458    HB3  LEU  53          HD21      LEU  53  62.702  -8.461  -0.591
  459    HG   LEU  53          HD23      LEU  53  64.539  -9.968   0.103
  460   HD11  LEU  53           HA       LEU  53  64.589 -12.312  -0.725
  461   HD12  LEU  53           HB1      LEU  53  62.895 -12.158  -1.241
  462   HD13  LEU  53           HN       LEU  53  63.330 -12.084   0.486
  463   HD21  LEU  53           HB2      LEU  53  64.537  -8.920  -2.139
  464   HD22  LEU  53          HD11      LEU  53  65.368 -10.496  -2.118
  465   HD23  LEU  53           HG       LEU  53  63.724 -10.371  -2.784
  466    H    LYS  54           HN       LYS  54  62.000  -7.479   2.223
  467    HA   LYS  54           HA       LYS  54  64.109  -8.525   4.038
  468    HB2  LYS  54           HB2      LYS  54  65.037  -7.644   1.887
  469    HB3  LYS  54           HB1      LYS  54  64.419  -6.044   2.295
  470    HG2  LYS  54           HG2      LYS  54  66.880  -6.451   2.662
  471    HG3  LYS  54           HG1      LYS  54  66.025  -5.797   4.054
  472    HD2  LYS  54           HD2      LYS  54  66.031  -7.995   5.147
  473    HD3  LYS  54           HD1      LYS  54  66.645  -8.768   3.686
  474    HE2  LYS  54           HE2      LYS  54  68.400  -8.491   5.384
  475    HE3  LYS  54           HE1      LYS  54  68.773  -7.622   3.898
  476    HZ1  LYS  54           HZ1      LYS  54  67.620  -6.374   6.327
  477    HZ2  LYS  54           HZ2      LYS  54  68.063  -5.586   4.959
  478    HZ3  LYS  54           HZ3      LYS  54  69.207  -6.290   5.895
  479    H    GLY  55           HN       GLY  55  61.248  -7.120   4.242
  480    HA2  GLY  55           HA2      GLY  55  60.168  -6.188   6.057
  481    HA3  GLY  55           HA1      GLY  55  61.431  -7.042   6.951
  482    H    ARG  56           HN       ARG  56  61.642  -4.038   4.942
  483    HA   ARG  56           HA       ARG  56  62.101  -2.449   7.381
  484    HB2  ARG  56           HB2      ARG  56  64.268  -3.616   6.565
  485    HB3  ARG  56           HB1      ARG  56  64.223  -2.515   5.204
  486    HG2  ARG  56           HG2      ARG  56  65.742  -1.777   6.988
  487    HG3  ARG  56           HG1      ARG  56  64.476  -0.598   6.707
  488    HD2  ARG  56           HD2      ARG  56  65.014  -0.939   9.110
  489    HD3  ARG  56           HD1      ARG  56  63.329  -1.207   8.731
  490    HE   ARG  56           HE       ARG  56  63.686  -3.620   8.900
  491   HH11  ARG  56          HH11      ARG  56  66.338  -1.716  10.233
  492   HH12  ARG  56          HH12      ARG  56  66.770  -2.947  11.371
  493   HH21  ARG  56          HH21      ARG  56  64.279  -5.125  10.403
  494   HH22  ARG  56          HH22      ARG  56  65.640  -4.841  11.455
  495    H    SER  57           HN       SER  57  61.111  -0.652   7.293
  496    HA   SER  57           HA       SER  57  61.544   1.232   5.084
  497    HB2  SER  57           HB2      SER  57  59.127   0.358   4.856
  498    HB3  SER  57           HB1      SER  57  58.804   1.108   6.435
  499    HG   SER  57           HG       SER  57  58.484   2.860   5.191
  500    H    ALA  58           HN       ALA  58  63.240   1.931   6.536
  501    HA   ALA  58           HA       ALA  58  62.820   1.532   9.326
  502    HB1  ALA  58           HB1      ALA  58  64.950   1.067   8.376
  503    HB2  ALA  58           HB2      ALA  58  65.216   2.518   9.365
  504    HB3  ALA  58           HB3      ALA  58  64.983   2.622   7.608
  505    H    ARG  59           HN       ARG  59  63.826   4.658   7.813
  506    HA   ARG  59           HA       ARG  59  62.130   6.092   9.827
  507    HB2  ARG  59           HB2      ARG  59  65.080   6.699   9.339
  508    HB3  ARG  59           HB1      ARG  59  63.984   7.557  10.424
  509    HG2  ARG  59           HG2      ARG  59  63.640   5.260  11.599
  510    HG3  ARG  59           HG1      ARG  59  65.110   4.768  10.733
  511    HD2  ARG  59           HD2      ARG  59  66.250   6.813  11.740
  512    HD3  ARG  59           HD1      ARG  59  64.809   7.074  12.714
  513    HE   ARG  59           HE       ARG  59  66.890   5.069  13.032
  514   HH11  ARG  59          HH11      ARG  59  66.910   4.024  15.044
  515   HH12  ARG  59          HH12      ARG  59  65.425   3.746  15.913
  516   HH21  ARG  59          HH21      ARG  59  63.497   5.405  13.611
  517   HH22  ARG  59          HH22      ARG  59  63.503   4.503  15.124
  518    H    LYS  60           HN       LYS  60  61.567   5.736   7.139
  519    HA   LYS  60           HA       LYS  60  60.788   6.796   5.253
  520    HB2  LYS  60           HB2      LYS  60  61.989   9.454   5.894
  521    HB3  LYS  60           HB1      LYS  60  60.579   9.099   4.943
  522    HG2  LYS  60           HG2      LYS  60  59.144   9.254   6.745
  523    HG3  LYS  60           HG1      LYS  60  60.290   8.588   7.901
  524    HD2  LYS  60           HD2      LYS  60  61.680  10.672   7.676
  525    HD3  LYS  60           HD1      LYS  60  60.386  11.387   6.692
  526    HE2  LYS  60           HE2      LYS  60  58.851  11.282   8.593
  527    HE3  LYS  60           HE1      LYS  60  60.023  10.327   9.527
  528    HZ1  LYS  60           HZ1      LYS  60  60.492  13.112   8.615
  529    HZ2  LYS  60           HZ2      LYS  60  61.533  12.209   9.479
  530    HZ3  LYS  60           HZ3      LYS  60  60.122  12.682  10.164
  531    H    LEU  61          HD12      LEU  61  63.884   8.019   6.368
  532    HA   LEU  61          HD13      LEU  61  65.300   7.209   3.890
  533    HB2  LEU  61          HD22      LEU  61  66.387   8.303   6.521
  534    HB3  LEU  61          HD21      LEU  61  67.254   8.149   4.992
  535    HG   LEU  61          HD23      LEU  61  64.960  10.079   5.576
  536   HD11  LEU  61           HA       LEU  61  66.648  11.821   5.326
  537   HD12  LEU  61           HB1      LEU  61  67.909  10.605   5.026
  538   HD13  LEU  61           HN       LEU  61  67.112  10.698   6.613
  539   HD21  LEU  61           HB2      LEU  61  66.608   9.759   3.020
  540   HD22  LEU  61          HD11      LEU  61  64.877   9.397   3.201
  541   HD23  LEU  61           HG       LEU  61  65.448  11.063   3.359
  542    H    GLU  62           HN       GLU  62  67.439   5.940   4.764
  543    HA   GLU  62           HA       GLU  62  68.271   3.891   5.251
  544    HB2  GLU  62           HB2      GLU  62  66.381   4.044   7.578
  545    HB3  GLU  62           HB1      GLU  62  67.642   2.828   7.418
  546    HG2  GLU  62           HG2      GLU  62  69.306   4.465   7.918
  547    HG3  GLU  62           HG1      GLU  62  68.211   5.804   7.557
  Start of MODEL    4
    1    H1   ALA   1           HT1      ALA   1  43.493  12.677  12.930
    2    H2   ALA   1           HT2      ALA   1  43.857  11.217  12.142
    3    H3   ALA   1           HT3      ALA   1  43.570  12.623  11.234
    4    HA   ALA   1           HA       ALA   1  45.546  13.663  12.134
    5    HB1  ALA   1           HB1      ALA   1  45.364  12.528  14.349
    6    HB2  ALA   1           HB2      ALA   1  45.880  10.976  13.606
    7    HB3  ALA   1           HB3      ALA   1  47.028  12.365  13.692
    8    H    SER   2           HN       SER   2  44.730  11.042  10.174
    9    HA   SER   2           HA       SER   2  47.304  11.220   8.838
   10    HB2  SER   2           HB1      SER   2  47.056   8.780   8.184
   11    HB3  SER   2           HB2      SER   2  47.314   8.960   9.948
   12    HG   SER   2           HG       SER   2  45.571   7.508   9.205
   13    H    MET   3           HN       MET   3  47.174  11.435   6.600
   14    HA   MET   3           HA       MET   3  44.528  11.334   5.401
   15    HB2  MET   3           HB1      MET   3  46.474  13.710   5.371
   16    HB3  MET   3           HB2      MET   3  45.127  13.567   4.213
   17    HG2  MET   3           HG1      MET   3  43.466  13.664   6.147
   18    HG3  MET   3           HG2      MET   3  44.829  13.710   7.312
   19    HE1  MET   3           HE1      MET   3  43.500  17.040   4.342
   20    HE2  MET   3           HE2      MET   3  44.187  15.468   3.805
   21    HE3  MET   3           HE3      MET   3  42.615  15.513   4.678
   22    H    VAL   4           HN       VAL   4  44.554  10.757   3.225
   23    HA   VAL   4           HA       VAL   4  46.952   9.624   2.237
   24    HB   VAL   4           HB       VAL   4  45.621   8.991   0.280
   25   HG11  VAL   4          HG11      VAL   4  44.086   7.442   1.639
   26   HG12  VAL   4          HG12      VAL   4  45.739   7.505   2.320
   27   HG13  VAL   4          HG13      VAL   4  44.407   8.436   3.102
   28   HG21  VAL   4          HG21      VAL   4  43.104   9.354   0.377
   29   HG22  VAL   4          HG22      VAL   4  43.332  10.458   1.782
   30   HG23  VAL   4          HG23      VAL   4  43.998  10.893   0.168
   31    H    LEU   5           HN       LEU   5  45.328  12.722   1.760
   32    HA   LEU   5           HA       LEU   5  46.490  13.469  -0.650
   33    HB2  LEU   5           HB1      LEU   5  44.477  14.519   0.372
   34    HB3  LEU   5           HB2      LEU   5  45.432  15.077   1.766
   35    HG   LEU   5           HG       LEU   5  46.772  16.546   0.204
   36   HD11  LEU   5          HD11      LEU   5  45.774  17.040  -2.106
   37   HD12  LEU   5          HD12      LEU   5  46.416  15.363  -1.967
   38   HD13  LEU   5          HD13      LEU   5  44.640  15.660  -1.882
   39   HD21  LEU   5          HD21      LEU   5  44.958  18.274  -0.095
   40   HD22  LEU   5          HD22      LEU   5  43.707  17.031   0.230
   41   HD23  LEU   5          HD23      LEU   5  44.884  17.474   1.517
   42    H    SER   6           HN       SER   6  47.593  13.896   2.723
   43    HA   SER   6           HA       SER   6  49.678  15.668   2.126
   44    HB2  SER   6           HB1      SER   6  49.132  13.831   4.556
   45    HB3  SER   6           HB2      SER   6  50.377  15.120   4.582
   46    HG   SER   6           HG       SER   6  48.194  15.639   5.446
   47    HA   PRO   7           HA       PRO   7  52.932  12.905   0.962
   48    HB2  PRO   7           HB2      PRO   7  55.245  14.043   1.867
   49    HB3  PRO   7           HB1      PRO   7  54.196  14.848   0.633
   50    HG2  PRO   7           HG2      PRO   7  54.170  15.395   3.636
   51    HG3  PRO   7           HG1      PRO   7  54.304  16.593   2.281
   52    HD2  PRO   7           HD2      PRO   7  51.865  15.954   3.422
   53    HD3  PRO   7           HD1      PRO   7  52.042  16.393   1.654
   54    H    ARG   8           HN       ARG   8  52.149  13.322   4.212
   55    HA   ARG   8           HA       ARG   8  53.731  11.404   5.539
   56    HB2  ARG   8           HB1      ARG   8  52.182  13.202   6.519
   57    HB3  ARG   8           HB2      ARG   8  50.795  12.170   6.098
   58    HG2  ARG   8           HG1      ARG   8  51.205  11.723   8.414
   59    HG3  ARG   8           HG2      ARG   8  51.919  10.324   7.590
   60    HD2  ARG   8           HD1      ARG   8  54.212  11.360   7.633
   61    HD3  ARG   8           HD2      ARG   8  53.572  12.774   8.567
   62    HE   ARG   8           HE       ARG   8  52.697  10.489   9.921
   63   HH11  ARG   8          HH11      ARG   8  55.682  10.071  11.949
   64   HH12  ARG   8          HH12      ARG   8  54.004   9.636  11.727
   65   HH21  ARG   8          HH21      ARG   8  56.659  11.579  10.377
   66   HH22  ARG   8          HH22      ARG   8  55.683  12.143   9.063
   67    H    ASP   9           HN       ASP   9  51.492  10.893   2.954
   68    HA   ASP   9           HA       ASP   9  49.925   8.842   3.897
   69    HB2  ASP   9           HB1      ASP   9  49.323   8.500   1.468
   70    HB3  ASP   9           HB2      ASP   9  49.322  10.249   1.882
   71    H    GLU  10           HN       GLU  10  53.241   8.661   2.790
   72    HA   GLU  10           HA       GLU  10  53.446   5.975   2.136
   73    HB2  GLU  10           HB1      GLU  10  55.229   7.710   1.802
   74    HB3  GLU  10           HB2      GLU  10  55.428   7.862   3.562
   75    HG2  GLU  10           HG1      GLU  10  56.240   5.482   3.692
   76    HG3  GLU  10           HG2      GLU  10  56.004   5.280   1.915
   77    H    ARG  11           HN       ARG  11  53.373   7.573   5.337
   78    HA   ARG  11           HA       ARG  11  54.066   5.349   6.928
   79    HB2  ARG  11           HB1      ARG  11  54.031   7.797   7.587
   80    HB3  ARG  11           HB2      ARG  11  52.254   7.810   7.492
   81    HG2  ARG  11           HG1      ARG  11  53.867   6.073   9.466
   82    HG3  ARG  11           HG2      ARG  11  53.356   7.732   9.833
   83    HD2  ARG  11           HD1      ARG  11  50.903   6.863   9.143
   84    HD3  ARG  11           HD2      ARG  11  51.578   5.255   9.633
   85    HE   ARG  11           HE       ARG  11  51.827   5.950  11.807
   86   HH11  ARG  11          HH11      ARG  11  50.456   8.937  13.298
   87   HH12  ARG  11          HH12      ARG  11  51.019   7.305  13.563
   88   HH21  ARG  11          HH21      ARG  11  50.377   9.742  11.061
   89   HH22  ARG  11          HH22      ARG  11  50.916   8.701   9.788
   90    H    THR  12           HN       THR  12  50.850   6.567   5.855
   91    HA   THR  12           HA       THR  12  49.333   4.541   7.016
   92    HB   THR  12           HB       THR  12  48.867   6.238   4.524
   93    HG1  THR  12           HG1      THR  12  47.556   7.443   5.966
   94   HG21  THR  12          HG21      THR  12  46.388   5.747   4.828
   95   HG22  THR  12          HG22      THR  12  47.262   4.181   4.716
   96   HG23  THR  12          HG23      THR  12  46.724   4.798   6.320
   97    H    LEU  13           HN       LEU  13  50.877   4.747   3.758
   98    HA   LEU  13           HA       LEU  13  49.630   2.498   2.690
   99    HB2  LEU  13           HB1      LEU  13  50.879   4.432   1.518
  100    HB3  LEU  13           HB2      LEU  13  52.411   3.709   2.061
  101    HG   LEU  13           HG       LEU  13  50.362   2.356   0.283
  102   HD11  LEU  13          HD11      LEU  13  51.991   3.021  -1.657
  103   HD12  LEU  13          HD12      LEU  13  51.163   4.408  -0.859
  104   HD13  LEU  13          HD13      LEU  13  52.881   4.034  -0.465
  105   HD21  LEU  13          HD21      LEU  13  52.222   0.888  -0.593
  106   HD22  LEU  13          HD22      LEU  13  53.353   1.594   0.605
  107   HD23  LEU  13          HD23      LEU  13  51.927   0.651   1.167
  108    H    VAL  14           HN       VAL  14  52.777   2.861   4.441
  109    HA   VAL  14           HA       VAL  14  53.594   0.212   4.215
  110    HB   VAL  14           HB       VAL  14  54.262   2.388   6.199
  111   HG11  VAL  14          HG11      VAL  14  56.300   0.979   6.759
  112   HG12  VAL  14          HG12      VAL  14  54.783   0.186   7.279
  113   HG13  VAL  14          HG13      VAL  14  55.626  -0.374   5.785
  114   HG21  VAL  14          HG21      VAL  14  56.398   2.430   4.734
  115   HG22  VAL  14          HG22      VAL  14  55.664   1.165   3.680
  116   HG23  VAL  14          HG23      VAL  14  54.927   2.805   3.782
  117    H    ARG  15           HN       ARG  15  51.663   1.821   6.873
  118    HA   ARG  15           HA       ARG  15  51.347  -0.527   8.382
  119    HB2  ARG  15           HB1      ARG  15  50.889   1.706   9.261
  120    HB3  ARG  15           HB2      ARG  15  49.539   1.940   8.123
  121    HG2  ARG  15           HG1      ARG  15  48.293   0.027   9.228
  122    HG3  ARG  15           HG2      ARG  15  49.681  -0.304  10.281
  123    HD2  ARG  15           HD1      ARG  15  48.057   0.896  11.620
  124    HD3  ARG  15           HD2      ARG  15  49.455   2.015  11.354
  125    HE   ARG  15           HE       ARG  15  46.855   2.134   9.889
  126   HH11  ARG  15          HH11      ARG  15  47.327   5.684   9.584
  127   HH12  ARG  15          HH12      ARG  15  46.284   4.317   9.276
  128   HH21  ARG  15          HH21      ARG  15  49.440   5.261  10.612
  129   HH22  ARG  15          HH22      ARG  15  49.833   3.632  11.047
  130    H    LYS  16           HN       LYS  16  49.290   0.738   5.648
  131    HA   LYS  16           HA       LYS  16  47.293  -1.162   5.917
  132    HB2  LYS  16           HB1      LYS  16  48.375   0.436   3.533
  133    HB3  LYS  16           HB2      LYS  16  46.996  -0.672   3.317
  134    HG2  LYS  16           HG1      LYS  16  46.987   1.636   5.375
  135    HG3  LYS  16           HG2      LYS  16  46.487   1.865   3.667
  136    HD2  LYS  16           HD1      LYS  16  44.770  -0.010   4.010
  137    HD3  LYS  16           HD2      LYS  16  45.243  -0.059   5.742
  138    HE2  LYS  16           HE1      LYS  16  44.527   2.342   6.027
  139    HE3  LYS  16           HE2      LYS  16  44.071   2.419   4.283
  140    HZ1  LYS  16           HZ1      LYS  16  42.175   1.947   5.692
  141    HZ2  LYS  16           HZ2      LYS  16  42.498   0.628   4.672
  142    HZ3  LYS  16           HZ3      LYS  16  42.928   0.557   6.311
  143    H    VAL  17           HN       VAL  17  50.375  -1.419   3.900
  144    HA   VAL  17           HA       VAL  17  49.429  -3.713   2.604
  145    HB   VAL  17           HB       VAL  17  51.689  -4.071   1.807
  146   HG11  VAL  17          HG11      VAL  17  51.713  -1.848   0.510
  147   HG12  VAL  17          HG12      VAL  17  50.070  -2.551   0.602
  148   HG13  VAL  17          HG13      VAL  17  50.524  -1.176   1.680
  149   HG21  VAL  17          HG21      VAL  17  53.449  -2.327   2.276
  150   HG22  VAL  17          HG22      VAL  17  52.401  -1.637   3.568
  151   HG23  VAL  17          HG23      VAL  17  53.047  -3.310   3.719
  152    H    GLN  18           HN       GLN  18  51.226  -3.355   5.729
  153    HA   GLN  18           HA       GLN  18  51.723  -6.090   6.007
  154    HB2  GLN  18           HB1      GLN  18  51.286  -3.802   7.986
  155    HB3  GLN  18           HB2      GLN  18  51.735  -5.434   8.544
  156    HG2  GLN  18           HG1      GLN  18  53.901  -5.312   7.212
  157    HG3  GLN  18           HG2      GLN  18  53.417  -3.722   6.532
  158   HE21  GLN  18          HE21      GLN  18  54.700  -1.951   9.272
  159   HE22  GLN  18          HE22      GLN  18  54.089  -1.937   7.632
  160    H    ILE  19           HN       ILE  19  48.858  -4.081   7.001
  161    HA   ILE  19           HA       ILE  19  47.523  -6.197   8.257
  162    HB   ILE  19           HB       ILE  19  46.691  -3.536   7.109
  163   HG12  ILE  19          HG11      ILE  19  47.009  -4.444  10.049
  164   HG13  ILE  19          HG12      ILE  19  48.225  -3.547   9.085
  165   HG21  ILE  19          HG21      ILE  19  44.446  -3.796   8.283
  166   HG22  ILE  19          HG22      ILE  19  44.665  -5.198   7.189
  167   HG23  ILE  19          HG23      ILE  19  44.940  -5.386   8.960
  168   HD11  ILE  19          HD11      ILE  19  46.994  -1.984  10.544
  169   HD12  ILE  19          HD12      ILE  19  46.600  -1.628   8.824
  170   HD13  ILE  19          HD13      ILE  19  45.417  -2.509   9.861
  171    H    ASN  20           HN       ASN  20  47.332  -4.928   4.864
  172    HA   ASN  20           HA       ASN  20  45.708  -7.249   4.261
  173    HB2  ASN  20           HB1      ASN  20  44.439  -5.751   2.602
  174    HB3  ASN  20           HB2      ASN  20  44.050  -5.581   4.342
  175   HD21  ASN  20          HD21      ASN  20  45.978  -2.454   2.410
  176   HD22  ASN  20          HD22      ASN  20  46.324  -4.082   1.878
  177    HA   PRO  21           HA       PRO  21  49.547  -7.000   1.793
  178    HB2  PRO  21           HB2      PRO  21  50.378  -9.610   1.863
  179    HB3  PRO  21           HB1      PRO  21  50.463  -8.513   3.299
  180    HG2  PRO  21           HG2      PRO  21  48.234 -10.511   2.685
  181    HG3  PRO  21           HG1      PRO  21  49.173 -10.321   4.225
  182    HD2  PRO  21           HD2      PRO  21  46.754  -9.035   3.852
  183    HD3  PRO  21           HD1      PRO  21  48.113  -8.324   4.850
  184    H    ARG  22           HN       ARG  22  46.623  -8.643   0.890
  185    HA   ARG  22           HA       ARG  22  47.433  -9.683  -1.607
  186    HB2  ARG  22           HB1      ARG  22  45.087  -9.734  -2.217
  187    HB3  ARG  22           HB2      ARG  22  45.319 -10.428  -0.594
  188    HG2  ARG  22           HG1      ARG  22  44.407  -7.514  -1.047
  189    HG3  ARG  22           HG2      ARG  22  43.253  -8.861  -1.069
  190    HD2  ARG  22           HD1      ARG  22  43.833  -9.538   1.249
  191    HD3  ARG  22           HD2      ARG  22  45.012  -8.170   1.386
  192    HE   ARG  22           HE       ARG  22  42.861  -6.828   0.521
  193   HH11  ARG  22          HH11      ARG  22  40.770  -6.658   3.437
  194   HH12  ARG  22          HH12      ARG  22  41.373  -5.823   2.025
  195   HH21  ARG  22          HH21      ARG  22  41.690  -8.801   3.940
  196   HH22  ARG  22          HH22      ARG  22  42.881  -9.460   2.871
  197    H    THR  23           HN       THR  23  47.143  -6.433  -0.577
  198    HA   THR  23           HA       THR  23  46.159  -5.203  -2.856
  199    HB   THR  23           HB       THR  23  48.015  -4.249  -0.639
  200    HG1  THR  23           HG1      THR  23  46.054  -3.347   0.143
  201   HG21  THR  23          HG21      THR  23  47.287  -1.885  -1.193
  202   HG22  THR  23          HG22      THR  23  47.961  -2.621  -2.685
  203   HG23  THR  23          HG23      THR  23  46.177  -2.485  -2.477
  204    H    THR  24           HN       THR  24  46.970  -4.506  -4.754
  205    HA   THR  24           HA       THR  24  49.832  -4.945  -5.249
  206    HB   THR  24           HB       THR  24  47.415  -5.421  -7.066
  207    HG1  THR  24           HG1      THR  24  48.128  -7.597  -6.970
  208   HG21  THR  24          HG21      THR  24  49.061  -6.430  -8.732
  209   HG22  THR  24          HG22      THR  24  49.647  -4.783  -8.322
  210   HG23  THR  24          HG23      THR  24  50.421  -6.225  -7.571
  211    H    ALA  25           HN       ALA  25  50.564  -3.547  -7.224
  212    HA   ALA  25           HA       ALA  25  50.231  -0.867  -6.509
  213    HB1  ALA  25           HB1      ALA  25  52.258  -1.829  -7.586
  214    HB2  ALA  25           HB2      ALA  25  51.339  -2.071  -9.112
  215    HB3  ALA  25           HB3      ALA  25  51.655  -0.402  -8.498
  216    H    LYS  26           HN       LYS  26  48.320  -2.752  -8.767
  217    HA   LYS  26           HA       LYS  26  47.044  -0.732 -10.170
  218    HB2  LYS  26           HB1      LYS  26  46.874  -3.182 -10.645
  219    HB3  LYS  26           HB2      LYS  26  46.015  -3.444  -9.104
  220    HG2  LYS  26           HG1      LYS  26  44.093  -2.020  -9.943
  221    HG3  LYS  26           HG2      LYS  26  44.989  -1.702 -11.464
  222    HD2  LYS  26           HD1      LYS  26  44.890  -4.098 -12.068
  223    HD3  LYS  26           HD2      LYS  26  44.189  -4.512 -10.468
  224    HE2  LYS  26           HE1      LYS  26  42.100  -3.264 -10.988
  225    HE3  LYS  26           HE2      LYS  26  42.803  -2.655 -12.534
  226    HZ1  LYS  26           HZ1      LYS  26  41.390  -4.577 -12.881
  227    HZ2  LYS  26           HZ2      LYS  26  42.998  -4.945 -13.283
  228    HZ3  LYS  26           HZ3      LYS  26  42.337  -5.515 -11.829
  229    H    ASP  27           HN       ASP  27  46.289  -2.032  -6.825
  230    HA   ASP  27           HA       ASP  27  44.029  -0.438  -6.467
  231    HB2  ASP  27           HB1      ASP  27  46.096  -1.657  -4.509
  232    HB3  ASP  27           HB2      ASP  27  44.546  -0.931  -3.962
  233    H    LEU  28           HN       LEU  28  47.531   0.146  -5.841
  234    HA   LEU  28           HA       LEU  28  47.195   2.499  -4.409
  235    HB2  LEU  28           HB1      LEU  28  49.501   1.346  -6.043
  236    HB3  LEU  28           HB2      LEU  28  49.653   2.959  -5.306
  237    HG   LEU  28           HG       LEU  28  50.742   1.225  -4.055
  238   HD11  LEU  28          HD11      LEU  28  49.677   1.696  -1.728
  239   HD12  LEU  28          HD12      LEU  28  49.938   3.153  -2.754
  240   HD13  LEU  28          HD13      LEU  28  48.290   2.445  -2.595
  241   HD21  LEU  28          HD21      LEU  28  49.524  -0.518  -2.668
  242   HD22  LEU  28          HD22      LEU  28  48.001  -0.125  -3.527
  243   HD23  LEU  28          HD23      LEU  28  49.396  -0.801  -4.442
  244    H    VAL  29           HN       VAL  29  47.706   2.036  -8.049
  245    HA   VAL  29           HA       VAL  29  47.814   4.776  -8.535
  246    HB   VAL  29           HB       VAL  29  48.632   3.155 -10.111
  247   HG11  VAL  29          HG11      VAL  29  47.035   2.044 -11.710
  248   HG12  VAL  29          HG12      VAL  29  46.876   1.387 -10.054
  249   HG13  VAL  29          HG13      VAL  29  45.650   2.552 -10.683
  250   HG21  VAL  29          HG21      VAL  29  47.733   4.361 -12.152
  251   HG22  VAL  29          HG22      VAL  29  46.468   5.118 -11.117
  252   HG23  VAL  29          HG23      VAL  29  48.210   5.473 -10.830
  253    H    LYS  30           HN       LYS  30  44.919   2.561  -8.303
  254    HA   LYS  30           HA       LYS  30  43.080   4.482  -9.107
  255    HB2  LYS  30           HB1      LYS  30  42.931   2.064  -7.229
  256    HB3  LYS  30           HB2      LYS  30  41.473   3.015  -7.614
  257    HG2  LYS  30           HG1      LYS  30  41.706   2.438 -10.044
  258    HG3  LYS  30           HG2      LYS  30  43.278   1.629  -9.729
  259    HD2  LYS  30           HD1      LYS  30  41.415  -0.008 -10.023
  260    HD3  LYS  30           HD2      LYS  30  42.151  -0.120  -8.388
  261    HE2  LYS  30           HE1      LYS  30  40.228   1.122  -7.393
  262    HE3  LYS  30           HE2      LYS  30  39.496   1.340  -9.029
  263    HZ1  LYS  30           HZ1      LYS  30  38.555  -0.547  -7.862
  264    HZ2  LYS  30           HZ2      LYS  30  39.396  -1.065  -9.244
  265    HZ3  LYS  30           HZ3      LYS  30  40.084  -1.267  -7.708
  266    H    MET  31           HN       MET  31  44.274   3.755  -5.677
  267    HA   MET  31           HA       MET  31  42.585   5.690  -4.573
  268    HB2  MET  31           HB1      MET  31  45.228   4.464  -3.626
  269    HB3  MET  31           HB2      MET  31  44.274   5.561  -2.594
  270    HG2  MET  31           HG1      MET  31  42.282   3.871  -2.835
  271    HG3  MET  31           HG2      MET  31  43.413   2.777  -3.698
  272    HE1  MET  31           HE1      MET  31  46.102   2.092  -0.795
  273    HE2  MET  31           HE2      MET  31  45.730   1.870  -2.538
  274    HE3  MET  31           HE3      MET  31  46.138   3.502  -1.907
  275    H    LEU  32           HN       LEU  32  46.043   5.887  -5.662
  276    HA   LEU  32           HA       LEU  32  46.452   8.449  -4.642
  277    HB2  LEU  32           HB1      LEU  32  47.848   6.758  -6.779
  278    HB3  LEU  32           HB2      LEU  32  48.483   8.351  -6.303
  279    HG   LEU  32           HG       LEU  32  47.933   6.072  -4.299
  280   HD11  LEU  32          HD11      LEU  32  50.457   5.588  -4.402
  281   HD12  LEU  32          HD12      LEU  32  49.603   5.215  -5.945
  282   HD13  LEU  32          HD13      LEU  32  50.585   6.720  -5.795
  283   HD21  LEU  32          HD21      LEU  32  49.573   7.289  -2.823
  284   HD22  LEU  32          HD22      LEU  32  49.749   8.577  -4.057
  285   HD23  LEU  32          HD23      LEU  32  48.158   8.316  -3.257
  286    H    GLU  33           HN       GLU  33  45.527   7.356  -8.012
  287    HA   GLU  33           HA       GLU  33  45.752   9.916  -9.127
  288    HB2  GLU  33           HB1      GLU  33  45.859   7.786 -10.414
  289    HB3  GLU  33           HB2      GLU  33  44.144   7.476 -10.060
  290    HG2  GLU  33           HG1      GLU  33  43.475   9.529 -11.338
  291    HG3  GLU  33           HG2      GLU  33  45.205   9.946 -11.640
  292    H    GLU  34           HN       GLU  34  42.866   8.143  -7.750
  293    HA   GLU  34           HA       GLU  34  41.024  10.162  -8.290
  294    HB2  GLU  34           HB1      GLU  34  41.147   7.960  -6.171
  295    HB3  GLU  34           HB2      GLU  34  39.747   9.047  -6.307
  296    HG2  GLU  34           HG1      GLU  34  40.772   7.292  -8.648
  297    HG3  GLU  34           HG2      GLU  34  39.467   6.772  -7.516
  298    H    THR  35           HN       THR  35  43.142   9.644  -5.362
  299    HA   THR  35           HA       THR  35  42.133  11.841  -3.972
  300    HB   THR  35           HB       THR  35  44.895  10.564  -3.934
  301    HG1  THR  35           HG1      THR  35  44.078   9.568  -2.047
  302   HG21  THR  35          HG21      THR  35  45.131  11.616  -1.610
  303   HG22  THR  35          HG22      THR  35  44.739  12.926  -2.774
  304   HG23  THR  35          HG23      THR  35  43.455  12.263  -1.700
  305    H    GLY  36           HN       GLY  36  44.800  11.605  -6.380
  306    HA2  GLY  36           HA2      GLY  36  45.493  13.329  -7.714
  307    HA3  GLY  36           HA1      GLY  36  44.800  14.510  -6.521
  308    H    THR  37           HN       THR  37  46.897  11.803  -5.477
  309    HA   THR  37           HA       THR  37  48.747  13.854  -4.535
  310    HB   THR  37           HB       THR  37  48.501  10.887  -3.838
  311    HG1  THR  37           HG1      THR  37  47.711  11.668  -1.846
  312   HG21  THR  37          HG21      THR  37  50.020  11.497  -1.843
  313   HG22  THR  37          HG22      THR  37  50.822  12.100  -3.333
  314   HG23  THR  37          HG23      THR  37  49.925  13.243  -2.270
  315    H    LYS  38           HN       LYS  38  50.870  13.986  -5.292
  316    HA   LYS  38           HA       LYS  38  51.258  12.541  -7.741
  317    HB2  LYS  38           HB1      LYS  38  52.854  14.748  -6.338
  318    HB3  LYS  38           HB2      LYS  38  53.310  14.088  -7.930
  319    HG2  LYS  38           HG1      LYS  38  50.601  15.475  -7.294
  320    HG3  LYS  38           HG2      LYS  38  52.022  16.314  -8.001
  321    HD2  LYS  38           HD1      LYS  38  51.913  14.680  -9.962
  322    HD3  LYS  38           HD2      LYS  38  50.426  13.978  -9.240
  323    HE2  LYS  38           HE1      LYS  38  49.250  16.192  -9.434
  324    HE3  LYS  38           HE2      LYS  38  50.747  16.943 -10.107
  325    HZ1  LYS  38           HZ1      LYS  38  49.215  16.275 -11.840
  326    HZ2  LYS  38           HZ2      LYS  38  50.648  15.369 -11.936
  327    HZ3  LYS  38           HZ3      LYS  38  49.242  14.665 -11.303
  328    H    VAL  39           HN       VAL  39  51.554  10.416  -6.812
  329    HA   VAL  39           HA       VAL  39  54.263   9.916  -5.787
  330    HB   VAL  39           HB       VAL  39  51.685   8.334  -5.390
  331   HG11  VAL  39          HG11      VAL  39  53.081   6.895  -3.834
  332   HG12  VAL  39          HG12      VAL  39  53.644   6.779  -5.529
  333   HG13  VAL  39          HG13      VAL  39  54.557   7.787  -4.342
  334   HG21  VAL  39          HG21      VAL  39  52.064   8.951  -2.924
  335   HG22  VAL  39          HG22      VAL  39  53.456   9.981  -3.421
  336   HG23  VAL  39          HG23      VAL  39  51.784  10.397  -3.943
  337    H    SER  40           HN       SER  40  55.573   8.524  -7.004
  338    HA   SER  40           HA       SER  40  54.617   7.969  -9.614
  339    HB2  SER  40           HB1      SER  40  56.936   8.790  -9.266
  340    HB3  SER  40           HB2      SER  40  57.325   7.394  -8.213
  341    HG   SER  40           HG       SER  40  58.033   7.323 -10.486
  342    H    ILE  41           HN       ILE  41  54.426   5.994 -10.698
  343    HA   ILE  41           HA       ILE  41  53.449   3.799  -9.274
  344    HB   ILE  41           HB       ILE  41  54.412   4.164 -12.117
  345   HG12  ILE  41          HG11      ILE  41  52.526   5.617 -11.682
  346   HG13  ILE  41          HG12      ILE  41  51.971   4.269 -12.725
  347   HG21  ILE  41          HG21      ILE  41  53.164   2.007 -12.681
  348   HG22  ILE  41          HG22      ILE  41  54.321   1.648 -11.361
  349   HG23  ILE  41          HG23      ILE  41  52.572   1.866 -10.988
  350   HD11  ILE  41          HD11      ILE  41  50.262   4.781 -11.040
  351   HD12  ILE  41          HD12      ILE  41  50.939   3.143 -10.719
  352   HD13  ILE  41          HD13      ILE  41  51.434   4.544  -9.698
  353    H    SER  42           HN       SER  42  56.672   4.477 -10.733
  354    HA   SER  42           HA       SER  42  57.698   1.920 -10.413
  355    HB2  SER  42           HB1      SER  42  58.651   3.657 -11.942
  356    HB3  SER  42           HB2      SER  42  59.087   4.695 -10.548
  357    HG   SER  42           HG       SER  42  60.785   3.336 -11.518
  358    H    THR  43           HN       THR  43  57.807   4.781  -8.148
  359    HA   THR  43           HA       THR  43  59.416   3.450  -6.295
  360    HB   THR  43           HB       THR  43  58.679   5.172  -4.663
  361    HG1  THR  43           HG1      THR  43  57.595   6.960  -5.540
  362   HG21  THR  43          HG21      THR  43  59.925   7.032  -5.919
  363   HG22  THR  43          HG22      THR  43  60.674   5.452  -6.331
  364   HG23  THR  43          HG23      THR  43  59.553   6.246  -7.495
  365    H    VAL  44           HN       VAL  44  55.723   3.649  -6.481
  366    HA   VAL  44           HA       VAL  44  55.451   2.322  -4.023
  367    HB   VAL  44           HB       VAL  44  53.204   1.725  -4.612
  368   HG11  VAL  44          HG11      VAL  44  52.423   4.165  -4.792
  369   HG12  VAL  44          HG12      VAL  44  53.734   3.971  -3.590
  370   HG13  VAL  44          HG13      VAL  44  54.101   4.651  -5.220
  371   HG21  VAL  44          HG21      VAL  44  52.150   2.606  -6.703
  372   HG22  VAL  44          HG22      VAL  44  53.785   3.005  -7.346
  373   HG23  VAL  44          HG23      VAL  44  53.331   1.295  -7.017
  374    H    LYS  45           HN       LYS  45  55.918   1.051  -7.398
  375    HA   LYS  45           HA       LYS  45  55.310  -1.581  -6.768
  376    HB2  LYS  45           HB1      LYS  45  55.423  -0.658  -9.054
  377    HB3  LYS  45           HB2      LYS  45  57.170  -0.348  -8.886
  378    HG2  LYS  45           HG1      LYS  45  57.605  -2.824  -8.732
  379    HG3  LYS  45           HG2      LYS  45  55.841  -3.152  -8.772
  380    HD2  LYS  45           HD1      LYS  45  55.702  -2.201 -11.075
  381    HD3  LYS  45           HD2      LYS  45  57.439  -1.744 -11.012
  382    HE2  LYS  45           HE1      LYS  45  56.533  -4.683 -10.690
  383    HE3  LYS  45           HE2      LYS  45  56.841  -3.946 -12.309
  384    HZ1  LYS  45           HZ1      LYS  45  58.799  -5.033 -11.423
  385    HZ2  LYS  45           HZ2      LYS  45  59.061  -3.360 -11.558
  386    HZ3  LYS  45           HZ3      LYS  45  58.770  -4.052 -10.038
  387    H    ARG  46           HN       ARG  46  58.586   0.059  -6.718
  388    HA   ARG  46           HA       ARG  46  59.914  -2.239  -5.821
  389    HB2  ARG  46           HB1      ARG  46  60.546   0.696  -5.726
  390    HB3  ARG  46           HB2      ARG  46  61.628  -0.464  -4.918
  391    HG2  ARG  46           HG1      ARG  46  61.816  -1.740  -7.156
  392    HG3  ARG  46           HG2      ARG  46  60.757  -0.537  -7.917
  393    HD2  ARG  46           HD1      ARG  46  63.252   0.516  -6.517
  394    HD3  ARG  46           HD2      ARG  46  63.426  -0.227  -8.159
  395    HE   ARG  46           HE       ARG  46  61.304   1.295  -8.633
  396   HH11  ARG  46          HH11      ARG  46  62.468   4.657  -8.672
  397   HH12  ARG  46          HH12      ARG  46  61.343   3.482  -9.309
  398   HH21  ARG  46          HH21      ARG  46  64.143   3.872  -7.145
  399   HH22  ARG  46          HH22      ARG  46  64.134   2.196  -6.713
  400    H    VAL  47           HN       VAL  47  58.396   0.441  -3.719
  401    HA   VAL  47           HA       VAL  47  59.446  -0.706  -1.389
  402    HB   VAL  47           HB       VAL  47  58.715   1.617  -1.573
  403   HG11  VAL  47          HG11      VAL  47  56.293   2.133  -1.093
  404   HG12  VAL  47          HG12      VAL  47  56.504   1.384  -2.704
  405   HG13  VAL  47          HG13      VAL  47  55.877   0.399  -1.328
  406   HG21  VAL  47          HG21      VAL  47  57.818   1.674   0.785
  407   HG22  VAL  47          HG22      VAL  47  57.617  -0.116   0.725
  408   HG23  VAL  47          HG23      VAL  47  59.255   0.620   0.597
  409    H    LEU  48           HN       LEU  48  56.297  -1.362  -3.146
  410    HA   LEU  48           HA       LEU  48  55.308  -3.139  -1.267
  411    HB2  LEU  48           HB1      LEU  48  55.012  -2.899  -4.304
  412    HB3  LEU  48           HB2      LEU  48  54.135  -4.159  -3.406
  413    HG   LEU  48           HG       LEU  48  53.950  -1.155  -2.703
  414   HD11  LEU  48          HD11      LEU  48  51.724  -1.160  -3.974
  415   HD12  LEU  48          HD12      LEU  48  53.126  -1.436  -5.070
  416   HD13  LEU  48          HD13      LEU  48  52.085  -2.820  -4.568
  417   HD21  LEU  48          HD21      LEU  48  51.794  -1.828  -1.609
  418   HD22  LEU  48          HD22      LEU  48  52.072  -3.538  -2.068
  419   HD23  LEU  48          HD23      LEU  48  53.200  -2.723  -0.927
  420    H    TYR  49           HN       TYR  49  57.515  -3.798  -4.109
  421    HA   TYR  49           HA       TYR  49  57.654  -6.534  -3.676
  422    HB2  TYR  49           HB1      TYR  49  58.338  -5.428  -5.795
  423    HB3  TYR  49           HB2      TYR  49  59.628  -4.515  -4.955
  424    HD1  TYR  49           HD1      TYR  49  58.495  -8.120  -5.381
  425    HD2  TYR  49           HD2      TYR  49  61.779  -5.343  -5.245
  426    HE1  TYR  49           HE1      TYR  49  60.075  -9.941  -5.992
  427    HE2  TYR  49           HE2      TYR  49  63.328  -7.142  -5.930
  428    HH   TYR  49           HH       TYR  49  63.543  -9.291  -6.540
  429    H    ARG  50           HN       ARG  50  59.791  -3.892  -2.343
  430    HA   ARG  50           HA       ARG  50  61.476  -5.644  -0.935
  431    HB2  ARG  50           HB1      ARG  50  60.673  -2.738  -0.487
  432    HB3  ARG  50           HB2      ARG  50  61.863  -3.529   0.572
  433    HG2  ARG  50           HG1      ARG  50  63.293  -4.002  -1.522
  434    HG3  ARG  50           HG2      ARG  50  62.095  -3.146  -2.510
  435    HD2  ARG  50           HD1      ARG  50  63.978  -1.615  -2.022
  436    HD3  ARG  50           HD2      ARG  50  62.470  -0.983  -1.243
  437    HE   ARG  50           HE       ARG  50  63.751  -2.714   0.598
  438   HH11  ARG  50          HH11      ARG  50  65.210   1.136   0.232
  439   HH12  ARG  50          HH12      ARG  50  64.420   0.300  -1.083
  440   HH21  ARG  50          HH21      ARG  50  65.425  -0.012   2.313
  441   HH22  ARG  50          HH22      ARG  50  64.756  -1.602   2.448
  442    H    HIS  51           HN       HIS  51  58.451  -3.965   0.224
  443    HA   HIS  51           HA       HIS  51  58.656  -5.041   2.811
  444    HB2  HIS  51           HB1      HIS  51  56.344  -3.777   1.298
  445    HB3  HIS  51           HB2      HIS  51  56.178  -4.373   2.973
  446    HD1  HIS  51           HD1      HIS  51  55.800  -1.425   2.846
  447    HD2  HIS  51           HD2      HIS  51  59.675  -3.015   3.099
  448    HE1  HIS  51           HE1      HIS  51  57.379   0.417   3.689
  449    H    ASN  52           HN       ASN  52  56.996  -6.366  -0.171
  450    HA   ASN  52           HA       ASN  52  55.805  -8.476   1.195
  451    HB2  ASN  52           HB1      ASN  52  55.300  -7.743  -1.185
  452    HB3  ASN  52           HB2      ASN  52  56.909  -8.326  -1.712
  453   HD21  ASN  52          HD21      ASN  52  54.950 -11.697  -0.703
  454   HD22  ASN  52          HD22      ASN  52  55.726 -10.681   0.487
  455    H    LEU  53           HN       LEU  53  59.165  -8.209  -0.267
  456    HA   LEU  53           HA       LEU  53  59.837 -10.834   0.426
  457    HB2  LEU  53           HB1      LEU  53  60.879  -9.567  -1.399
  458    HB3  LEU  53           HB2      LEU  53  61.515  -8.357  -0.260
  459    HG   LEU  53           HG       LEU  53  62.291 -11.269   0.105
  460   HD11  LEU  53          HD11      LEU  53  64.209 -10.918  -1.595
  461   HD12  LEU  53          HD12      LEU  53  62.578 -10.922  -2.360
  462   HD13  LEU  53          HD13      LEU  53  63.442  -9.365  -2.082
  463   HD21  LEU  53          HD21      LEU  53  64.527 -10.321   0.751
  464   HD22  LEU  53          HD22      LEU  53  63.945  -8.660   0.412
  465   HD23  LEU  53          HD23      LEU  53  63.194  -9.620   1.737
  466    H    LYS  54           HN       LYS  54  60.391  -7.679   2.188
  467    HA   LYS  54           HA       LYS  54  61.229  -9.289   4.496
  468    HB2  LYS  54           HB1      LYS  54  63.142  -8.008   3.345
  469    HB3  LYS  54           HB2      LYS  54  62.218  -6.497   3.546
  470    HG2  LYS  54           HG1      LYS  54  62.322  -7.094   6.154
  471    HG3  LYS  54           HG2      LYS  54  63.635  -8.216   5.666
  472    HD2  LYS  54           HD1      LYS  54  63.517  -5.158   5.215
  473    HD3  LYS  54           HD2      LYS  54  64.533  -6.026   6.415
  474    HE2  LYS  54           HE1      LYS  54  65.976  -6.940   4.696
  475    HE3  LYS  54           HE2      LYS  54  64.835  -6.468   3.378
  476    HZ1  LYS  54           HZ1      LYS  54  66.657  -4.894   3.604
  477    HZ2  LYS  54           HZ2      LYS  54  65.180  -4.150   3.988
  478    HZ3  LYS  54           HZ3      LYS  54  66.250  -4.597   5.225
  479    H    GLY  55           HN       GLY  55  59.749  -9.067   6.187
  480    HA2  GLY  55           HA2      GLY  55  57.769  -7.004   5.825
  481    HA3  GLY  55           HA1      GLY  55  57.741  -8.432   6.948
  482    H    ARG  56           HN       ARG  56  59.701  -5.470   6.487
  483    HA   ARG  56           HA       ARG  56  59.199  -4.712   9.301
  484    HB2  ARG  56           HB1      ARG  56  61.810  -4.595   7.726
  485    HB3  ARG  56           HB2      ARG  56  61.518  -3.439   9.047
  486    HG2  ARG  56           HG1      ARG  56  62.884  -5.169   9.980
  487    HG3  ARG  56           HG2      ARG  56  61.263  -5.490  10.623
  488    HD2  ARG  56           HD1      ARG  56  60.862  -7.378   9.236
  489    HD3  ARG  56           HD2      ARG  56  62.271  -7.030   8.152
  490    HE   ARG  56           HE       ARG  56  62.335  -8.217  10.834
  491   HH11  ARG  56          HH11      ARG  56  65.892  -8.773  10.434
  492   HH12  ARG  56          HH12      ARG  56  64.460  -9.135  11.367
  493   HH21  ARG  56          HH21      ARG  56  65.686  -7.290   8.606
  494   HH22  ARG  56          HH22      ARG  56  64.126  -6.645   8.229
  495    H    SER  57           HN       SER  57  58.839  -2.481   9.693
  496    HA   SER  57           HA       SER  57  58.255  -0.909   7.372
  497    HB2  SER  57           HB1      SER  57  56.819  -0.754   9.438
  498    HB3  SER  57           HB2      SER  57  58.237  -0.259  10.415
  499    HG   SER  57           HG       SER  57  56.760   1.436   9.632
  500    H    ALA  58           HN       ALA  58  59.382   0.992   6.669
  501    HA   ALA  58           HA       ALA  58  62.193   1.125   7.565
  502    HB1  ALA  58           HB1      ALA  58  61.794   0.829   5.108
  503    HB2  ALA  58           HB2      ALA  58  60.740   2.284   5.098
  504    HB3  ALA  58           HB3      ALA  58  62.504   2.446   5.441
  505    H    ARG  59           HN       ARG  59  62.975   2.828   8.686
  506    HA   ARG  59           HA       ARG  59  61.238   5.188   8.939
  507    HB2  ARG  59           HB1      ARG  59  62.747   3.661  11.134
  508    HB3  ARG  59           HB2      ARG  59  62.073   5.286  11.402
  509    HG2  ARG  59           HG1      ARG  59  59.753   4.384  11.001
  510    HG3  ARG  59           HG2      ARG  59  60.411   2.792  10.580
  511    HD2  ARG  59           HD1      ARG  59  61.386   2.478  12.853
  512    HD3  ARG  59           HD2      ARG  59  60.715   4.073  13.392
  513    HE   ARG  59           HE       ARG  59  58.627   2.577  12.173
  514   HH11  ARG  59          HH11      ARG  59  57.462   1.210  15.335
  515   HH12  ARG  59          HH12      ARG  59  57.064   1.565  13.671
  516   HH21  ARG  59          HH21      ARG  59  59.638   1.854  16.117
  517   HH22  ARG  59          HH22      ARG  59  60.723   2.599  14.993
  518    H    LYS  60           HN       LYS  60  62.261   7.036   8.468
  519    HA   LYS  60           HA       LYS  60  65.055   7.307   8.399
  520    HB2  LYS  60           HB1      LYS  60  64.657   9.723   8.208
  521    HB3  LYS  60           HB2      LYS  60  63.676   8.793   7.045
  522    HG2  LYS  60           HG1      LYS  60  62.516   9.830   9.704
  523    HG3  LYS  60           HG2      LYS  60  62.622  10.862   8.240
  524    HD2  LYS  60           HD1      LYS  60  61.287   8.947   7.044
  525    HD3  LYS  60           HD2      LYS  60  60.984   8.306   8.694
  526    HE2  LYS  60           HE1      LYS  60  59.825  10.388   9.373
  527    HE3  LYS  60           HE2      LYS  60  60.282  11.203   7.830
  528    HZ1  LYS  60           HZ1      LYS  60  58.029  10.347   7.767
  529    HZ2  LYS  60           HZ2      LYS  60  59.002   9.536   6.636
  530    HZ3  LYS  60           HZ3      LYS  60  58.575   8.772   8.088
  531    H    LEU  61           HN       LEU  61  62.703   7.598  10.968
  532    HA   LEU  61           HA       LEU  61  64.140   9.032  12.847
  533    HB2  LEU  61           HB1      LEU  61  61.701   8.695  12.865
  534    HB3  LEU  61           HB2      LEU  61  61.896   6.939  13.070
  535    HG   LEU  61           HG       LEU  61  63.061   8.816  15.159
  536   HD11  LEU  61          HD11      LEU  61  60.763   8.809  16.343
  537   HD12  LEU  61          HD12      LEU  61  60.747   9.718  14.789
  538   HD13  LEU  61          HD13      LEU  61  60.046   8.059  14.872
  539   HD21  LEU  61          HD21      LEU  61  62.367   7.013  16.768
  540   HD22  LEU  61          HD22      LEU  61  61.660   6.057  15.427
  541   HD23  LEU  61          HD23      LEU  61  63.431   6.369  15.466
  542    H    GLU  62           HN       GLU  62  64.250   5.496  12.065
  543    HA   GLU  62           HA       GLU  62  65.116   4.658  14.552
  544    HB2  GLU  62           HB1      GLU  62  64.059   3.192  12.855
  545    HB3  GLU  62           HB2      GLU  62  65.449   3.392  11.764
  546    HG2  GLU  62           HG1      GLU  62  65.573   1.191  12.819
  547    HG3  GLU  62           HG2      GLU  62  66.910   2.175  13.524
  Start of MODEL    5
    1    H1   ALA   1           HT1      ALA   1  40.016  12.636   7.450
    2    H2   ALA   1           HT2      ALA   1  40.711  11.826   6.130
    3    H3   ALA   1           HT3      ALA   1  41.666  12.242   7.472
    4    HA   ALA   1           HA       ALA   1  40.428  10.737   8.881
    5    HB1  ALA   1           HB1      ALA   1  38.272  11.079   7.681
    6    HB2  ALA   1           HB2      ALA   1  38.881  10.114   6.292
    7    HB3  ALA   1           HB3      ALA   1  38.608   9.325   7.892
    8    H    SER   2           HN       SER   2  41.196   9.728   5.434
    9    HA   SER   2           HA       SER   2  42.255   7.269   6.436
   10    HB2  SER   2           HB1      SER   2  40.922   7.410   4.275
   11    HB3  SER   2           HB2      SER   2  42.209   8.424   3.552
   12    HG   SER   2           HG       SER   2  42.238   6.078   3.108
   13    H    MET   3           HN       MET   3  43.511  10.356   6.153
   14    HA   MET   3           HA       MET   3  45.419  11.201   6.738
   15    HB2  MET   3           HB1      MET   3  46.390   8.342   7.046
   16    HB3  MET   3           HB2      MET   3  47.404   9.749   7.455
   17    HG2  MET   3           HG1      MET   3  45.631  10.478   9.168
   18    HG3  MET   3           HG2      MET   3  44.648   9.045   8.724
   19    HE1  MET   3           HE1      MET   3  45.577   8.094  12.245
   20    HE2  MET   3           HE2      MET   3  45.100   9.684  11.558
   21    HE3  MET   3           HE3      MET   3  44.326   8.177  10.958
   22    H    VAL   4           HN       VAL   4  45.044   9.695   3.813
   23    HA   VAL   4           HA       VAL   4  47.628   9.571   2.743
   24    HB   VAL   4           HB       VAL   4  44.905   9.831   1.436
   25   HG11  VAL   4          HG11      VAL   4  46.066   8.944  -0.646
   26   HG12  VAL   4          HG12      VAL   4  46.662  10.571  -0.197
   27   HG13  VAL   4          HG13      VAL   4  47.656   9.113   0.177
   28   HG21  VAL   4          HG21      VAL   4  45.261   7.317   1.073
   29   HG22  VAL   4          HG22      VAL   4  46.783   7.420   2.031
   30   HG23  VAL   4          HG23      VAL   4  45.193   7.752   2.809
   31    H    LEU   5           HN       LEU   5  45.211  12.167   2.847
   32    HA   LEU   5           HA       LEU   5  46.363  13.905   1.013
   33    HB2  LEU   5           HB1      LEU   5  44.471  14.346   3.388
   34    HB3  LEU   5           HB2      LEU   5  44.844  15.635   2.221
   35    HG   LEU   5           HG       LEU   5  44.036  13.844   0.422
   36   HD11  LEU   5          HD11      LEU   5  42.068  12.428   1.294
   37   HD12  LEU   5          HD12      LEU   5  43.653  11.889   1.961
   38   HD13  LEU   5          HD13      LEU   5  42.530  12.867   2.976
   39   HD21  LEU   5          HD21      LEU   5  41.679  14.748   0.617
   40   HD22  LEU   5          HD22      LEU   5  42.054  15.380   2.252
   41   HD23  LEU   5          HD23      LEU   5  42.934  16.023   0.819
   42    H    SER   6           HN       SER   6  46.736  13.625   4.547
   43    HA   SER   6           HA       SER   6  48.458  15.793   4.926
   44    HB2  SER   6           HB1      SER   6  48.089  13.122   6.443
   45    HB3  SER   6           HB2      SER   6  49.058  14.474   7.108
   46    HG   SER   6           HG       SER   6  46.751  14.306   7.765
   47    HA   PRO   7           HA       PRO   7  52.187  14.516   3.220
   48    HB2  PRO   7           HB2      PRO   7  54.271  15.153   4.859
   49    HB3  PRO   7           HB1      PRO   7  53.163  16.385   4.134
   50    HG2  PRO   7           HG2      PRO   7  52.863  15.258   6.933
   51    HG3  PRO   7           HG1      PRO   7  52.910  16.993   6.410
   52    HD2  PRO   7           HD2      PRO   7  50.512  15.635   6.669
   53    HD3  PRO   7           HD1      PRO   7  50.777  16.951   5.426
   54    H    ARG   8           HN       ARG   8  51.387  12.726   6.135
   55    HA   ARG   8           HA       ARG   8  53.494  10.778   5.782
   56    HB2  ARG   8           HB1      ARG   8  50.933  10.835   7.464
   57    HB3  ARG   8           HB2      ARG   8  52.098   9.492   7.550
   58    HG2  ARG   8           HG1      ARG   8  53.879  11.249   8.269
   59    HG3  ARG   8           HG2      ARG   8  52.590  12.466   8.312
   60    HD2  ARG   8           HD1      ARG   8  52.325   9.868   9.949
   61    HD3  ARG   8           HD2      ARG   8  53.097  11.357  10.634
   62    HE   ARG   8           HE       ARG   8  50.999  12.577  10.048
   63   HH11  ARG   8          HH11      ARG   8  49.216   8.984  11.020
   64   HH12  ARG   8          HH12      ARG   8  50.852   9.066  10.416
   65   HH21  ARG   8          HH21      ARG   8  48.014  11.012  11.270
   66   HH22  ARG   8          HH22      ARG   8  48.809  12.500  10.888
   67    H    ASP   9           HN       ASP   9  52.172  11.017   3.267
   68    HA   ASP   9           HA       ASP   9  50.091   9.190   2.995
   69    HB2  ASP   9           HB1      ASP   9  50.494   9.471   0.530
   70    HB3  ASP   9           HB2      ASP   9  50.320  11.035   1.398
   71    H    GLU  10           HN       GLU  10  53.629   8.827   2.658
   72    HA   GLU  10           HA       GLU  10  53.731   6.258   1.619
   73    HB2  GLU  10           HB1      GLU  10  55.644   7.863   1.705
   74    HB3  GLU  10           HB2      GLU  10  55.672   7.765   3.480
   75    HG2  GLU  10           HG1      GLU  10  56.307   5.333   3.357
   76    HG3  GLU  10           HG2      GLU  10  56.227   5.376   1.556
   77    H    ARG  11           HN       ARG  11  53.437   7.381   5.007
   78    HA   ARG  11           HA       ARG  11  53.856   4.908   6.269
   79    HB2  ARG  11           HB1      ARG  11  53.852   7.135   7.424
   80    HB3  ARG  11           HB2      ARG  11  52.118   7.345   7.082
   81    HG2  ARG  11           HG1      ARG  11  51.908   5.026   8.467
   82    HG3  ARG  11           HG2      ARG  11  53.522   5.452   9.066
   83    HD2  ARG  11           HD1      ARG  11  52.826   7.534  10.064
   84    HD3  ARG  11           HD2      ARG  11  51.210   7.512   9.246
   85    HE   ARG  11           HE       ARG  11  51.990   6.075  11.645
   86   HH11  ARG  11          HH11      ARG  11  48.867   4.263  11.732
   87   HH12  ARG  11          HH12      ARG  11  50.404   4.547  12.510
   88   HH21  ARG  11          HH21      ARG  11  48.473   5.289   9.629
   89   HH22  ARG  11          HH22      ARG  11  49.699   6.311   8.961
   90    H    THR  12           HN       THR  12  50.700   6.444   5.212
   91    HA   THR  12           HA       THR  12  49.161   4.271   6.049
   92    HB   THR  12           HB       THR  12  48.686   6.327   3.865
   93    HG1  THR  12           HG1      THR  12  47.333   7.228   5.480
   94   HG21  THR  12          HG21      THR  12  46.211   5.721   4.075
   95   HG22  THR  12          HG22      THR  12  47.122   4.214   3.718
   96   HG23  THR  12          HG23      THR  12  46.574   4.556   5.398
   97    H    LEU  13           HN       LEU  13  50.738   4.968   2.865
   98    HA   LEU  13           HA       LEU  13  49.537   2.867   1.531
   99    HB2  LEU  13           HB1      LEU  13  50.560   4.833   0.474
  100    HB3  LEU  13           HB2      LEU  13  52.165   4.410   1.117
  101    HG   LEU  13           HG       LEU  13  50.748   2.413  -0.681
  102   HD11  LEU  13          HD11      LEU  13  51.667   3.679  -2.727
  103   HD12  LEU  13          HD12      LEU  13  50.375   4.588  -1.862
  104   HD13  LEU  13          HD13      LEU  13  52.104   5.048  -1.644
  105   HD21  LEU  13          HD21      LEU  13  53.065   2.003  -1.562
  106   HD22  LEU  13          HD22      LEU  13  53.722   3.292  -0.504
  107   HD23  LEU  13          HD23      LEU  13  52.995   1.817   0.228
  108    H    VAL  14           HN       VAL  14  52.798   2.908   3.270
  109    HA   VAL  14           HA       VAL  14  53.294   0.214   2.639
  110    HB   VAL  14           HB       VAL  14  55.026   1.867   3.143
  111   HG11  VAL  14          HG11      VAL  14  55.670   2.202   5.560
  112   HG12  VAL  14          HG12      VAL  14  54.110   2.990   5.175
  113   HG13  VAL  14          HG13      VAL  14  54.133   1.428   6.077
  114   HG21  VAL  14          HG21      VAL  14  56.463   0.186   4.353
  115   HG22  VAL  14          HG22      VAL  14  54.990  -0.800   4.678
  116   HG23  VAL  14          HG23      VAL  14  55.538  -0.513   2.987
  117    H    ARG  15           HN       ARG  15  51.620   1.756   5.448
  118    HA   ARG  15           HA       ARG  15  51.374  -0.581   6.990
  119    HB2  ARG  15           HB1      ARG  15  50.930   1.732   7.810
  120    HB3  ARG  15           HB2      ARG  15  49.525   1.884   6.728
  121    HG2  ARG  15           HG1      ARG  15  48.465  -0.098   8.022
  122    HG3  ARG  15           HG2      ARG  15  49.844  -0.049   9.134
  123    HD2  ARG  15           HD1      ARG  15  49.356   2.488   9.523
  124    HD3  ARG  15           HD2      ARG  15  47.737   2.195   8.766
  125    HE   ARG  15           HE       ARG  15  47.053   0.996  10.567
  126   HH11  ARG  15          HH11      ARG  15  50.760   0.889  12.397
  127   HH12  ARG  15          HH12      ARG  15  50.556   1.386  10.736
  128   HH21  ARG  15          HH21      ARG  15  48.817   0.222  13.608
  129   HH22  ARG  15          HH22      ARG  15  47.283   0.295  12.811
  130    H    LYS  16           HN       LYS  16  49.248   0.706   4.368
  131    HA   LYS  16           HA       LYS  16  47.097  -0.960   4.949
  132    HB2  LYS  16           HB1      LYS  16  47.022   1.181   3.634
  133    HB3  LYS  16           HB2      LYS  16  47.929   0.408   2.309
  134    HG2  LYS  16           HG1      LYS  16  45.570   0.468   1.673
  135    HG3  LYS  16           HG2      LYS  16  45.979  -1.243   2.030
  136    HD2  LYS  16           HD1      LYS  16  44.991  -1.016   4.323
  137    HD3  LYS  16           HD2      LYS  16  44.696   0.735   4.044
  138    HE2  LYS  16           HE1      LYS  16  43.320  -1.535   2.465
  139    HE3  LYS  16           HE2      LYS  16  42.604  -0.661   3.873
  140    HZ1  LYS  16           HZ1      LYS  16  41.892   0.261   1.778
  141    HZ2  LYS  16           HZ2      LYS  16  42.822   1.394   2.635
  142    HZ3  LYS  16           HZ3      LYS  16  43.495   0.571   1.315
  143    H    VAL  17           HN       VAL  17  49.803  -1.383   2.582
  144    HA   VAL  17           HA       VAL  17  48.811  -3.767   1.498
  145    HB   VAL  17           HB       VAL  17  51.014  -4.078   0.510
  146   HG11  VAL  17          HG11      VAL  17  50.889  -1.900  -0.852
  147   HG12  VAL  17          HG12      VAL  17  49.273  -2.631  -0.612
  148   HG13  VAL  17          HG13      VAL  17  49.779  -1.213   0.384
  149   HG21  VAL  17          HG21      VAL  17  52.756  -2.271   0.766
  150   HG22  VAL  17          HG22      VAL  17  51.798  -1.555   2.113
  151   HG23  VAL  17          HG23      VAL  17  52.508  -3.202   2.277
  152    H    GLN  18           HN       GLN  18  51.037  -3.172   4.324
  153    HA   GLN  18           HA       GLN  18  51.602  -5.881   4.701
  154    HB2  GLN  18           HB1      GLN  18  51.586  -3.458   6.548
  155    HB3  GLN  18           HB2      GLN  18  52.123  -5.057   7.121
  156    HG2  GLN  18           HG1      GLN  18  53.946  -5.087   5.313
  157    HG3  GLN  18           HG2      GLN  18  53.371  -3.500   4.703
  158   HE21  GLN  18          HE21      GLN  18  54.616  -1.784   7.710
  159   HE22  GLN  18          HE22      GLN  18  53.139  -1.853   6.772
  160    H    ILE  19           HN       ILE  19  48.933  -3.789   6.116
  161    HA   ILE  19           HA       ILE  19  47.875  -5.876   7.650
  162    HB   ILE  19           HB       ILE  19  46.726  -3.330   6.517
  163   HG12  ILE  19          HG11      ILE  19  48.464  -2.887   8.160
  164   HG13  ILE  19          HG12      ILE  19  46.870  -2.455   8.857
  165   HG21  ILE  19          HG21      ILE  19  44.735  -3.636   8.074
  166   HG22  ILE  19          HG22      ILE  19  44.860  -5.091   7.036
  167   HG23  ILE  19          HG23      ILE  19  45.441  -5.151   8.740
  168   HD11  ILE  19          HD11      ILE  19  48.268  -3.529  10.563
  169   HD12  ILE  19          HD12      ILE  19  46.870  -4.599  10.182
  170   HD13  ILE  19          HD13      ILE  19  48.508  -4.982   9.532
  171    H    ASN  20           HN       ASN  20  47.041  -4.766   4.258
  172    HA   ASN  20           HA       ASN  20  45.549  -7.264   4.047
  173    HB2  ASN  20           HB1      ASN  20  45.154  -4.544   2.645
  174    HB3  ASN  20           HB2      ASN  20  44.327  -6.023   2.064
  175   HD21  ASN  20          HD21      ASN  20  42.336  -3.894   4.671
  176   HD22  ASN  20          HD22      ASN  20  43.326  -3.376   3.328
  177    HA   PRO  21           HA       PRO  21  49.154  -7.616   1.177
  178    HB2  PRO  21           HB2      PRO  21  49.596 -10.310   1.406
  179    HB3  PRO  21           HB1      PRO  21  50.087  -9.146   2.701
  180    HG2  PRO  21           HG2      PRO  21  47.512 -10.765   2.702
  181    HG3  PRO  21           HG1      PRO  21  48.755 -10.621   4.016
  182    HD2  PRO  21           HD2      PRO  21  46.509  -8.997   3.917
  183    HD3  PRO  21           HD1      PRO  21  48.113  -8.411   4.575
  184    H    ARG  22           HN       ARG  22  46.009  -8.817   1.224
  185    HA   ARG  22           HA       ARG  22  45.879 -10.406  -1.148
  186    HB2  ARG  22           HB2      ARG  22  43.767  -8.838   0.496
  187    HB3  ARG  22           HB1      ARG  22  43.340  -9.868  -0.855
  188    HG2  ARG  22           HG2      ARG  22  44.328 -11.886   0.388
  189    HG3  ARG  22           HG1      ARG  22  44.800 -10.821   1.717
  190    HD2  ARG  22           HD2      ARG  22  42.343 -10.207   2.061
  191    HD3  ARG  22           HD1      ARG  22  41.900 -11.297   0.725
  192    HE   ARG  22           HE       ARG  22  43.497 -12.875   2.593
  193   HH11  ARG  22          HH11      ARG  22  40.409 -11.299   2.600
  194   HH12  ARG  22          HH12      ARG  22  39.736 -12.460   3.843
  195   HH21  ARG  22          HH21      ARG  22  42.713 -14.167   3.990
  196   HH22  ARG  22          HH22      ARG  22  41.000 -13.999   4.579
  197    H    THR  23           HN       THR  23  45.987  -6.900  -0.607
  198    HA   THR  23           HA       THR  23  44.611  -6.259  -3.002
  199    HB   THR  23           HB       THR  23  45.335  -3.925  -2.560
  200    HG1  THR  23           HG1      THR  23  46.269  -3.491  -0.542
  201   HG21  THR  23          HG21      THR  23  43.923  -3.656  -0.457
  202   HG22  THR  23          HG22      THR  23  43.211  -4.946  -1.483
  203   HG23  THR  23          HG23      THR  23  44.180  -5.387  -0.032
  204    H    THR  24           HN       THR  24  45.558  -4.764  -4.740
  205    HA   THR  24           HA       THR  24  48.301  -5.579  -5.325
  206    HB   THR  24           HB       THR  24  47.783  -5.624  -7.717
  207    HG1  THR  24           HG1      THR  24  45.612  -5.682  -8.378
  208   HG21  THR  24          HG21      THR  24  46.434  -7.797  -7.743
  209   HG22  THR  24          HG22      THR  24  47.501  -7.794  -6.298
  210   HG23  THR  24          HG23      THR  24  45.748  -7.419  -6.122
  211    H    ALA  25           HN       ALA  25  49.210  -4.106  -7.192
  212    HA   ALA  25           HA       ALA  25  49.395  -1.497  -6.215
  213    HB1  ALA  25           HB1      ALA  25  51.139  -2.641  -7.579
  214    HB2  ALA  25           HB2      ALA  25  50.057  -2.592  -9.013
  215    HB3  ALA  25           HB3      ALA  25  50.688  -1.058  -8.303
  216    H    LYS  26           HN       LYS  26  47.144  -2.807  -8.690
  217    HA   LYS  26           HA       LYS  26  46.311  -0.358  -9.691
  218    HB2  LYS  26           HB1      LYS  26  44.947  -3.066  -9.489
  219    HB3  LYS  26           HB2      LYS  26  44.168  -1.686 -10.306
  220    HG2  LYS  26           HG1      LYS  26  46.269  -1.498 -11.815
  221    HG3  LYS  26           HG2      LYS  26  46.916  -2.971 -11.020
  222    HD2  LYS  26           HD1      LYS  26  44.925  -4.271 -11.830
  223    HD3  LYS  26           HD2      LYS  26  44.251  -2.782 -12.576
  224    HE2  LYS  26           HE1      LYS  26  46.942  -4.086 -13.392
  225    HE3  LYS  26           HE2      LYS  26  45.379  -4.290 -14.272
  226    HZ1  LYS  26           HZ1      LYS  26  46.746  -2.575 -15.243
  227    HZ2  LYS  26           HZ2      LYS  26  45.321  -1.905 -14.607
  228    HZ3  LYS  26           HZ3      LYS  26  46.790  -1.716 -13.780
  229    H    ASP  27           HN       ASP  27  45.267  -2.005  -6.597
  230    HA   ASP  27           HA       ASP  27  43.101  -0.304  -6.177
  231    HB2  ASP  27           HB1      ASP  27  45.081  -1.752  -4.283
  232    HB3  ASP  27           HB2      ASP  27  43.607  -0.920  -3.679
  233    H    LEU  28           HN       LEU  28  46.591   0.032  -5.441
  234    HA   LEU  28           HA       LEU  28  46.391   2.401  -3.994
  235    HB2  LEU  28           HB1      LEU  28  48.676   0.989  -5.417
  236    HB3  LEU  28           HB2      LEU  28  48.940   2.566  -4.639
  237    HG   LEU  28           HG       LEU  28  48.145   1.594  -2.468
  238   HD11  LEU  28          HD11      LEU  28  48.193  -0.961  -2.166
  239   HD12  LEU  28          HD12      LEU  28  46.823  -0.418  -3.204
  240   HD13  LEU  28          HD13      LEU  28  48.292  -1.145  -3.954
  241   HD21  LEU  28          HD21      LEU  28  50.255   0.264  -2.016
  242   HD22  LEU  28          HD22      LEU  28  50.569   0.177  -3.779
  243   HD23  LEU  28          HD23      LEU  28  50.552   1.775  -2.950
  244    H    VAL  29           HN       VAL  29  46.888   1.862  -7.613
  245    HA   VAL  29           HA       VAL  29  47.745   4.490  -8.050
  246    HB   VAL  29           HB       VAL  29  47.316   4.207 -10.399
  247   HG11  VAL  29          HG11      VAL  29  48.801   2.145 -10.722
  248   HG12  VAL  29          HG12      VAL  29  49.423   3.219  -9.434
  249   HG13  VAL  29          HG13      VAL  29  48.541   1.706  -8.998
  250   HG21  VAL  29          HG21      VAL  29  46.430   2.107 -11.373
  251   HG22  VAL  29          HG22      VAL  29  45.881   1.592  -9.737
  252   HG23  VAL  29          HG23      VAL  29  45.194   3.068 -10.504
  253    H    LYS  30           HN       LYS  30  44.406   3.044  -8.079
  254    HA   LYS  30           HA       LYS  30  43.108   5.369  -8.920
  255    HB2  LYS  30           HB1      LYS  30  42.057   3.106  -8.879
  256    HB3  LYS  30           HB2      LYS  30  42.131   3.084  -7.098
  257    HG2  LYS  30           HG1      LYS  30  40.591   5.128  -7.041
  258    HG3  LYS  30           HG2      LYS  30  40.536   5.117  -8.835
  259    HD2  LYS  30           HD1      LYS  30  39.521   2.777  -8.706
  260    HD3  LYS  30           HD2      LYS  30  39.493   2.940  -6.917
  261    HE2  LYS  30           HE1      LYS  30  38.060   5.070  -7.192
  262    HE3  LYS  30           HE2      LYS  30  37.975   4.723  -8.961
  263    HZ1  LYS  30           HZ1      LYS  30  36.077   3.845  -7.775
  264    HZ2  LYS  30           HZ2      LYS  30  36.998   2.580  -8.436
  265    HZ3  LYS  30           HZ3      LYS  30  37.080   2.909  -6.775
  266    H    MET  31           HN       MET  31  43.971   4.220  -5.599
  267    HA   MET  31           HA       MET  31  42.681   6.219  -4.199
  268    HB2  MET  31           HB1      MET  31  43.418   4.082  -3.253
  269    HB3  MET  31           HB2      MET  31  45.127   4.424  -3.630
  270    HG2  MET  31           HG1      MET  31  43.633   6.296  -1.703
  271    HG3  MET  31           HG2      MET  31  44.130   4.670  -1.133
  272    HE1  MET  31           HE1      MET  31  48.007   4.738  -1.265
  273    HE2  MET  31           HE2      MET  31  46.533   3.857  -0.740
  274    HE3  MET  31           HE3      MET  31  46.878   4.067  -2.490
  275    H    LEU  32           HN       LEU  32  46.111   6.110  -5.341
  276    HA   LEU  32           HA       LEU  32  46.829   8.585  -4.289
  277    HB2  LEU  32           HB1      LEU  32  47.873   6.768  -6.504
  278    HB3  LEU  32           HB2      LEU  32  48.732   8.265  -6.069
  279    HG   LEU  32           HG       LEU  32  47.904   6.213  -3.947
  280   HD11  LEU  32          HD11      LEU  32  50.241   5.138  -4.153
  281   HD12  LEU  32          HD12      LEU  32  49.198   4.871  -5.597
  282   HD13  LEU  32          HD13      LEU  32  50.508   6.107  -5.646
  283   HD21  LEU  32          HD21      LEU  32  49.918   7.041  -2.673
  284   HD22  LEU  32          HD22      LEU  32  50.286   8.197  -3.992
  285   HD23  LEU  32          HD23      LEU  32  48.755   8.359  -3.061
  286    H    GLU  33           HN       GLU  33  45.574   7.709  -7.633
  287    HA   GLU  33           HA       GLU  33  45.650  10.322  -8.594
  288    HB2  GLU  33           HB1      GLU  33  45.441   8.299 -10.019
  289    HB3  GLU  33           HB2      GLU  33  43.845   7.938  -9.325
  290    HG2  GLU  33           HG1      GLU  33  42.901  10.037 -10.331
  291    HG3  GLU  33           HG2      GLU  33  44.522  10.492 -10.981
  292    H    GLU  34           HN       GLU  34  42.975   8.574  -6.851
  293    HA   GLU  34           HA       GLU  34  41.019  10.527  -7.183
  294    HB2  GLU  34           HB1      GLU  34  40.592   8.139  -6.552
  295    HB3  GLU  34           HB2      GLU  34  41.390   8.393  -4.984
  296    HG2  GLU  34           HG1      GLU  34  39.580  10.022  -4.321
  297    HG3  GLU  34           HG2      GLU  34  38.763   9.783  -5.913
  298    H    THR  35           HN       THR  35  43.429  10.058  -4.515
  299    HA   THR  35           HA       THR  35  42.430  12.307  -3.111
  300    HB   THR  35           HB       THR  35  44.474  12.071  -1.702
  301    HG1  THR  35           HG1      THR  35  45.619  10.124  -1.948
  302   HG21  THR  35          HG21      THR  35  43.673   9.908  -0.624
  303   HG22  THR  35          HG22      THR  35  42.249  10.830  -1.216
  304   HG23  THR  35          HG23      THR  35  42.857   9.417  -2.152
  305    H    GLY  36           HN       GLY  36  44.511  12.070  -5.854
  306    HA2  GLY  36           HA2      GLY  36  45.246  13.757  -7.079
  307    HA3  GLY  36           HA1      GLY  36  44.748  14.900  -5.758
  308    H    THR  37           HN       THR  37  47.135  12.177  -5.449
  309    HA   THR  37           HA       THR  37  49.089  14.266  -4.846
  310    HB   THR  37           HB       THR  37  48.485  12.939  -2.881
  311    HG1  THR  37           HG1      THR  37  50.581  12.184  -2.389
  312   HG21  THR  37          HG21      THR  37  48.998  10.473  -2.769
  313   HG22  THR  37          HG22      THR  37  47.868  10.778  -4.131
  314   HG23  THR  37          HG23      THR  37  49.614  10.489  -4.460
  315    H    LYS  38           HN       LYS  38  51.265  14.067  -5.633
  316    HA   LYS  38           HA       LYS  38  51.404  12.384  -8.015
  317    HB2  LYS  38           HB1      LYS  38  51.817  14.872  -8.202
  318    HB3  LYS  38           HB2      LYS  38  53.135  14.743  -7.010
  319    HG2  LYS  38           HG1      LYS  38  54.393  13.218  -8.634
  320    HG3  LYS  38           HG2      LYS  38  53.055  13.414  -9.815
  321    HD2  LYS  38           HD1      LYS  38  54.746  15.745  -8.702
  322    HD3  LYS  38           HD2      LYS  38  55.162  14.829 -10.191
  323    HE2  LYS  38           HE1      LYS  38  54.095  16.731 -11.075
  324    HE3  LYS  38           HE2      LYS  38  52.720  15.563 -11.003
  325    HZ1  LYS  38           HZ1      LYS  38  52.129  17.708 -10.130
  326    HZ2  LYS  38           HZ2      LYS  38  52.074  16.537  -8.901
  327    HZ3  LYS  38           HZ3      LYS  38  53.366  17.633  -8.971
  328    H    VAL  39           HN       VAL  39  52.082  10.346  -7.486
  329    HA   VAL  39           HA       VAL  39  54.547  10.107  -5.917
  330    HB   VAL  39           HB       VAL  39  52.052   8.375  -5.677
  331   HG11  VAL  39          HG11      VAL  39  53.385   7.169  -3.879
  332   HG12  VAL  39          HG12      VAL  39  54.130   6.983  -5.495
  333   HG13  VAL  39          HG13      VAL  39  54.833   8.147  -4.307
  334   HG21  VAL  39          HG21      VAL  39  52.128   9.212  -3.235
  335   HG22  VAL  39          HG22      VAL  39  53.504  10.290  -3.674
  336   HG23  VAL  39          HG23      VAL  39  51.873  10.557  -4.391
  337    H    SER  40           HN       SER  40  56.118   8.779  -6.952
  338    HA   SER  40           HA       SER  40  55.489   7.841  -9.522
  339    HB2  SER  40           HB1      SER  40  57.798   8.574  -8.927
  340    HB3  SER  40           HB2      SER  40  57.927   7.293  -7.681
  341    HG   SER  40           HG       SER  40  58.924   6.897  -9.813
  342    H    ILE  41           HN       ILE  41  54.820   5.913 -10.289
  343    HA   ILE  41           HA       ILE  41  53.681   4.039  -8.564
  344    HB   ILE  41           HB       ILE  41  54.278   4.038 -11.514
  345   HG12  ILE  41          HG11      ILE  41  52.745   5.813 -11.009
  346   HG13  ILE  41          HG12      ILE  41  51.777   4.491 -11.735
  347   HG21  ILE  41          HG21      ILE  41  52.633   2.101 -11.722
  348   HG22  ILE  41          HG22      ILE  41  53.902   1.627 -10.549
  349   HG23  ILE  41          HG23      ILE  41  52.285   2.159  -9.958
  350   HD11  ILE  41          HD11      ILE  41  50.549   5.490  -9.853
  351   HD12  ILE  41          HD12      ILE  41  51.001   3.797  -9.435
  352   HD13  ILE  41          HD13      ILE  41  51.915   5.180  -8.727
  353    H    SER  42           HN       SER  42  56.781   4.013 -10.404
  354    HA   SER  42           HA       SER  42  57.423   1.356  -9.934
  355    HB2  SER  42           HB1      SER  42  58.552   2.796 -11.648
  356    HB3  SER  42           HB2      SER  42  59.229   3.849 -10.366
  357    HG   SER  42           HG       SER  42  60.631   2.154 -11.291
  358    H    THR  43           HN       THR  43  58.149   4.312  -7.962
  359    HA   THR  43           HA       THR  43  59.613   3.002  -5.990
  360    HB   THR  43           HB       THR  43  57.794   5.444  -5.829
  361    HG1  THR  43           HG1      THR  43  59.779   6.566  -5.998
  362   HG21  THR  43          HG21      THR  43  59.152   6.125  -3.787
  363   HG22  THR  43          HG22      THR  43  58.503   4.474  -3.503
  364   HG23  THR  43          HG23      THR  43  60.226   4.693  -3.979
  365    H    VAL  44           HN       VAL  44  56.048   3.610  -6.229
  366    HA   VAL  44           HA       VAL  44  55.378   2.505  -3.770
  367    HB   VAL  44           HB       VAL  44  53.889   2.833  -6.391
  368   HG11  VAL  44          HG11      VAL  44  51.758   2.419  -5.091
  369   HG12  VAL  44          HG12      VAL  44  52.765   0.944  -5.200
  370   HG13  VAL  44          HG13      VAL  44  52.728   1.900  -3.669
  371   HG21  VAL  44          HG21      VAL  44  52.771   4.692  -4.987
  372   HG22  VAL  44          HG22      VAL  44  53.860   4.268  -3.615
  373   HG23  VAL  44          HG23      VAL  44  54.540   4.934  -5.143
  374    H    LYS  45           HN       LYS  45  55.606   0.891  -7.026
  375    HA   LYS  45           HA       LYS  45  54.809  -1.616  -6.127
  376    HB2  LYS  45           HB1      LYS  45  54.802  -0.918  -8.473
  377    HB3  LYS  45           HB2      LYS  45  56.577  -0.760  -8.478
  378    HG2  LYS  45           HG1      LYS  45  56.844  -3.218  -8.199
  379    HG3  LYS  45           HG2      LYS  45  55.083  -3.421  -7.920
  380    HD2  LYS  45           HD1      LYS  45  56.175  -2.204 -10.528
  381    HD3  LYS  45           HD2      LYS  45  56.136  -3.983 -10.284
  382    HE2  LYS  45           HE1      LYS  45  53.638  -3.887  -9.903
  383    HE3  LYS  45           HE2      LYS  45  53.671  -2.099 -10.152
  384    HZ1  LYS  45           HZ1      LYS  45  53.080  -3.282 -12.168
  385    HZ2  LYS  45           HZ2      LYS  45  54.563  -2.481 -12.367
  386    HZ3  LYS  45           HZ3      LYS  45  54.532  -4.159 -12.130
  387    H    ARG  46           HN       ARG  46  58.088  -0.149  -6.259
  388    HA   ARG  46           HA       ARG  46  59.549  -2.420  -5.517
  389    HB2  ARG  46           HB1      ARG  46  60.523  -0.349  -6.465
  390    HB3  ARG  46           HB2      ARG  46  60.149   0.546  -4.973
  391    HG2  ARG  46           HG1      ARG  46  61.666  -1.122  -3.703
  392    HG3  ARG  46           HG2      ARG  46  62.056  -1.902  -5.246
  393    HD2  ARG  46           HD1      ARG  46  62.889   0.377  -6.147
  394    HD3  ARG  46           HD2      ARG  46  62.844   0.982  -4.440
  395    HE   ARG  46           HE       ARG  46  64.707  -0.948  -5.588
  396   HH11  ARG  46          HH11      ARG  46  66.363  -1.409  -2.437
  397   HH12  ARG  46          HH12      ARG  46  66.357  -1.757  -4.148
  398   HH21  ARG  46          HH21      ARG  46  64.532  -0.168  -1.546
  399   HH22  ARG  46          HH22      ARG  46  63.296   0.372  -2.629
  400    H    VAL  47           HN       VAL  47  57.846  -0.018  -3.385
  401    HA   VAL  47           HA       VAL  47  59.015  -0.793  -0.997
  402    HB   VAL  47           HB       VAL  47  56.338   0.459  -1.644
  403   HG11  VAL  47          HG11      VAL  47  56.201   1.109   0.802
  404   HG12  VAL  47          HG12      VAL  47  56.054  -0.660   0.579
  405   HG13  VAL  47          HG13      VAL  47  57.608   0.048   1.162
  406   HG21  VAL  47          HG21      VAL  47  57.578   2.510  -0.675
  407   HG22  VAL  47          HG22      VAL  47  59.048   1.489  -0.464
  408   HG23  VAL  47          HG23      VAL  47  58.415   1.844  -2.112
  409    H    LEU  48           HN       LEU  48  55.981  -2.189  -2.587
  410    HA   LEU  48           HA       LEU  48  55.411  -3.888  -0.465
  411    HB2  LEU  48           HB1      LEU  48  54.855  -4.086  -3.467
  412    HB3  LEU  48           HB2      LEU  48  54.343  -5.385  -2.367
  413    HG   LEU  48           HG       LEU  48  53.053  -3.595  -1.065
  414   HD11  LEU  48          HD11      LEU  48  52.269  -1.564  -2.425
  415   HD12  LEU  48          HD12      LEU  48  54.017  -1.489  -1.996
  416   HD13  LEU  48          HD13      LEU  48  53.516  -1.949  -3.665
  417   HD21  LEU  48          HD21      LEU  48  51.099  -3.718  -2.681
  418   HD22  LEU  48          HD22      LEU  48  52.206  -4.295  -3.967
  419   HD23  LEU  48          HD23      LEU  48  51.959  -5.288  -2.486
  420    H    TYR  49           HN       TYR  49  57.495  -4.490  -3.427
  421    HA   TYR  49           HA       TYR  49  58.187  -7.060  -2.647
  422    HB2  TYR  49           HB1      TYR  49  59.448  -4.993  -4.490
  423    HB3  TYR  49           HB2      TYR  49  60.375  -6.472  -4.096
  424    HD1  TYR  49           HD1      TYR  49  57.370  -5.097  -5.856
  425    HD2  TYR  49           HD2      TYR  49  59.435  -8.686  -4.696
  426    HE1  TYR  49           HE1      TYR  49  56.028  -6.413  -7.488
  427    HE2  TYR  49           HE2      TYR  49  58.113  -9.979  -6.323
  428    HH   TYR  49           HH       TYR  49  56.572  -9.927  -7.926
  429    H    ARG  50           HN       ARG  50  59.741  -3.899  -1.758
  430    HA   ARG  50           HA       ARG  50  62.011  -5.069  -0.582
  431    HB2  ARG  50           HB1      ARG  50  61.735  -2.643  -1.215
  432    HB3  ARG  50           HB2      ARG  50  60.617  -2.418   0.150
  433    HG2  ARG  50           HG1      ARG  50  62.575  -3.268   1.686
  434    HG3  ARG  50           HG2      ARG  50  63.627  -3.206   0.260
  435    HD2  ARG  50           HD1      ARG  50  64.132  -1.106   1.045
  436    HD3  ARG  50           HD2      ARG  50  62.677  -0.631   0.074
  437    HE   ARG  50           HE       ARG  50  61.763  -1.527   2.592
  438   HH11  ARG  50          HH11      ARG  50  61.841   1.700   4.198
  439   HH12  ARG  50          HH12      ARG  50  61.238   0.062   4.244
  440   HH21  ARG  50          HH21      ARG  50  63.230   2.323   2.358
  441   HH22  ARG  50          HH22      ARG  50  63.614   1.120   1.175
  442    H    HIS  51           HN       HIS  51  58.861  -4.056   1.043
  443    HA   HIS  51           HA       HIS  51  59.599  -5.139   3.502
  444    HB2  HIS  51           HB1      HIS  51  56.954  -4.331   2.339
  445    HB3  HIS  51           HB2      HIS  51  57.003  -5.255   3.865
  446    HD1  HIS  51           HD1      HIS  51  57.144  -3.780   5.884
  447    HD2  HIS  51           HD2      HIS  51  59.123  -1.967   2.660
  448    HE1  HIS  51           HE1      HIS  51  58.165  -1.579   6.707
  449    H    ASN  52           HN       ASN  52  57.867  -6.868   0.707
  450    HA   ASN  52           HA       ASN  52  57.512  -9.154   2.246
  451    HB2  ASN  52           HB1      ASN  52  57.854  -8.654  -0.765
  452    HB3  ASN  52           HB2      ASN  52  57.599 -10.318  -0.155
  453   HD21  ASN  52          HD21      ASN  52  54.292  -8.727  -1.114
  454   HD22  ASN  52          HD22      ASN  52  55.792  -9.051  -1.948
  455    H    LEU  53           HN       LEU  53  60.353  -8.143   0.203
  456    HA   LEU  53           HA       LEU  53  61.787 -10.500   0.615
  457    HB2  LEU  53           HB1      LEU  53  62.139  -8.922  -1.274
  458    HB3  LEU  53           HB2      LEU  53  62.614  -7.626  -0.152
  459    HG   LEU  53           HG       LEU  53  64.642  -8.994   0.498
  460   HD11  LEU  53          HD11      LEU  53  65.322 -10.897  -1.075
  461   HD12  LEU  53          HD12      LEU  53  63.849 -11.287  -0.115
  462   HD13  LEU  53          HD13      LEU  53  63.697 -10.811  -1.846
  463   HD21  LEU  53          HD21      LEU  53  65.901  -8.532  -1.634
  464   HD22  LEU  53          HD22      LEU  53  64.357  -8.315  -2.517
  465   HD23  LEU  53          HD23      LEU  53  64.798  -7.180  -1.191
  466    H    LYS  54           HN       LYS  54  61.878  -7.343   2.374
  467    HA   LYS  54           HA       LYS  54  63.666  -8.561   4.362
  468    HB2  LYS  54           HB1      LYS  54  64.753  -6.735   2.939
  469    HB3  LYS  54           HB2      LYS  54  63.420  -5.626   3.355
  470    HG2  LYS  54           HG1      LYS  54  64.224  -5.991   5.868
  471    HG3  LYS  54           HG2      LYS  54  65.716  -6.659   5.126
  472    HD2  LYS  54           HD1      LYS  54  64.510  -3.853   4.586
  473    HD3  LYS  54           HD2      LYS  54  65.875  -4.197   5.703
  474    HE2  LYS  54           HE1      LYS  54  66.042  -4.835   2.696
  475    HE3  LYS  54           HE2      LYS  54  66.474  -3.221   3.381
  476    HZ1  LYS  54           HZ1      LYS  54  68.380  -4.671   3.211
  477    HZ2  LYS  54           HZ2      LYS  54  68.045  -4.322   4.839
  478    HZ3  LYS  54           HZ3      LYS  54  67.637  -5.836   4.195
  479    H    GLY  55           HN       GLY  55  62.665  -8.811   6.359
  480    HA2  GLY  55           HA2      GLY  55  60.114  -7.523   6.678
  481    HA3  GLY  55           HA1      GLY  55  60.922  -8.741   7.757
  482    H    ARG  56           HN       ARG  56  60.980  -5.231   6.798
  483    HA   ARG  56           HA       ARG  56  62.548  -4.537   9.076
  484    HB2  ARG  56           HB1      ARG  56  60.704  -2.834   7.320
  485    HB3  ARG  56           HB2      ARG  56  61.775  -2.141   8.560
  486    HG2  ARG  56           HG1      ARG  56  63.719  -3.341   7.172
  487    HG3  ARG  56           HG2      ARG  56  62.508  -3.505   5.887
  488    HD2  ARG  56           HD1      ARG  56  63.501  -1.437   5.290
  489    HD3  ARG  56           HD2      ARG  56  62.040  -0.882   6.207
  490    HE   ARG  56           HE       ARG  56  63.376  -0.516   8.156
  491   HH11  ARG  56          HH11      ARG  56  66.832   0.406   8.008
  492   HH12  ARG  56          HH12      ARG  56  65.363   0.374   8.952
  493   HH21  ARG  56          HH21      ARG  56  66.749  -0.476   5.792
  494   HH22  ARG  56          HH22      ARG  56  65.258  -1.147   5.227
  495    H    SER  57           HN       SER  57  61.946  -4.423  11.209
  496    HA   SER  57           HA       SER  57  59.580  -2.910  11.783
  497    HB2  SER  57           HB1      SER  57  58.693  -5.297  11.847
  498    HB3  SER  57           HB2      SER  57  60.027  -5.767  12.947
  499    HG   SER  57           HG       SER  57  57.906  -5.217  13.912
  500    H    ALA  58           HN       ALA  58  59.916  -1.729  13.680
  501    HA   ALA  58           HA       ALA  58  61.069  -0.655  15.287
  502    HB1  ALA  58           HB1      ALA  58  61.029  -2.802  16.453
  503    HB2  ALA  58           HB2      ALA  58  62.598  -3.250  15.700
  504    HB3  ALA  58           HB3      ALA  58  62.506  -1.850  16.837
  505    H    ARG  59           HN       ARG  59  63.756  -2.632  14.031
  506    HA   ARG  59           HA       ARG  59  65.008  -0.258  12.793
  507    HB2  ARG  59           HB1      ARG  59  65.923  -0.633  15.091
  508    HB3  ARG  59           HB2      ARG  59  66.299  -2.326  14.690
  509    HG2  ARG  59           HG1      ARG  59  68.002  -1.523  13.028
  510    HG3  ARG  59           HG2      ARG  59  67.584   0.160  13.392
  511    HD2  ARG  59           HD1      ARG  59  68.407  -1.736  15.682
  512    HD3  ARG  59           HD2      ARG  59  69.646  -0.786  14.763
  513    HE   ARG  59           HE       ARG  59  67.590   0.260  16.590
  514   HH11  ARG  59          HH11      ARG  59  70.333   2.596  14.572
  515   HH12  ARG  59          HH12      ARG  59  70.130   0.897  14.229
  516   HH21  ARG  59          HH21      ARG  59  68.979   3.558  16.282
  517   HH22  ARG  59          HH22      ARG  59  67.824   2.550  17.084
  518    H    LYS  60           HN       LYS  60  66.614  -3.514  12.888
  519    HA   LYS  60           HA       LYS  60  64.776  -4.322  10.785
  520    HB2  LYS  60           HB1      LYS  60  67.809  -4.598  10.710
  521    HB3  LYS  60           HB2      LYS  60  66.749  -5.598   9.682
  522    HG2  LYS  60           HG1      LYS  60  65.807  -3.471   8.634
  523    HG3  LYS  60           HG2      LYS  60  66.882  -2.491   9.687
  524    HD2  LYS  60           HD1      LYS  60  67.686  -4.423   7.427
  525    HD3  LYS  60           HD2      LYS  60  67.795  -2.630   7.426
  526    HE2  LYS  60           HE1      LYS  60  69.483  -4.530   9.186
  527    HE3  LYS  60           HE2      LYS  60  70.038  -3.662   7.704
  528    HZ1  LYS  60           HZ1      LYS  60  70.658  -2.506   9.714
  529    HZ2  LYS  60           HZ2      LYS  60  69.559  -1.576   8.814
  530    HZ3  LYS  60           HZ3      LYS  60  69.038  -2.394  10.205
  531    H    LEU  61           HN       LEU  61  67.367  -5.646  13.048
  532    HA   LEU  61           HA       LEU  61  67.532  -7.484  14.152
  533    HB2  LEU  61           HB1      LEU  61  64.568  -7.061  14.475
  534    HB3  LEU  61           HB2      LEU  61  65.432  -8.341  15.357
  535    HG   LEU  61           HG       LEU  61  66.356  -5.413  15.315
  536   HD11  LEU  61          HD11      LEU  61  65.226  -5.142  17.612
  537   HD12  LEU  61          HD12      LEU  61  64.051  -5.385  16.267
  538   HD13  LEU  61          HD13      LEU  61  64.448  -6.748  17.377
  539   HD21  LEU  61          HD21      LEU  61  67.518  -5.981  17.488
  540   HD22  LEU  61          HD22      LEU  61  66.949  -7.676  17.358
  541   HD23  LEU  61          HD23      LEU  61  68.075  -7.012  16.120
  542    H    GLU  62           HN       GLU  62  67.712  -8.316  11.512
  543    HA   GLU  62           HA       GLU  62  65.993 -10.475  10.963
  544    HB2  GLU  62           HB1      GLU  62  68.715  -9.598   9.884
  545    HB3  GLU  62           HB2      GLU  62  67.841 -10.994   9.218
  546    HG2  GLU  62           HG1      GLU  62  65.890  -9.500   8.605
  547    HG3  GLU  62           HG2      GLU  62  66.732  -8.071   9.316
  Start of MODEL    6
    1    H1   ALA   1           HT1      ALA   1  60.016   5.275  17.129
    2    H2   ALA   1           HT2      ALA   1  61.529   5.441  16.376
    3    H3   ALA   1           HT3      ALA   1  60.362   4.399  15.716
    4    HA   ALA   1           HA       ALA   1  58.916   6.257  15.212
    5    HB1  ALA   1           HB1      ALA   1  59.626   7.605  17.187
    6    HB2  ALA   1           HB2      ALA   1  61.215   7.925  16.410
    7    HB3  ALA   1           HB3      ALA   1  59.703   8.596  15.688
    8    H    SER   2           HN       SER   2  59.207   5.378  13.075
    9    HA   SER   2           HA       SER   2  61.529   6.143  11.636
   10    HB2  SER   2           HB1      SER   2  60.332   5.084   9.676
   11    HB3  SER   2           HB2      SER   2  60.441   3.969  11.075
   12    HG   SER   2           HG       SER   2  58.332   4.194   9.971
   13    H    MET   3           HN       MET   3  61.558   7.477   9.615
   14    HA   MET   3           HA       MET   3  59.735   9.702   9.825
   15    HB2  MET   3           HB1      MET   3  62.053   9.070   7.914
   16    HB3  MET   3           HB2      MET   3  61.114  10.584   7.834
   17    HG2  MET   3           HG1      MET   3  62.872   9.638  10.231
   18    HG3  MET   3           HG2      MET   3  63.312  10.907   9.042
   19    HE1  MET   3           HE1      MET   3  61.043  13.900   9.880
   20    HE2  MET   3           HE2      MET   3  62.460  13.282   8.966
   21    HE3  MET   3           HE3      MET   3  60.816  12.655   8.606
   22    H    VAL   4           HN       VAL   4  58.028  10.134   8.457
   23    HA   VAL   4           HA       VAL   4  57.779   8.478   6.046
   24    HB   VAL   4           HB       VAL   4  55.343   8.687   6.199
   25   HG11  VAL   4          HG11      VAL   4  55.060   6.978   8.089
   26   HG12  VAL   4          HG12      VAL   4  56.447   6.579   7.032
   27   HG13  VAL   4          HG13      VAL   4  56.732   7.338   8.644
   28   HG21  VAL   4          HG21      VAL   4  54.270   9.314   8.406
   29   HG22  VAL   4          HG22      VAL   4  55.880   9.844   9.021
   30   HG23  VAL   4          HG23      VAL   4  55.108  10.698   7.636
   31    H    LEU   5           HN       LEU   5  57.071   9.604   4.180
   32    HA   LEU   5           HA       LEU   5  57.984  12.227   3.997
   33    HB2  LEU   5           HB1      LEU   5  56.350  10.433   2.137
   34    HB3  LEU   5           HB2      LEU   5  56.784  12.089   1.653
   35    HG   LEU   5           HG       LEU   5  59.221  11.451   2.039
   36   HD11  LEU   5          HD11      LEU   5  59.823   8.960   1.780
   37   HD12  LEU   5          HD12      LEU   5  59.022   9.320   3.352
   38   HD13  LEU   5          HD13      LEU   5  58.089   8.545   2.020
   39   HD21  LEU   5          HD21      LEU   5  59.405  10.287  -0.214
   40   HD22  LEU   5          HD22      LEU   5  57.639   9.985  -0.193
   41   HD23  LEU   5          HD23      LEU   5  58.259  11.674  -0.218
   42    H    SER   6           HN       SER   6  54.597  10.897   4.124
   43    HA   SER   6           HA       SER   6  53.832  13.480   5.183
   44    HB2  SER   6           HB1      SER   6  51.643  13.374   3.934
   45    HB3  SER   6           HB2      SER   6  53.002  13.553   2.781
   46    HG   SER   6           HG       SER   6  51.335  11.911   2.314
   47    HA   PRO   7           HA       PRO   7  51.961  10.584   8.020
   48    HB2  PRO   7           HB2      PRO   7  50.201  12.143   9.422
   49    HB3  PRO   7           HB1      PRO   7  51.990  12.379   9.542
   50    HG2  PRO   7           HG2      PRO   7  50.088  13.956   7.742
   51    HG3  PRO   7           HG1      PRO   7  51.321  14.602   8.906
   52    HD2  PRO   7           HD2      PRO   7  51.872  14.235   6.212
   53    HD3  PRO   7           HD1      PRO   7  53.146  14.022   7.510
   54    H    ARG   8           HN       ARG   8  50.149  12.203   5.455
   55    HA   ARG   8           HA       ARG   8  47.745  10.713   6.132
   56    HB2  ARG   8           HB1      ARG   8  48.382  12.730   3.934
   57    HB3  ARG   8           HB2      ARG   8  46.794  11.938   4.070
   58    HG2  ARG   8           HG1      ARG   8  48.156  13.874   6.083
   59    HG3  ARG   8           HG2      ARG   8  46.723  14.223   5.098
   60    HD2  ARG   8           HD1      ARG   8  46.805  12.209   7.428
   61    HD3  ARG   8           HD2      ARG   8  45.934  13.797   7.400
   62    HE   ARG   8           HE       ARG   8  44.840  12.694   5.250
   63   HH11  ARG   8          HH11      ARG   8  42.798  10.001   6.509
   64   HH12  ARG   8          HH12      ARG   8  43.097  11.114   5.196
   65   HH21  ARG   8          HH21      ARG   8  44.214  10.129   8.422
   66   HH22  ARG   8          HH22      ARG   8  45.501  11.286   8.419
   67    H    ASP   9           HN       ASP   9  50.222  10.748   3.323
   68    HA   ASP   9           HA       ASP   9  48.611   8.577   2.293
   69    HB2  ASP   9           HB1      ASP   9  50.919  10.256   1.097
   70    HB3  ASP   9           HB2      ASP   9  50.125   8.909   0.212
   71    H    GLU  10           HN       GLU  10  52.101   9.279   3.278
   72    HA   GLU  10           HA       GLU  10  52.922   6.717   2.452
   73    HB2  GLU  10           HB1      GLU  10  54.430   8.700   2.585
   74    HB3  GLU  10           HB2      GLU  10  54.272   8.710   4.356
   75    HG2  GLU  10           HG1      GLU  10  56.400   7.623   3.755
   76    HG3  GLU  10           HG2      GLU  10  55.318   6.322   4.384
   77    H    ARG  11           HN       ARG  11  52.016   8.050   5.684
   78    HA   ARG  11           HA       ARG  11  52.658   5.737   7.159
   79    HB2  ARG  11           HB1      ARG  11  52.263   8.009   8.114
   80    HB3  ARG  11           HB2      ARG  11  50.542   7.928   7.666
   81    HG2  ARG  11           HG1      ARG  11  50.384   5.831   9.211
   82    HG3  ARG  11           HG2      ARG  11  52.051   6.152   9.721
   83    HD2  ARG  11           HD1      ARG  11  49.731   8.149  10.110
   84    HD3  ARG  11           HD2      ARG  11  50.471   7.129  11.412
   85    HE   ARG  11           HE       ARG  11  51.610   9.512  10.148
   86   HH11  ARG  11          HH11      ARG  11  54.342   9.439  12.491
   87   HH12  ARG  11          HH12      ARG  11  53.478  10.361  11.286
   88   HH21  ARG  11          HH21      ARG  11  53.584   7.229  12.958
   89   HH22  ARG  11          HH22      ARG  11  52.190   6.640  12.120
   90    H    THR  12           HN       THR  12  49.553   6.744   5.610
   91    HA   THR  12           HA       THR  12  48.093   4.485   6.333
   92    HB   THR  12           HB       THR  12  47.877   6.293   3.891
   93    HG1  THR  12           HG1      THR  12  46.185   7.225   5.119
   94   HG21  THR  12          HG21      THR  12  45.458   5.477   3.728
   95   HG22  THR  12          HG22      THR  12  46.532   4.038   3.713
   96   HG23  THR  12          HG23      THR  12  45.657   4.490   5.220
   97    H    LEU  13           HN       LEU  13  50.139   5.099   3.378
   98    HA   LEU  13           HA       LEU  13  49.543   2.706   2.151
   99    HB2  LEU  13           HB1      LEU  13  50.637   4.596   1.015
  100    HB3  LEU  13           HB2      LEU  13  52.027   4.534   2.124
  101    HG   LEU  13           HG       LEU  13  52.664   2.318   1.194
  102   HD11  LEU  13          HD11      LEU  13  51.621   1.551  -1.021
  103   HD12  LEU  13          HD12      LEU  13  50.477   1.457   0.368
  104   HD13  LEU  13          HD13      LEU  13  50.346   2.806  -0.819
  105   HD21  LEU  13          HD21      LEU  13  53.484   3.166  -1.047
  106   HD22  LEU  13          HD22      LEU  13  52.373   4.567  -0.925
  107   HD23  LEU  13          HD23      LEU  13  53.699   4.370   0.276
  108    H    VAL  14           HN       VAL  14  52.248   3.412   4.538
  109    HA   VAL  14           HA       VAL  14  53.369   0.868   4.322
  110    HB   VAL  14           HB       VAL  14  53.461   2.953   6.516
  111   HG11  VAL  14          HG11      VAL  14  55.476   1.675   7.393
  112   HG12  VAL  14          HG12      VAL  14  53.967   0.731   7.567
  113   HG13  VAL  14          HG13      VAL  14  55.126   0.341   6.240
  114   HG21  VAL  14          HG21      VAL  14  55.820   3.274   5.518
  115   HG22  VAL  14          HG22      VAL  14  55.426   2.041   4.264
  116   HG23  VAL  14          HG23      VAL  14  54.532   3.602   4.316
  117    H    ARG  15           HN       ARG  15  50.855   2.109   6.750
  118    HA   ARG  15           HA       ARG  15  50.793  -0.426   8.013
  119    HB2  ARG  15           HB1      ARG  15  48.858   0.278   9.199
  120    HB3  ARG  15           HB2      ARG  15  50.117   1.534   9.267
  121    HG2  ARG  15           HG1      ARG  15  48.425   2.973   8.826
  122    HG3  ARG  15           HG2      ARG  15  48.559   2.444   7.140
  123    HD2  ARG  15           HD1      ARG  15  46.800   0.748   7.372
  124    HD3  ARG  15           HD2      ARG  15  46.621   1.083   9.144
  125    HE   ARG  15           HE       ARG  15  46.432   3.504   7.567
  126   HH11  ARG  15          HH11      ARG  15  43.069   1.310   8.554
  127   HH12  ARG  15          HH12      ARG  15  44.666   0.604   8.485
  128   HH21  ARG  15          HH21      ARG  15  42.859   3.640   8.057
  129   HH22  ARG  15          HH22      ARG  15  44.295   4.534   7.693
  130    H    LYS  16           HN       LYS  16  48.842   0.896   5.229
  131    HA   LYS  16           HA       LYS  16  46.939  -1.142   5.295
  132    HB2  LYS  16           HB1      LYS  16  46.709   1.045   4.080
  133    HB3  LYS  16           HB2      LYS  16  48.012   0.576   2.957
  134    HG2  LYS  16           HG1      LYS  16  45.943   0.279   1.760
  135    HG3  LYS  16           HG2      LYS  16  46.488  -1.376   2.188
  136    HD2  LYS  16           HD1      LYS  16  44.137  -1.333   2.615
  137    HD3  LYS  16           HD2      LYS  16  44.916  -1.233   4.230
  138    HE2  LYS  16           HE1      LYS  16  44.511   1.236   4.316
  139    HE3  LYS  16           HE2      LYS  16  43.801   1.199   2.657
  140    HZ1  LYS  16           HZ1      LYS  16  42.104   1.127   4.367
  141    HZ2  LYS  16           HZ2      LYS  16  42.107  -0.319   3.477
  142    HZ3  LYS  16           HZ3      LYS  16  42.775  -0.282   5.035
  143    H    VAL  17           HN       VAL  17  50.068  -0.936   3.370
  144    HA   VAL  17           HA       VAL  17  49.621  -3.403   2.107
  145    HB   VAL  17           HB       VAL  17  51.039  -1.602   1.215
  146   HG11  VAL  17          HG11      VAL  17  53.467  -1.565   1.901
  147   HG12  VAL  17          HG12      VAL  17  52.403  -0.964   3.207
  148   HG13  VAL  17          HG13      VAL  17  53.090  -2.630   3.300
  149   HG21  VAL  17          HG21      VAL  17  52.706  -3.226   0.234
  150   HG22  VAL  17          HG22      VAL  17  52.180  -4.455   1.442
  151   HG23  VAL  17          HG23      VAL  17  51.020  -3.833   0.213
  152    H    GLN  18           HN       GLN  18  51.335  -2.553   5.216
  153    HA   GLN  18           HA       GLN  18  52.320  -5.119   5.630
  154    HB2  GLN  18           HB1      GLN  18  53.152  -3.081   6.722
  155    HB3  GLN  18           HB2      GLN  18  51.603  -2.846   7.571
  156    HG2  GLN  18           HG1      GLN  18  51.994  -4.887   8.962
  157    HG3  GLN  18           HG2      GLN  18  53.426  -5.341   7.980
  158   HE21  GLN  18          HE21      GLN  18  53.634  -2.122  10.623
  159   HE22  GLN  18          HE22      GLN  18  52.088  -2.550   9.921
  160    H    ILE  19           HN       ILE  19  49.128  -3.646   6.726
  161    HA   ILE  19           HA       ILE  19  48.345  -5.951   8.095
  162    HB   ILE  19           HB       ILE  19  46.899  -3.593   6.924
  163   HG12  ILE  19          HG11      ILE  19  47.433  -4.354   9.873
  164   HG13  ILE  19          HG12      ILE  19  48.449  -3.263   8.880
  165   HG21  ILE  19          HG21      ILE  19  44.796  -4.331   8.161
  166   HG22  ILE  19          HG22      ILE  19  45.298  -5.672   7.083
  167   HG23  ILE  19          HG23      ILE  19  45.653  -5.756   8.847
  168   HD11  ILE  19          HD11      ILE  19  46.937  -1.929  10.304
  169   HD12  ILE  19          HD12      ILE  19  46.481  -1.704   8.577
  170   HD13  ILE  19          HD13      ILE  19  45.492  -2.770   9.643
  171    H    ASN  20           HN       ASN  20  47.611  -4.923   4.625
  172    HA   ASN  20           HA       ASN  20  46.995  -7.734   4.231
  173    HB2  ASN  20           HB1      ASN  20  45.214  -7.141   2.571
  174    HB3  ASN  20           HB2      ASN  20  44.779  -6.773   4.268
  175   HD21  ASN  20          HD21      ASN  20  44.637  -3.227   3.715
  176   HD22  ASN  20          HD22      ASN  20  45.045  -4.412   4.932
  177    HA   PRO  21           HA       PRO  21  50.237  -6.474   1.294
  178    HB2  PRO  21           HB2      PRO  21  51.617  -8.821   1.089
  179    HB3  PRO  21           HB1      PRO  21  51.721  -7.751   2.543
  180    HG2  PRO  21           HG2      PRO  21  49.916 -10.189   2.276
  181    HG3  PRO  21           HG1      PRO  21  51.079  -9.791   3.609
  182    HD2  PRO  21           HD2      PRO  21  48.405  -9.087   3.758
  183    HD3  PRO  21           HD1      PRO  21  49.735  -8.077   4.505
  184    H    ARG  22           HN       ARG  22  47.617  -8.773   0.939
  185    HA   ARG  22           HA       ARG  22  48.300  -9.478  -1.786
  186    HB2  ARG  22           HB1      ARG  22  45.802  -9.920  -0.083
  187    HB3  ARG  22           HB2      ARG  22  45.972 -10.569  -1.732
  188    HG2  ARG  22           HG1      ARG  22  48.109 -11.809  -0.870
  189    HG3  ARG  22           HG2      ARG  22  47.702 -11.254   0.764
  190    HD2  ARG  22           HD1      ARG  22  45.443 -12.362   0.664
  191    HD3  ARG  22           HD2      ARG  22  45.848 -13.062  -0.957
  192    HE   ARG  22           HE       ARG  22  46.977 -13.826   1.649
  193   HH11  ARG  22          HH11      ARG  22  48.123 -15.491  -1.954
  194   HH12  ARG  22          HH12      ARG  22  47.100 -14.078  -1.867
  195   HH21  ARG  22          HH21      ARG  22  48.841 -16.475   0.096
  196   HH22  ARG  22          HH22      ARG  22  48.358 -15.730   1.582
  197    H    THR  23           HN       THR  23  48.495  -7.002  -2.109
  198    HA   THR  23           HA       THR  23  46.106  -6.223  -3.582
  199    HB   THR  23           HB       THR  23  46.669  -3.840  -3.229
  200    HG1  THR  23           HG1      THR  23  47.963  -3.306  -1.448
  201   HG21  THR  23          HG21      THR  23  45.718  -3.650  -0.882
  202   HG22  THR  23          HG22      THR  23  44.918  -5.017  -1.729
  203   HG23  THR  23          HG23      THR  23  46.207  -5.343  -0.515
  204    H    THR  24           HN       THR  24  46.691  -4.759  -5.507
  205    HA   THR  24           HA       THR  24  49.445  -5.317  -6.323
  206    HB   THR  24           HB       THR  24  48.718  -5.191  -8.662
  207    HG1  THR  24           HG1      THR  24  46.500  -5.329  -9.126
  208   HG21  THR  24          HG21      THR  24  47.507  -7.443  -8.745
  209   HG22  THR  24          HG22      THR  24  48.708  -7.476  -7.409
  210   HG23  THR  24          HG23      THR  24  46.961  -7.239  -7.042
  211    H    ALA  25           HN       ALA  25  50.205  -3.643  -8.047
  212    HA   ALA  25           HA       ALA  25  50.248  -1.115  -6.843
  213    HB1  ALA  25           HB1      ALA  25  52.050  -2.022  -8.294
  214    HB2  ALA  25           HB2      ALA  25  50.959  -1.931  -9.719
  215    HB3  ALA  25           HB3      ALA  25  51.489  -0.420  -8.886
  216    H    LYS  26           HN       LYS  26  48.032  -2.403  -9.302
  217    HA   LYS  26           HA       LYS  26  46.976  -0.020 -10.241
  218    HB2  LYS  26           HB1      LYS  26  45.828  -2.834  -9.858
  219    HB3  LYS  26           HB2      LYS  26  44.867  -1.554 -10.642
  220    HG2  LYS  26           HG1      LYS  26  47.662  -2.456 -11.638
  221    HG3  LYS  26           HG2      LYS  26  46.133  -3.204 -12.206
  222    HD2  LYS  26           HD1      LYS  26  45.370  -0.825 -12.894
  223    HD3  LYS  26           HD2      LYS  26  47.031  -0.261 -12.500
  224    HE2  LYS  26           HE1      LYS  26  48.013  -1.722 -14.249
  225    HE3  LYS  26           HE2      LYS  26  46.408  -2.479 -14.575
  226    HZ1  LYS  26           HZ1      LYS  26  46.916  -0.723 -16.153
  227    HZ2  LYS  26           HZ2      LYS  26  45.570  -0.300 -15.208
  228    HZ3  LYS  26           HZ3      LYS  26  47.079   0.410 -14.901
  229    H    ASP  27           HN       ASP  27  46.072  -1.891  -7.228
  230    HA   ASP  27           HA       ASP  27  43.826  -0.362  -6.630
  231    HB2  ASP  27           HB1      ASP  27  45.893  -1.871  -4.863
  232    HB3  ASP  27           HB2      ASP  27  44.333  -1.253  -4.219
  233    H    LEU  28           HN       LEU  28  47.264   0.012  -5.752
  234    HA   LEU  28           HA       LEU  28  47.014   2.303  -4.194
  235    HB2  LEU  28           HB1      LEU  28  49.294   0.962  -5.679
  236    HB3  LEU  28           HB2      LEU  28  49.566   2.521  -4.865
  237    HG   LEU  28           HG       LEU  28  48.849   1.543  -2.717
  238   HD11  LEU  28          HD11      LEU  28  48.763  -1.012  -2.396
  239   HD12  LEU  28          HD12      LEU  28  47.379  -0.395  -3.371
  240   HD13  LEU  28          HD13      LEU  28  48.763  -1.211  -4.184
  241   HD21  LEU  28          HD21      LEU  28  50.897   0.079  -2.370
  242   HD22  LEU  28          HD22      LEU  28  51.123   0.002  -4.146
  243   HD23  LEU  28          HD23      LEU  28  51.230   1.587  -3.298
  244    H    VAL  29           HN       VAL  29  47.570   1.920  -7.767
  245    HA   VAL  29           HA       VAL  29  48.004   4.607  -8.348
  246    HB   VAL  29           HB       VAL  29  46.757   2.339  -9.956
  247   HG11  VAL  29          HG11      VAL  29  47.209   3.746 -12.016
  248   HG12  VAL  29          HG12      VAL  29  45.957   4.484 -10.973
  249   HG13  VAL  29          HG13      VAL  29  47.636   5.141 -10.966
  250   HG21  VAL  29          HG21      VAL  29  49.043   2.397 -11.119
  251   HG22  VAL  29          HG22      VAL  29  49.573   3.673  -9.962
  252   HG23  VAL  29          HG23      VAL  29  49.183   2.015  -9.374
  253    H    LYS  30           HN       LYS  30  44.825   2.753  -8.179
  254    HA   LYS  30           HA       LYS  30  43.277   4.993  -8.763
  255    HB2  LYS  30           HB1      LYS  30  42.678   2.485  -7.144
  256    HB3  LYS  30           HB2      LYS  30  41.438   3.730  -7.442
  257    HG2  LYS  30           HG1      LYS  30  41.952   3.418 -10.001
  258    HG3  LYS  30           HG2      LYS  30  42.952   2.002  -9.534
  259    HD2  LYS  30           HD1      LYS  30  39.925   2.394  -9.050
  260    HD3  LYS  30           HD2      LYS  30  40.683   1.328 -10.280
  261    HE2  LYS  30           HE1      LYS  30  41.763   0.009  -8.332
  262    HE3  LYS  30           HE2      LYS  30  40.725   0.970  -7.211
  263    HZ1  LYS  30           HZ1      LYS  30  39.675  -1.104  -7.861
  264    HZ2  LYS  30           HZ2      LYS  30  38.788   0.219  -8.451
  265    HZ3  LYS  30           HZ3      LYS  30  39.766  -0.682  -9.502
  266    H    MET  31           HN       MET  31  44.483   3.803  -5.528
  267    HA   MET  31           HA       MET  31  43.141   5.680  -4.005
  268    HB2  MET  31           HB1      MET  31  44.205   3.654  -3.112
  269    HB3  MET  31           HB2      MET  31  45.820   4.195  -3.636
  270    HG2  MET  31           HG1      MET  31  44.253   5.864  -1.578
  271    HG3  MET  31           HG2      MET  31  45.066   4.347  -1.074
  272    HE1  MET  31           HE1      MET  31  47.600   6.628   0.522
  273    HE2  MET  31           HE2      MET  31  45.804   6.595   0.580
  274    HE3  MET  31           HE3      MET  31  46.731   5.056   0.560
  275    H    LEU  32           HN       LEU  32  46.457   5.962  -5.538
  276    HA   LEU  32           HA       LEU  32  46.955   8.497  -4.508
  277    HB2  LEU  32           HB1      LEU  32  47.959   7.018  -6.997
  278    HB3  LEU  32           HB2      LEU  32  48.631   8.591  -6.505
  279    HG   LEU  32           HG       LEU  32  48.579   6.052  -4.760
  280   HD11  LEU  32          HD11      LEU  32  51.096   5.901  -5.300
  281   HD12  LEU  32          HD12      LEU  32  50.040   5.654  -6.738
  282   HD13  LEU  32          HD13      LEU  32  50.880   7.229  -6.494
  283   HD21  LEU  32          HD21      LEU  32  50.320   7.203  -3.346
  284   HD22  LEU  32          HD22      LEU  32  50.174   8.682  -4.348
  285   HD23  LEU  32          HD23      LEU  32  48.764   8.110  -3.385
  286    H    GLU  33           HN       GLU  33  45.467   7.520  -7.710
  287    HA   GLU  33           HA       GLU  33  45.159  10.130  -8.647
  288    HB2  GLU  33           HB1      GLU  33  43.708   7.518  -9.277
  289    HB3  GLU  33           HB2      GLU  33  43.342   9.029 -10.139
  290    HG2  GLU  33           HG1      GLU  33  45.734   9.171 -10.946
  291    HG3  GLU  33           HG2      GLU  33  46.157   7.672 -10.034
  292    H    GLU  34           HN       GLU  34  42.864   8.051  -6.721
  293    HA   GLU  34           HA       GLU  34  40.732   9.845  -6.748
  294    HB2  GLU  34           HB1      GLU  34  40.574   7.419  -6.129
  295    HB3  GLU  34           HB2      GLU  34  41.563   7.706  -4.679
  296    HG2  GLU  34           HG1      GLU  34  39.751   9.195  -3.737
  297    HG3  GLU  34           HG2      GLU  34  38.738   8.910  -5.202
  298    H    THR  35           HN       THR  35  43.470   9.483  -4.392
  299    HA   THR  35           HA       THR  35  42.600  11.514  -2.681
  300    HB   THR  35           HB       THR  35  45.399  10.487  -3.288
  301    HG1  THR  35           HG1      THR  35  45.059   9.317  -1.351
  302   HG21  THR  35          HG21      THR  35  46.020  11.431  -0.985
  303   HG22  THR  35          HG22      THR  35  45.293  12.760  -1.951
  304   HG23  THR  35          HG23      THR  35  44.313  11.923  -0.694
  305    H    GLY  36           HN       GLY  36  44.774  11.584  -5.546
  306    HA2  GLY  36           HA2      GLY  36  44.794  13.348  -7.026
  307    HA3  GLY  36           HA1      GLY  36  44.287  14.457  -5.680
  308    H    THR  37           HN       THR  37  47.011  12.047  -5.935
  309    HA   THR  37           HA       THR  37  48.861  14.277  -5.814
  310    HB   THR  37           HB       THR  37  48.496  13.584  -3.469
  311    HG1  THR  37           HG1      THR  37  50.672  13.091  -3.004
  312   HG21  THR  37          HG21      THR  37  49.196  11.279  -2.701
  313   HG22  THR  37          HG22      THR  37  47.928  11.116  -3.963
  314   HG23  THR  37          HG23      THR  37  49.655  10.820  -4.380
  315    H    LYS  38           HN       LYS  38  51.056  13.705  -6.571
  316    HA   LYS  38           HA       LYS  38  51.023  11.242  -8.167
  317    HB2  LYS  38           HB1      LYS  38  52.684  13.816  -8.422
  318    HB3  LYS  38           HB2      LYS  38  52.963  12.370  -9.425
  319    HG2  LYS  38           HG1      LYS  38  50.601  12.602 -10.367
  320    HG3  LYS  38           HG2      LYS  38  50.346  14.051  -9.338
  321    HD2  LYS  38           HD1      LYS  38  50.858  14.803 -11.587
  322    HD3  LYS  38           HD2      LYS  38  52.276  15.177 -10.551
  323    HE2  LYS  38           HE1      LYS  38  53.494  13.173 -11.455
  324    HE3  LYS  38           HE2      LYS  38  52.067  12.760 -12.480
  325    HZ1  LYS  38           HZ1      LYS  38  53.720  14.020 -13.698
  326    HZ2  LYS  38           HZ2      LYS  38  52.284  14.913 -13.553
  327    HZ3  LYS  38           HZ3      LYS  38  53.624  15.300 -12.589
  328    H    VAL  39           HN       VAL  39  52.153   9.599  -7.337
  329    HA   VAL  39           HA       VAL  39  54.723  10.140  -6.005
  330    HB   VAL  39           HB       VAL  39  52.697   7.953  -5.325
  331   HG11  VAL  39          HG11      VAL  39  54.349   7.404  -3.463
  332   HG12  VAL  39          HG12      VAL  39  55.071   7.165  -5.082
  333   HG13  VAL  39          HG13      VAL  39  55.484   8.634  -4.119
  334   HG21  VAL  39          HG21      VAL  39  52.573   9.128  -3.052
  335   HG22  VAL  39          HG22      VAL  39  53.588  10.462  -3.712
  336   HG23  VAL  39          HG23      VAL  39  51.947  10.151  -4.383
  337    H    SER  40           HN       SER  40  56.439   8.866  -6.967
  338    HA   SER  40           HA       SER  40  55.810   8.013  -9.534
  339    HB2  SER  40           HB1      SER  40  58.302   7.484  -7.787
  340    HB3  SER  40           HB2      SER  40  58.259   7.138  -9.544
  341    HG   SER  40           HG       SER  40  59.151   9.250  -8.828
  342    H    ILE  41           HN       ILE  41  55.385   6.076 -10.491
  343    HA   ILE  41           HA       ILE  41  54.234   4.157  -8.839
  344    HB   ILE  41           HB       ILE  41  54.841   4.243 -11.783
  345   HG12  ILE  41          HG11      ILE  41  53.298   5.998 -11.197
  346   HG13  ILE  41          HG12      ILE  41  52.360   4.712 -12.019
  347   HG21  ILE  41          HG21      ILE  41  53.199   2.306 -12.053
  348   HG22  ILE  41          HG22      ILE  41  54.468   1.799 -10.893
  349   HG23  ILE  41          HG23      ILE  41  52.850   2.309 -10.289
  350   HD11  ILE  41          HD11      ILE  41  51.075   5.602 -10.125
  351   HD12  ILE  41          HD12      ILE  41  51.526   3.892  -9.784
  352   HD13  ILE  41          HD13      ILE  41  52.411   5.240  -8.977
  353    H    SER  42           HN       SER  42  57.367   4.098 -10.675
  354    HA   SER  42           HA       SER  42  57.845   1.402 -10.305
  355    HB2  SER  42           HB1      SER  42  59.818   3.765 -10.533
  356    HB3  SER  42           HB2      SER  42  60.329   2.055 -10.690
  357    HG   SER  42           HG       SER  42  59.812   3.271 -12.704
  358    H    THR  43           HN       THR  43  58.720   4.197  -8.185
  359    HA   THR  43           HA       THR  43  60.209   2.724  -6.343
  360    HB   THR  43           HB       THR  43  58.501   5.227  -5.998
  361    HG1  THR  43           HG1      THR  43  60.531   6.268  -6.199
  362   HG21  THR  43          HG21      THR  43  59.980   5.737  -3.975
  363   HG22  THR  43          HG22      THR  43  59.280   4.098  -3.750
  364   HG23  THR  43          HG23      THR  43  60.985   4.279  -4.301
  365    H    VAL  44           HN       VAL  44  56.693   3.510  -6.433
  366    HA   VAL  44           HA       VAL  44  55.996   2.259  -4.043
  367    HB   VAL  44           HB       VAL  44  54.486   2.812  -6.635
  368   HG11  VAL  44          HG11      VAL  44  52.357   2.472  -5.310
  369   HG12  VAL  44          HG12      VAL  44  53.280   0.949  -5.482
  370   HG13  VAL  44          HG13      VAL  44  53.321   1.856  -3.922
  371   HG21  VAL  44          HG21      VAL  44  53.465   4.680  -5.200
  372   HG22  VAL  44          HG22      VAL  44  54.555   4.201  -3.847
  373   HG23  VAL  44          HG23      VAL  44  55.239   4.853  -5.379
  374    H    LYS  45           HN       LYS  45  56.105   0.938  -7.430
  375    HA   LYS  45           HA       LYS  45  55.117  -1.566  -6.717
  376    HB2  LYS  45           HB1      LYS  45  55.043  -0.600  -8.969
  377    HB3  LYS  45           HB2      LYS  45  56.822  -0.636  -9.084
  378    HG2  LYS  45           HG1      LYS  45  56.843  -3.100  -9.114
  379    HG3  LYS  45           HG2      LYS  45  55.118  -3.181  -8.623
  380    HD2  LYS  45           HD1      LYS  45  54.478  -2.070 -10.808
  381    HD3  LYS  45           HD2      LYS  45  56.213  -2.008 -11.271
  382    HE2  LYS  45           HE1      LYS  45  55.177  -3.922 -12.422
  383    HE3  LYS  45           HE2      LYS  45  56.276  -4.572 -11.148
  384    HZ1  LYS  45           HZ1      LYS  45  54.132  -5.668 -11.137
  385    HZ2  LYS  45           HZ2      LYS  45  54.362  -4.804  -9.694
  386    HZ3  LYS  45           HZ3      LYS  45  53.331  -4.192 -10.893
  387    H    ARG  46           HN       ARG  46  58.544  -0.415  -7.024
  388    HA   ARG  46           HA       ARG  46  59.728  -2.885  -6.427
  389    HB2  ARG  46           HB1      ARG  46  60.606   0.010  -6.000
  390    HB3  ARG  46           HB2      ARG  46  61.684  -1.332  -5.554
  391    HG2  ARG  46           HG1      ARG  46  60.560  -0.926  -8.406
  392    HG3  ARG  46           HG2      ARG  46  62.045  -0.129  -7.857
  393    HD2  ARG  46           HD1      ARG  46  62.827  -2.049  -9.026
  394    HD3  ARG  46           HD2      ARG  46  63.030  -2.483  -7.280
  395    HE   ARG  46           HE       ARG  46  60.450  -3.277  -8.278
  396   HH11  ARG  46          HH11      ARG  46  63.744  -5.775  -8.491
  397   HH12  ARG  46          HH12      ARG  46  63.875  -4.034  -8.485
  398   HH21  ARG  46          HH21      ARG  46  61.563  -6.729  -8.334
  399   HH22  ARG  46          HH22      ARG  46  60.208  -5.664  -8.180
  400    H    VAL  47           HN       VAL  47  58.738  -0.208  -4.042
  401    HA   VAL  47           HA       VAL  47  59.880  -1.623  -1.905
  402    HB   VAL  47           HB       VAL  47  59.454   0.807  -1.924
  403   HG11  VAL  47          HG11      VAL  47  57.215   1.613  -1.091
  404   HG12  VAL  47          HG12      VAL  47  57.100   0.932  -2.742
  405   HG13  VAL  47          HG13      VAL  47  56.533  -0.033  -1.326
  406   HG21  VAL  47          HG21      VAL  47  58.903   0.840   0.542
  407   HG22  VAL  47          HG22      VAL  47  58.466  -0.904   0.440
  408   HG23  VAL  47          HG23      VAL  47  60.152  -0.368   0.105
  409    H    LEU  48           HN       LEU  48  56.560  -1.710  -3.356
  410    HA   LEU  48           HA       LEU  48  55.367  -3.120  -1.280
  411    HB2  LEU  48           HB1      LEU  48  54.183  -1.799  -3.052
  412    HB3  LEU  48           HB2      LEU  48  54.740  -2.936  -4.302
  413    HG   LEU  48           HG       LEU  48  53.082  -3.944  -1.965
  414   HD11  LEU  48          HD11      LEU  48  50.967  -3.346  -3.335
  415   HD12  LEU  48          HD12      LEU  48  51.866  -1.907  -2.728
  416   HD13  LEU  48          HD13      LEU  48  52.015  -2.405  -4.454
  417   HD21  LEU  48          HD21      LEU  48  52.069  -5.510  -3.651
  418   HD22  LEU  48          HD22      LEU  48  53.076  -4.795  -4.951
  419   HD23  LEU  48          HD23      LEU  48  53.862  -5.669  -3.587
  420    H    TYR  49           HN       TYR  49  56.846  -4.384  -4.423
  421    HA   TYR  49           HA       TYR  49  56.437  -7.009  -3.558
  422    HB2  TYR  49           HB1      TYR  49  57.919  -5.679  -5.833
  423    HB3  TYR  49           HB2      TYR  49  58.372  -7.368  -5.454
  424    HD1  TYR  49           HD1      TYR  49  56.773  -9.139  -5.688
  425    HD2  TYR  49           HD2      TYR  49  55.567  -5.118  -6.637
  426    HE1  TYR  49           HE1      TYR  49  54.709 -10.011  -6.745
  427    HE2  TYR  49           HE2      TYR  49  53.477  -5.997  -7.638
  428    HH   TYR  49           HH       TYR  49  52.241  -7.796  -8.088
  429    H    ARG  50           HN       ARG  50  59.413  -4.867  -3.231
  430    HA   ARG  50           HA       ARG  50  61.057  -7.143  -3.027
  431    HB2  ARG  50           HB1      ARG  50  61.817  -4.932  -3.789
  432    HB3  ARG  50           HB2      ARG  50  61.609  -4.263  -2.154
  433    HG2  ARG  50           HG1      ARG  50  63.343  -5.934  -1.299
  434    HG3  ARG  50           HG2      ARG  50  63.509  -6.604  -2.931
  435    HD2  ARG  50           HD1      ARG  50  65.356  -5.111  -2.817
  436    HD3  ARG  50           HD2      ARG  50  64.133  -4.159  -3.754
  437    HE   ARG  50           HE       ARG  50  63.963  -3.840  -0.847
  438   HH11  ARG  50          HH11      ARG  50  65.148  -0.452  -1.082
  439   HH12  ARG  50          HH12      ARG  50  64.395  -1.671  -0.083
  440   HH21  ARG  50          HH21      ARG  50  65.681  -1.038  -3.339
  441   HH22  ARG  50          HH22      ARG  50  65.340  -2.648  -3.872
  442    H    HIS  51           HN       HIS  51  59.682  -5.037  -0.375
  443    HA   HIS  51           HA       HIS  51  61.070  -6.364   1.662
  444    HB2  HIS  51           HB1      HIS  51  58.525  -4.672   1.702
  445    HB3  HIS  51           HB2      HIS  51  59.214  -5.383   3.188
  446    HD1  HIS  51           HD1      HIS  51  59.421  -2.713   3.820
  447    HD2  HIS  51           HD2      HIS  51  62.105  -4.109   0.908
  448    HE1  HIS  51           HE1      HIS  51  61.307  -0.987   3.563
  449    H    ASN  52           HN       ASN  52  57.719  -7.013   0.324
  450    HA   ASN  52           HA       ASN  52  57.232  -9.061   2.146
  451    HB2  ASN  52           HB1      ASN  52  56.188  -8.401  -0.662
  452    HB3  ASN  52           HB2      ASN  52  55.593  -9.859   0.189
  453   HD21  ASN  52          HD21      ASN  52  54.022  -6.204   1.051
  454   HD22  ASN  52          HD22      ASN  52  55.010  -6.525  -0.352
  455    H    LEU  53           HN       LEU  53  58.854  -9.116  -1.102
  456    HA   LEU  53           HA       LEU  53  58.800 -11.944  -1.220
  457    HB2  LEU  53           HB1      LEU  53  58.617 -10.367  -3.162
  458    HB3  LEU  53           HB2      LEU  53  60.273  -9.790  -2.864
  459    HG   LEU  53           HG       LEU  53  59.904 -11.230  -4.774
  460   HD11  LEU  53          HD11      LEU  53  61.942 -12.802  -4.467
  461   HD12  LEU  53          HD12      LEU  53  62.225 -11.085  -4.001
  462   HD13  LEU  53          HD13      LEU  53  61.955 -12.334  -2.730
  463   HD21  LEU  53          HD21      LEU  53  59.697 -13.773  -4.486
  464   HD22  LEU  53          HD22      LEU  53  59.383 -13.512  -2.741
  465   HD23  LEU  53          HD23      LEU  53  58.251 -12.836  -3.964
  466    H    LYS  54           HN       LYS  54  61.401  -9.498  -0.429
  467    HA   LYS  54           HA       LYS  54  62.904 -11.728   0.754
  468    HB2  LYS  54           HB1      LYS  54  64.028 -10.821  -1.361
  469    HB3  LYS  54           HB2      LYS  54  64.023  -9.192  -0.636
  470    HG2  LYS  54           HG1      LYS  54  65.471 -10.145   1.295
  471    HG3  LYS  54           HG2      LYS  54  65.539 -11.701   0.402
  472    HD2  LYS  54           HD1      LYS  54  66.711  -8.975  -0.415
  473    HD3  LYS  54           HD2      LYS  54  67.600 -10.463   0.056
  474    HE2  LYS  54           HE1      LYS  54  66.714 -11.598  -2.049
  475    HE3  LYS  54           HE2      LYS  54  65.994 -10.017  -2.541
  476    HZ1  LYS  54           HZ1      LYS  54  68.215 -10.322  -3.456
  477    HZ2  LYS  54           HZ2      LYS  54  68.198  -9.022  -2.364
  478    HZ3  LYS  54           HZ3      LYS  54  68.871 -10.507  -1.902
  479    H    GLY  55           HN       GLY  55  63.456 -11.405   2.963
  480    HA2  GLY  55           HA2      GLY  55  62.368  -9.012   4.121
  481    HA3  GLY  55           HA1      GLY  55  63.182 -10.411   4.947
  482    H    ARG  56           HN       ARG  56  63.524  -7.241   3.535
  483    HA   ARG  56           HA       ARG  56  66.414  -7.170   3.704
  484    HB2  ARG  56           HB1      ARG  56  64.302  -5.014   3.180
  485    HB3  ARG  56           HB2      ARG  56  66.050  -4.695   3.090
  486    HG2  ARG  56           HG1      ARG  56  64.439  -6.681   1.323
  487    HG3  ARG  56           HG2      ARG  56  64.941  -5.060   0.814
  488    HD2  ARG  56           HD1      ARG  56  67.019  -7.179   1.612
  489    HD3  ARG  56           HD2      ARG  56  66.456  -6.942  -0.093
  490    HE   ARG  56           HE       ARG  56  67.162  -4.571   0.109
  491   HH11  ARG  56          HH11      ARG  56  70.076  -6.028   2.630
  492   HH12  ARG  56          HH12      ARG  56  68.488  -6.750   2.542
  493   HH21  ARG  56          HH21      ARG  56  70.547  -4.190   1.190
  494   HH22  ARG  56          HH22      ARG  56  69.318  -3.672   0.087
  495    H    SER  57           HN       SER  57  66.543  -7.807   5.934
  496    HA   SER  57           HA       SER  57  66.701  -7.626   8.087
  497    HB2  SER  57           HB1      SER  57  68.037  -5.550   7.469
  498    HB3  SER  57           HB2      SER  57  66.580  -4.562   7.800
  499    HG   SER  57           HG       SER  57  68.171  -4.849   9.556
  500    H    ALA  58           HN       ALA  58  65.509  -5.782  10.041
  501    HA   ALA  58           HA       ALA  58  62.634  -6.254   9.606
  502    HB1  ALA  58           HB1      ALA  58  63.532  -8.222  10.836
  503    HB2  ALA  58           HB2      ALA  58  64.244  -7.133  12.075
  504    HB3  ALA  58           HB3      ALA  58  62.452  -7.244  11.889
  505    H    ARG  59           HN       ARG  59  64.858  -5.025  12.142
  506    HA   ARG  59           HA       ARG  59  64.697  -3.341  13.616
  507    HB2  ARG  59           HB1      ARG  59  63.638  -1.946  11.180
  508    HB3  ARG  59           HB2      ARG  59  63.746  -1.089  12.736
  509    HG2  ARG  59           HG1      ARG  59  65.777  -0.530  11.571
  510    HG3  ARG  59           HG2      ARG  59  66.289  -1.747  12.755
  511    HD2  ARG  59           HD1      ARG  59  67.408  -2.092  10.587
  512    HD3  ARG  59           HD2      ARG  59  66.414  -3.537  11.043
  513    HE   ARG  59           HE       ARG  59  64.865  -3.073   9.395
  514   HH11  ARG  59          HH11      ARG  59  65.292  -0.876   6.592
  515   HH12  ARG  59          HH12      ARG  59  64.491  -2.291   7.232
  516   HH21  ARG  59          HH21      ARG  59  66.935   0.185   7.958
  517   HH22  ARG  59          HH22      ARG  59  67.236  -0.458   9.535
  518    H    LYS  60           HN       LYS  60  61.883  -1.543  12.741
  519    HA   LYS  60           HA       LYS  60  60.545  -2.831  15.000
  520    HB2  LYS  60           HB1      LYS  60  60.293  -0.010  13.818
  521    HB3  LYS  60           HB2      LYS  60  59.288  -0.605  15.165
  522    HG2  LYS  60           HG1      LYS  60  61.459  -0.993  16.517
  523    HG3  LYS  60           HG2      LYS  60  62.384  -0.280  15.154
  524    HD2  LYS  60           HD1      LYS  60  60.969   1.852  15.453
  525    HD3  LYS  60           HD2      LYS  60  60.261   1.097  16.921
  526    HE2  LYS  60           HE1      LYS  60  62.630   0.867  17.890
  527    HE3  LYS  60           HE2      LYS  60  63.255   1.780  16.464
  528    HZ1  LYS  60           HZ1      LYS  60  62.845   3.217  18.349
  529    HZ2  LYS  60           HZ2      LYS  60  61.801   3.609  17.069
  530    HZ3  LYS  60           HZ3      LYS  60  61.215   2.750  18.407
  531    H    LEU  61           HN       LEU  61  58.529  -3.581  14.857
  532    HA   LEU  61           HA       LEU  61  56.580  -4.227  14.198
  533    HB2  LEU  61           HB1      LEU  61  56.780  -1.902  12.256
  534    HB3  LEU  61           HB2      LEU  61  55.391  -3.011  12.175
  535    HG   LEU  61           HG       LEU  61  54.888  -0.995  13.303
  536   HD11  LEU  61          HD11      LEU  61  53.937  -1.961  15.525
  537   HD12  LEU  61          HD12      LEU  61  53.613  -2.945  14.051
  538   HD13  LEU  61          HD13      LEU  61  54.905  -3.443  15.204
  539   HD21  LEU  61          HD21      LEU  61  55.771  -0.344  15.603
  540   HD22  LEU  61          HD22      LEU  61  57.024  -1.617  15.465
  541   HD23  LEU  61          HD23      LEU  61  57.007  -0.248  14.298
  542    H    GLU  62           HN       GLU  62  58.672  -3.739  11.227
  543    HA   GLU  62           HA       GLU  62  57.076  -5.412   9.659
  544    HB2  GLU  62           HB1      GLU  62  58.467  -3.567   8.783
  545    HB3  GLU  62           HB2      GLU  62  59.949  -4.422   9.262
  546    HG2  GLU  62           HG1      GLU  62  59.471  -6.266   7.647
  547    HG3  GLU  62           HG2      GLU  62  57.861  -5.562   7.240
  Start of MODEL    7
    1    H1   ALA   1           HT1      ALA   1  41.278   5.933   8.597
    2    H2   ALA   1           HT2      ALA   1  42.942   5.894   8.932
    3    H3   ALA   1           HT3      ALA   1  42.397   6.329   7.383
    4    HA   ALA   1           HA       ALA   1  41.367   8.326   8.254
    5    HB1  ALA   1           HB1      ALA   1  40.799   7.299  10.459
    6    HB2  ALA   1           HB2      ALA   1  42.532   7.332  10.932
    7    HB3  ALA   1           HB3      ALA   1  41.628   8.877  10.698
    8    H    SER   2           HN       SER   2  44.556   6.923   8.591
    9    HA   SER   2           HA       SER   2  46.005   9.247   9.034
   10    HB2  SER   2           HB1      SER   2  46.753   6.579   7.679
   11    HB3  SER   2           HB2      SER   2  47.979   7.802   8.136
   12    HG   SER   2           HG       SER   2  47.509   6.031   9.699
   13    H    MET   3           HN       MET   3  47.260  10.616   7.684
   14    HA   MET   3           HA       MET   3  46.007  11.034   5.153
   15    HB2  MET   3           HB1      MET   3  48.184  12.521   6.709
   16    HB3  MET   3           HB2      MET   3  47.558  13.109   5.147
   17    HG2  MET   3           HG1      MET   3  45.223  13.313   6.181
   18    HG3  MET   3           HG2      MET   3  45.857  12.654   7.724
   19    HE1  MET   3           HE1      MET   3  46.777  16.828   5.841
   20    HE2  MET   3           HE2      MET   3  47.322  15.286   5.096
   21    HE3  MET   3           HE3      MET   3  45.567  15.650   5.226
   22    H    VAL   4           HN       VAL   4  46.996  11.105   3.066
   23    HA   VAL   4           HA       VAL   4  49.548   9.710   2.879
   24    HB   VAL   4           HB       VAL   4  47.585   8.793   1.691
   25   HG11  VAL   4          HG11      VAL   4  46.872   9.921  -0.459
   26   HG12  VAL   4          HG12      VAL   4  46.417  10.886   0.978
   27   HG13  VAL   4          HG13      VAL   4  47.841  11.369  -0.018
   28   HG21  VAL   4          HG21      VAL   4  48.829   8.396  -0.457
   29   HG22  VAL   4          HG22      VAL   4  50.018   9.660   0.025
   30   HG23  VAL   4          HG23      VAL   4  49.835   8.163   1.007
   31    H    LEU   5           HN       LEU   5  48.126  12.905   2.545
   32    HA   LEU   5           HA       LEU   5  49.965  14.062   0.817
   33    HB2  LEU   5           HB1      LEU   5  48.202  15.201   3.049
   34    HB3  LEU   5           HB2      LEU   5  49.223  16.266   2.054
   35    HG   LEU   5           HG       LEU   5  47.023  16.393   1.347
   36   HD11  LEU   5          HD11      LEU   5  47.137  15.610  -1.138
   37   HD12  LEU   5          HD12      LEU   5  48.585  16.505  -0.548
   38   HD13  LEU   5          HD13      LEU   5  48.635  14.710  -0.706
   39   HD21  LEU   5          HD21      LEU   5  45.615  14.500   0.368
   40   HD22  LEU   5          HD22      LEU   5  46.849  13.323   0.925
   41   HD23  LEU   5          HD23      LEU   5  45.958  14.323   2.128
   42    H    SER   6           HN       SER   6  50.093  13.549   4.330
   43    HA   SER   6           HA       SER   6  52.222  15.346   4.799
   44    HB2  SER   6           HB1      SER   6  52.021  14.462   7.156
   45    HB3  SER   6           HB2      SER   6  50.418  14.929   6.505
   46    HG   SER   6           HG       SER   6  50.622  12.807   7.592
   47    HA   PRO   7           HA       PRO   7  55.697  12.687   4.197
   48    HB2  PRO   7           HB2      PRO   7  57.507  13.119   6.193
   49    HB3  PRO   7           HB1      PRO   7  57.001  14.423   5.046
   50    HG2  PRO   7           HG2      PRO   7  55.866  13.942   7.839
   51    HG3  PRO   7           HG1      PRO   7  56.502  15.491   7.141
   52    HD2  PRO   7           HD2      PRO   7  53.808  14.852   7.067
   53    HD3  PRO   7           HD1      PRO   7  54.627  15.823   5.749
   54    H    ARG   8           HN       ARG   8  53.617  11.974   6.672
   55    HA   ARG   8           HA       ARG   8  54.745   9.479   7.588
   56    HB2  ARG   8           HB1      ARG   8  51.978  10.780   7.785
   57    HB3  ARG   8           HB2      ARG   8  52.357   9.233   8.581
   58    HG2  ARG   8           HG1      ARG   8  54.155  10.407   9.952
   59    HG3  ARG   8           HG2      ARG   8  53.850  11.926   9.089
   60    HD2  ARG   8           HD1      ARG   8  52.752  12.015  11.298
   61    HD3  ARG   8           HD2      ARG   8  51.497  12.069   9.995
   62    HE   ARG   8           HE       ARG   8  51.881   9.366  10.551
   63   HH11  ARG   8          HH11      ARG   8  49.381   9.146  13.144
   64   HH12  ARG   8          HH12      ARG   8  50.183   8.331  11.824
   65   HH21  ARG   8          HH21      ARG   8  49.898  11.455  13.505
   66   HH22  ARG   8          HH22      ARG   8  51.071  12.203  12.475
   67    H    ASP   9           HN       ASP   9  53.887  10.215   4.545
   68    HA   ASP   9           HA       ASP   9  51.714   8.669   3.905
   69    HB2  ASP   9           HB1      ASP   9  52.493   9.006   1.522
   70    HB3  ASP   9           HB2      ASP   9  52.513  10.542   2.454
   71    H    GLU  10           HN       GLU  10  55.210   7.716   3.985
   72    HA   GLU  10           HA       GLU  10  54.909   5.243   2.751
   73    HB2  GLU  10           HB1      GLU  10  57.092   6.374   3.179
   74    HB3  GLU  10           HB2      GLU  10  56.868   6.189   4.933
   75    HG2  GLU  10           HG1      GLU  10  56.987   3.689   4.715
   76    HG3  GLU  10           HG2      GLU  10  57.128   3.820   2.921
   77    H    ARG  11           HN       ARG  11  54.560   6.160   6.220
   78    HA   ARG  11           HA       ARG  11  54.007   3.580   7.202
   79    HB2  ARG  11           HB1      ARG  11  54.644   5.503   8.612
   80    HB3  ARG  11           HB2      ARG  11  53.150   6.371   8.190
   81    HG2  ARG  11           HG1      ARG  11  51.836   4.458   9.321
   82    HG3  ARG  11           HG2      ARG  11  53.380   3.728   9.799
   83    HD2  ARG  11           HD1      ARG  11  54.076   5.735  11.091
   84    HD3  ARG  11           HD2      ARG  11  52.555   6.610  10.645
   85    HE   ARG  11           HE       ARG  11  51.830   4.086  11.697
   86   HH11  ARG  11          HH11      ARG  11  51.402   5.312  15.079
   87   HH12  ARG  11          HH12      ARG  11  50.962   4.093  13.908
   88   HH21  ARG  11          HH21      ARG  11  52.837   7.081  14.359
   89   HH22  ARG  11          HH22      ARG  11  53.413   7.060  12.728
   90    H    THR  12           HN       THR  12  51.756   6.136   5.940
   91    HA   THR  12           HA       THR  12  49.425   4.692   6.393
   92    HB   THR  12           HB       THR  12  50.133   6.751   4.257
   93    HG1  THR  12           HG1      THR  12  49.039   8.152   5.704
   94   HG21  THR  12          HG21      THR  12  47.629   7.201   4.082
   95   HG22  THR  12          HG22      THR  12  47.900   5.451   3.791
   96   HG23  THR  12          HG23      THR  12  47.288   6.011   5.388
   97    H    LEU  13           HN       LEU  13  51.555   4.759   3.443
   98    HA   LEU  13           HA       LEU  13  49.964   3.034   1.951
   99    HB2  LEU  13           HB1      LEU  13  51.686   4.563   1.042
  100    HB3  LEU  13           HB2      LEU  13  52.975   3.672   1.884
  101    HG   LEU  13           HG       LEU  13  51.187   2.236  -0.109
  102   HD11  LEU  13          HD11      LEU  13  52.836   2.953  -1.973
  103   HD12  LEU  13          HD12      LEU  13  51.867   4.321  -1.316
  104   HD13  LEU  13          HD13      LEU  13  53.584   4.106  -0.812
  105   HD21  LEU  13          HD21      LEU  13  53.269   0.939  -0.665
  106   HD22  LEU  13          HD22      LEU  13  54.207   1.900   0.522
  107   HD23  LEU  13          HD23      LEU  13  52.865   0.843   1.087
  108    H    VAL  14           HN       VAL  14  52.764   2.305   4.166
  109    HA   VAL  14           HA       VAL  14  52.794  -0.451   3.756
  110    HB   VAL  14           HB       VAL  14  53.712   1.270   6.057
  111   HG11  VAL  14          HG11      VAL  14  55.042  -0.751   6.819
  112   HG12  VAL  14          HG12      VAL  14  53.280  -1.013   6.994
  113   HG13  VAL  14          HG13      VAL  14  54.173  -1.771   5.620
  114   HG21  VAL  14          HG21      VAL  14  55.991   0.620   4.998
  115   HG22  VAL  14          HG22      VAL  14  55.106  -0.287   3.718
  116   HG23  VAL  14          HG23      VAL  14  54.950   1.502   3.837
  117    H    ARG  15           HN       ARG  15  50.898   1.521   6.131
  118    HA   ARG  15           HA       ARG  15  49.775  -0.619   7.539
  119    HB2  ARG  15           HB1      ARG  15  49.709   1.733   8.276
  120    HB3  ARG  15           HB2      ARG  15  48.688   2.195   6.893
  121    HG2  ARG  15           HG1      ARG  15  47.261   2.080   8.847
  122    HG3  ARG  15           HG2      ARG  15  46.843   0.676   7.848
  123    HD2  ARG  15           HD1      ARG  15  48.106  -0.890   9.228
  124    HD3  ARG  15           HD2      ARG  15  48.779   0.441  10.257
  125    HE   ARG  15           HE       ARG  15  45.944   0.706  10.160
  126   HH11  ARG  15          HH11      ARG  15  45.429  -1.034  13.288
  127   HH12  ARG  15          HH12      ARG  15  44.822   0.169  12.176
  128   HH21  ARG  15          HH21      ARG  15  47.548  -2.026  12.805
  129   HH22  ARG  15          HH22      ARG  15  48.372  -1.546  11.362
  130    H    LYS  16           HN       LYS  16  48.503   0.991   4.498
  131    HA   LYS  16           HA       LYS  16  46.219  -0.592   4.352
  132    HB2  LYS  16           HB1      LYS  16  47.943   0.771   2.213
  133    HB3  LYS  16           HB2      LYS  16  46.418  -0.053   1.792
  134    HG2  LYS  16           HG1      LYS  16  46.638   2.285   3.825
  135    HG3  LYS  16           HG2      LYS  16  46.279   2.515   2.081
  136    HD2  LYS  16           HD1      LYS  16  44.230   1.015   2.391
  137    HD3  LYS  16           HD2      LYS  16  44.595   0.959   4.149
  138    HE2  LYS  16           HE1      LYS  16  44.344   3.467   4.298
  139    HE3  LYS  16           HE2      LYS  16  43.993   3.541   2.530
  140    HZ1  LYS  16           HZ1      LYS  16  41.977   3.509   3.850
  141    HZ2  LYS  16           HZ2      LYS  16  42.086   2.102   2.905
  142    HZ3  LYS  16           HZ3      LYS  16  42.418   2.034   4.565
  143    H    VAL  17           HN       VAL  17  49.514  -1.168   2.983
  144    HA   VAL  17           HA       VAL  17  48.934  -3.559   1.669
  145    HB   VAL  17           HB       VAL  17  51.504  -2.405   2.785
  146   HG11  VAL  17          HG11      VAL  17  52.693  -4.037   1.247
  147   HG12  VAL  17          HG12      VAL  17  51.824  -4.882   2.565
  148   HG13  VAL  17          HG13      VAL  17  51.126  -4.847   0.900
  149   HG21  VAL  17          HG21      VAL  17  51.862  -1.896   0.282
  150   HG22  VAL  17          HG22      VAL  17  50.222  -2.559  -0.058
  151   HG23  VAL  17          HG23      VAL  17  50.411  -1.073   0.939
  152    H    GLN  18           HN       GLN  18  50.140  -3.023   5.119
  153    HA   GLN  18           HA       GLN  18  50.275  -5.743   5.672
  154    HB2  GLN  18           HB1      GLN  18  49.802  -3.309   7.456
  155    HB3  GLN  18           HB2      GLN  18  49.983  -4.944   8.142
  156    HG2  GLN  18           HG1      GLN  18  52.326  -5.095   7.070
  157    HG3  GLN  18           HG2      GLN  18  52.122  -3.429   6.433
  158   HE21  GLN  18          HE21      GLN  18  52.280  -2.016   9.840
  159   HE22  GLN  18          HE22      GLN  18  51.249  -1.884   8.430
  160    H    ILE  19           HN       ILE  19  47.446  -3.435   6.117
  161    HA   ILE  19           HA       ILE  19  45.856  -5.360   7.359
  162    HB   ILE  19           HB       ILE  19  45.282  -2.817   5.876
  163   HG12  ILE  19          HG11      ILE  19  46.467  -2.470   7.979
  164   HG13  ILE  19          HG12      ILE  19  44.782  -1.879   8.138
  165   HG21  ILE  19          HG21      ILE  19  42.896  -2.917   6.737
  166   HG22  ILE  19          HG22      ILE  19  43.214  -4.409   5.796
  167   HG23  ILE  19          HG23      ILE  19  43.228  -4.461   7.598
  168   HD11  ILE  19          HD11      ILE  19  45.471  -3.008  10.204
  169   HD12  ILE  19          HD12      ILE  19  44.171  -3.967   9.408
  170   HD13  ILE  19          HD13      ILE  19  45.886  -4.512   9.310
  171    H    ASN  20           HN       ASN  20  46.035  -4.462   3.758
  172    HA   ASN  20           HA       ASN  20  44.676  -7.025   3.412
  173    HB2  ASN  20           HB1      ASN  20  43.308  -5.043   2.609
  174    HB3  ASN  20           HB2      ASN  20  44.649  -4.555   1.527
  175   HD21  ASN  20          HD21      ASN  20  42.658  -6.434  -0.844
  176   HD22  ASN  20          HD22      ASN  20  42.972  -4.832  -0.222
  177    HA   PRO  21           HA       PRO  21  48.848  -7.624   1.697
  178    HB2  PRO  21           HB2      PRO  21  49.003 -10.351   1.879
  179    HB3  PRO  21           HB1      PRO  21  49.125  -9.275   3.328
  180    HG2  PRO  21           HG2      PRO  21  46.596 -10.686   2.376
  181    HG3  PRO  21           HG1      PRO  21  47.328 -10.690   4.036
  182    HD2  PRO  21           HD2      PRO  21  45.356  -8.887   3.309
  183    HD3  PRO  21           HD1      PRO  21  46.682  -8.468   4.499
  184    H    ARG  22           HN       ARG  22  45.738  -8.551   0.455
  185    HA   ARG  22           HA       ARG  22  46.781  -9.882  -1.899
  186    HB2  ARG  22           HB1      ARG  22  43.971  -8.981  -1.075
  187    HB3  ARG  22           HB2      ARG  22  44.286  -9.875  -2.581
  188    HG2  ARG  22           HG1      ARG  22  44.805 -10.888   0.309
  189    HG3  ARG  22           HG2      ARG  22  43.394 -11.320  -0.673
  190    HD2  ARG  22           HD1      ARG  22  44.892 -12.350  -2.443
  191    HD3  ARG  22           HD2      ARG  22  46.313 -12.121  -1.343
  192    HE   ARG  22           HE       ARG  22  44.300 -13.300   0.213
  193   HH11  ARG  22          HH11      ARG  22  45.182 -16.730  -0.527
  194   HH12  ARG  22          HH12      ARG  22  44.403 -15.634   0.589
  195   HH21  ARG  22          HH21      ARG  22  46.250 -15.787  -2.447
  196   HH22  ARG  22          HH22      ARG  22  46.172 -14.073  -2.672
  197    H    THR  23           HN       THR  23  46.757  -6.629  -1.060
  198    HA   THR  23           HA       THR  23  45.431  -5.577  -3.302
  199    HB   THR  23           HB       THR  23  45.633  -4.436  -1.118
  200    HG1  THR  23           HG1      THR  23  46.104  -2.390  -2.003
  201   HG21  THR  23          HG21      THR  23  47.764  -3.193  -0.554
  202   HG22  THR  23          HG22      THR  23  48.141  -4.940  -0.728
  203   HG23  THR  23          HG23      THR  23  48.555  -3.794  -2.054
  204    H    THR  24           HN       THR  24  46.283  -4.253  -5.039
  205    HA   THR  24           HA       THR  24  48.989  -4.971  -5.860
  206    HB   THR  24           HB       THR  24  48.231  -5.054  -8.204
  207    HG1  THR  24           HG1      THR  24  46.008  -5.259  -8.619
  208   HG21  THR  24          HG21      THR  24  47.048  -7.306  -8.104
  209   HG22  THR  24          HG22      THR  24  48.269  -7.229  -6.790
  210   HG23  THR  24          HG23      THR  24  46.525  -6.987  -6.412
  211    H    ALA  25           HN       ALA  25  49.694  -3.436  -7.763
  212    HA   ALA  25           HA       ALA  25  49.847  -0.835  -6.757
  213    HB1  ALA  25           HB1      ALA  25  51.513  -1.894  -8.291
  214    HB2  ALA  25           HB2      ALA  25  50.309  -1.868  -9.625
  215    HB3  ALA  25           HB3      ALA  25  50.946  -0.320  -8.950
  216    H    LYS  26           HN       LYS  26  47.626  -2.183  -9.162
  217    HA   LYS  26           HA       LYS  26  46.398   0.142 -10.000
  218    HB2  LYS  26           HB1      LYS  26  45.578  -2.776  -9.750
  219    HB3  LYS  26           HB2      LYS  26  44.426  -1.587 -10.411
  220    HG2  LYS  26           HG1      LYS  26  46.039  -0.985 -12.243
  221    HG3  LYS  26           HG2      LYS  26  47.325  -1.983 -11.487
  222    HD2  LYS  26           HD1      LYS  26  46.165  -4.043 -12.036
  223    HD3  LYS  26           HD2      LYS  26  44.646  -3.169 -12.425
  224    HE2  LYS  26           HE1      LYS  26  45.700  -3.902 -14.532
  225    HE3  LYS  26           HE2      LYS  26  45.825  -2.104 -14.433
  226    HZ1  LYS  26           HZ1      LYS  26  47.888  -3.118 -15.120
  227    HZ2  LYS  26           HZ2      LYS  26  48.076  -2.364 -13.611
  228    HZ3  LYS  26           HZ3      LYS  26  47.955  -4.051 -13.705
  229    H    ASP  27           HN       ASP  27  45.588  -1.906  -7.055
  230    HA   ASP  27           HA       ASP  27  43.334  -0.388  -6.417
  231    HB2  ASP  27           HB1      ASP  27  45.322  -2.056  -4.732
  232    HB3  ASP  27           HB2      ASP  27  43.775  -1.424  -4.071
  233    H    LEU  28           HN       LEU  28  46.843  -0.036  -5.466
  234    HA   LEU  28           HA       LEU  28  46.392   2.094  -3.736
  235    HB2  LEU  28           HB1      LEU  28  48.844   1.169  -5.299
  236    HB3  LEU  28           HB2      LEU  28  48.914   2.662  -4.335
  237    HG   LEU  28           HG       LEU  28  48.231   1.288  -2.320
  238   HD11  LEU  28          HD11      LEU  28  48.799  -1.221  -2.369
  239   HD12  LEU  28          HD12      LEU  28  47.356  -0.814  -3.367
  240   HD13  LEU  28          HD13      LEU  28  48.945  -1.123  -4.160
  241   HD21  LEU  28          HD21      LEU  28  50.575   0.373  -1.961
  242   HD22  LEU  28          HD22      LEU  28  50.923   0.606  -3.704
  243   HD23  LEU  28          HD23      LEU  28  50.556   2.030  -2.666
  244    H    VAL  29           HN       VAL  29  47.109   2.125  -7.352
  245    HA   VAL  29           HA       VAL  29  47.703   4.846  -7.375
  246    HB   VAL  29           HB       VAL  29  48.430   3.262  -9.098
  247   HG11  VAL  29          HG11      VAL  29  46.914   2.853 -11.065
  248   HG12  VAL  29          HG12      VAL  29  46.337   2.006  -9.598
  249   HG13  VAL  29          HG13      VAL  29  45.526   3.525 -10.138
  250   HG21  VAL  29          HG21      VAL  29  48.179   4.950 -10.968
  251   HG22  VAL  29          HG22      VAL  29  46.970   5.839  -9.970
  252   HG23  VAL  29          HG23      VAL  29  48.675   5.688  -9.412
  253    H    LYS  30           HN       LYS  30  44.499   3.159  -7.853
  254    HA   LYS  30           HA       LYS  30  43.176   5.433  -8.781
  255    HB2  LYS  30           HB1      LYS  30  42.346   3.110  -9.038
  256    HB3  LYS  30           HB2      LYS  30  42.134   2.961  -7.274
  257    HG2  LYS  30           HG1      LYS  30  40.365   4.770  -7.331
  258    HG3  LYS  30           HG2      LYS  30  40.644   5.003  -9.088
  259    HD2  LYS  30           HD1      LYS  30  38.670   3.669  -8.932
  260    HD3  LYS  30           HD2      LYS  30  39.974   2.518  -9.382
  261    HE2  LYS  30           HE1      LYS  30  40.157   1.774  -6.975
  262    HE3  LYS  30           HE2      LYS  30  38.834   2.918  -6.527
  263    HZ1  LYS  30           HZ1      LYS  30  38.004   0.688  -6.922
  264    HZ2  LYS  30           HZ2      LYS  30  37.385   1.764  -8.081
  265    HZ3  LYS  30           HZ3      LYS  30  38.628   0.691  -8.501
  266    H    MET  31           HN       MET  31  43.511   4.143  -5.405
  267    HA   MET  31           HA       MET  31  42.043   6.142  -4.157
  268    HB2  MET  31           HB1      MET  31  42.652   3.956  -3.153
  269    HB3  MET  31           HB2      MET  31  44.391   4.337  -3.251
  270    HG2  MET  31           HG1      MET  31  42.507   6.074  -1.524
  271    HG3  MET  31           HG2      MET  31  43.110   4.496  -0.923
  272    HE1  MET  31           HE1      MET  31  47.008   5.086  -0.730
  273    HE2  MET  31           HE2      MET  31  45.663   3.923  -0.471
  274    HE3  MET  31           HE3      MET  31  46.112   4.424  -2.137
  275    H    LEU  32           HN       LEU  32  45.560   5.947  -4.902
  276    HA   LEU  32           HA       LEU  32  46.274   8.229  -3.465
  277    HB2  LEU  32           HB1      LEU  32  47.713   6.252  -4.093
  278    HB3  LEU  32           HB2      LEU  32  47.579   6.692  -5.812
  279    HG   LEU  32           HG       LEU  32  48.735   8.916  -5.177
  280   HD11  LEU  32          HD11      LEU  32  50.213   8.777  -3.087
  281   HD12  LEU  32          HD12      LEU  32  48.456   8.823  -2.693
  282   HD13  LEU  32          HD13      LEU  32  49.359   7.266  -2.613
  283   HD21  LEU  32          HD21      LEU  32  51.014   7.852  -5.258
  284   HD22  LEU  32          HD22      LEU  32  50.296   6.251  -4.892
  285   HD23  LEU  32          HD23      LEU  32  49.868   7.094  -6.424
  286    H    GLU  33           HN       GLU  33  45.591   7.724  -6.988
  287    HA   GLU  33           HA       GLU  33  46.030  10.359  -7.805
  288    HB2  GLU  33           HB1      GLU  33  46.047   8.382  -9.325
  289    HB3  GLU  33           HB2      GLU  33  44.316   8.108  -9.027
  290    HG2  GLU  33           HG1      GLU  33  44.618   9.164 -11.222
  291    HG3  GLU  33           HG2      GLU  33  43.824  10.380 -10.150
  292    H    GLU  34           HN       GLU  34  42.933   8.690  -6.776
  293    HA   GLU  34           HA       GLU  34  41.263  10.859  -7.327
  294    HB2  GLU  34           HB1      GLU  34  40.538   8.476  -6.991
  295    HB3  GLU  34           HB2      GLU  34  40.946   8.598  -5.265
  296    HG2  GLU  34           HG1      GLU  34  38.892  10.523  -6.493
  297    HG3  GLU  34           HG2      GLU  34  38.413   8.849  -6.017
  298    H    THR  35           HN       THR  35  43.080   9.966  -4.313
  299    HA   THR  35           HA       THR  35  42.147  12.105  -2.791
  300    HB   THR  35           HB       THR  35  44.811  10.640  -2.715
  301    HG1  THR  35           HG1      THR  35  43.810   9.530  -0.984
  302   HG21  THR  35          HG21      THR  35  44.933  11.473  -0.282
  303   HG22  THR  35          HG22      THR  35  44.692  12.902  -1.343
  304   HG23  THR  35          HG23      THR  35  43.301  12.218  -0.428
  305    H    GLY  36           HN       GLY  36  45.047  11.863  -4.958
  306    HA2  GLY  36           HA2      GLY  36  45.209  13.715  -6.458
  307    HA3  GLY  36           HA1      GLY  36  44.962  14.790  -5.016
  308    H    THR  37           HN       THR  37  47.105  11.891  -5.121
  309    HA   THR  37           HA       THR  37  49.365  13.737  -4.856
  310    HB   THR  37           HB       THR  37  48.892  10.976  -3.636
  311    HG1  THR  37           HG1      THR  37  49.021  12.139  -1.668
  312   HG21  THR  37          HG21      THR  37  51.091  11.323  -2.400
  313   HG22  THR  37          HG22      THR  37  51.399  11.532  -4.157
  314   HG23  THR  37          HG23      THR  37  51.259  12.977  -3.092
  315    H    LYS  38           HN       LYS  38  51.073  13.459  -6.336
  316    HA   LYS  38           HA       LYS  38  50.727  11.187  -8.138
  317    HB2  LYS  38           HB1      LYS  38  52.527  13.683  -8.282
  318    HB3  LYS  38           HB2      LYS  38  52.451  12.442  -9.559
  319    HG2  LYS  38           HG1      LYS  38  50.110  14.279  -8.664
  320    HG3  LYS  38           HG2      LYS  38  51.131  14.534 -10.118
  321    HD2  LYS  38           HD1      LYS  38  49.232  12.160  -9.605
  322    HD3  LYS  38           HD2      LYS  38  48.880  13.598 -10.624
  323    HE2  LYS  38           HE1      LYS  38  50.893  12.941 -12.103
  324    HE3  LYS  38           HE2      LYS  38  50.996  11.404 -11.162
  325    HZ1  LYS  38           HZ1      LYS  38  49.653  11.159 -13.148
  326    HZ2  LYS  38           HZ2      LYS  38  48.699  10.949 -11.760
  327    HZ3  LYS  38           HZ3      LYS  38  48.605  12.394 -12.642
  328    H    VAL  39           HN       VAL  39  51.855   9.328  -7.569
  329    HA   VAL  39           HA       VAL  39  54.730   9.692  -7.061
  330    HB   VAL  39           HB       VAL  39  52.968   7.534  -5.809
  331   HG11  VAL  39          HG11      VAL  39  55.114   6.919  -4.581
  332   HG12  VAL  39          HG12      VAL  39  55.281   6.717  -6.351
  333   HG13  VAL  39          HG13      VAL  39  56.006   8.155  -5.536
  334   HG21  VAL  39          HG21      VAL  39  53.592   8.624  -3.588
  335   HG22  VAL  39          HG22      VAL  39  54.358   9.979  -4.494
  336   HG23  VAL  39          HG23      VAL  39  52.585   9.691  -4.617
  337    H    SER  40           HN       SER  40  55.955   8.474  -8.595
  338    HA   SER  40           HA       SER  40  54.553   7.173 -10.623
  339    HB2  SER  40           HB1      SER  40  57.513   6.980  -9.765
  340    HB3  SER  40           HB2      SER  40  56.905   6.325 -11.318
  341    HG   SER  40           HG       SER  40  57.854   8.531 -11.315
  342    H    ILE  41           HN       ILE  41  54.298   4.951 -11.186
  343    HA   ILE  41           HA       ILE  41  53.755   3.297  -9.010
  344    HB   ILE  41           HB       ILE  41  53.875   2.805 -11.968
  345   HG12  ILE  41          HG11      ILE  41  52.184   4.445 -11.429
  346   HG13  ILE  41          HG12      ILE  41  51.353   2.907 -11.821
  347   HG21  ILE  41          HG21      ILE  41  52.536   0.667 -11.520
  348   HG22  ILE  41          HG22      ILE  41  54.030   0.591 -10.533
  349   HG23  ILE  41          HG23      ILE  41  52.465   1.038  -9.762
  350   HD11  ILE  41          HD11      ILE  41  50.245   3.994  -9.920
  351   HD12  ILE  41          HD12      ILE  41  51.013   2.464  -9.363
  352   HD13  ILE  41          HD13      ILE  41  51.780   4.052  -8.987
  353    H    SER  42           HN       SER  42  56.589   3.465 -11.167
  354    HA   SER  42           HA       SER  42  57.530   0.910 -10.823
  355    HB2  SER  42           HB1      SER  42  59.087   3.562 -11.237
  356    HB3  SER  42           HB2      SER  42  59.816   1.952 -11.537
  357    HG   SER  42           HG       SER  42  58.880   3.138 -13.406
  358    H    THR  43           HN       THR  43  58.335   3.868  -8.816
  359    HA   THR  43           HA       THR  43  60.095   2.361  -7.205
  360    HB   THR  43           HB       THR  43  60.401   4.715  -7.526
  361    HG1  THR  43           HG1      THR  43  60.615   5.314  -5.345
  362   HG21  THR  43          HG21      THR  43  58.880   6.412  -6.463
  363   HG22  THR  43          HG22      THR  43  57.933   5.391  -7.597
  364   HG23  THR  43          HG23      THR  43  57.816   5.109  -5.823
  365    H    VAL  44           HN       VAL  44  56.551   3.012  -7.001
  366    HA   VAL  44           HA       VAL  44  56.218   2.215  -4.346
  367    HB   VAL  44           HB       VAL  44  54.328   2.181  -6.722
  368   HG11  VAL  44          HG11      VAL  44  52.464   2.046  -5.005
  369   HG12  VAL  44          HG12      VAL  44  53.455   0.556  -5.024
  370   HG13  VAL  44          HG13      VAL  44  53.682   1.772  -3.710
  371   HG21  VAL  44          HG21      VAL  44  53.429   4.276  -5.532
  372   HG22  VAL  44          HG22      VAL  44  54.748   4.116  -4.315
  373   HG23  VAL  44          HG23      VAL  44  55.138   4.463  -6.037
  374    H    LYS  45           HN       LYS  45  56.062   0.194  -7.438
  375    HA   LYS  45           HA       LYS  45  55.354  -2.132  -6.078
  376    HB2  LYS  45           HB1      LYS  45  56.098  -3.386  -8.040
  377    HB3  LYS  45           HB2      LYS  45  55.093  -1.994  -8.518
  378    HG2  LYS  45           HG1      LYS  45  57.105  -0.734  -9.249
  379    HG3  LYS  45           HG2      LYS  45  58.191  -1.985  -8.559
  380    HD2  LYS  45           HD1      LYS  45  58.271  -2.433 -10.840
  381    HD3  LYS  45           HD2      LYS  45  57.037  -3.607 -10.268
  382    HE2  LYS  45           HE1      LYS  45  55.215  -2.306 -11.199
  383    HE3  LYS  45           HE2      LYS  45  56.282  -0.881 -11.491
  384    HZ1  LYS  45           HZ1      LYS  45  55.973  -2.205 -13.503
  385    HZ2  LYS  45           HZ2      LYS  45  57.597  -2.246 -13.008
  386    HZ3  LYS  45           HZ3      LYS  45  56.594  -3.584 -12.731
  387    H    ARG  46           HN       ARG  46  58.569  -0.734  -6.708
  388    HA   ARG  46           HA       ARG  46  60.122  -2.893  -5.775
  389    HB2  ARG  46           HB1      ARG  46  60.641   0.081  -6.038
  390    HB3  ARG  46           HB2      ARG  46  61.907  -1.038  -5.478
  391    HG2  ARG  46           HG1      ARG  46  61.564  -2.404  -7.648
  392    HG3  ARG  46           HG2      ARG  46  60.320  -1.253  -8.167
  393    HD2  ARG  46           HD1      ARG  46  62.033   0.635  -8.121
  394    HD3  ARG  46           HD2      ARG  46  63.330  -0.609  -7.890
  395    HE   ARG  46           HE       ARG  46  61.635  -0.217 -10.283
  396   HH11  ARG  46          HH11      ARG  46  64.579  -3.096  -9.967
  397   HH12  ARG  46          HH12      ARG  46  64.095  -2.109  -8.608
  398   HH21  ARG  46          HH21      ARG  46  63.481  -2.742 -12.049
  399   HH22  ARG  46          HH22      ARG  46  62.222  -1.558 -12.128
  400    H    VAL  47           HN       VAL  47  58.744  -0.025  -3.965
  401    HA   VAL  47           HA       VAL  47  59.909  -0.673  -1.521
  402    HB   VAL  47           HB       VAL  47  57.317   0.740  -2.251
  403   HG11  VAL  47          HG11      VAL  47  57.308   1.649   0.119
  404   HG12  VAL  47          HG12      VAL  47  57.028  -0.118   0.087
  405   HG13  VAL  47          HG13      VAL  47  58.647   0.530   0.550
  406   HG21  VAL  47          HG21      VAL  47  58.725   2.787  -1.561
  407   HG22  VAL  47          HG22      VAL  47  60.130   1.693  -1.287
  408   HG23  VAL  47          HG23      VAL  47  59.449   1.903  -2.941
  409    H    LEU  48           HN       LEU  48  56.633  -1.795  -2.883
  410    HA   LEU  48           HA       LEU  48  56.110  -3.337  -0.631
  411    HB2  LEU  48           HB1      LEU  48  55.122  -3.479  -3.496
  412    HB3  LEU  48           HB2      LEU  48  54.650  -4.735  -2.326
  413    HG   LEU  48           HG       LEU  48  53.848  -2.792  -0.823
  414   HD11  LEU  48          HD11      LEU  48  52.982  -0.725  -2.081
  415   HD12  LEU  48          HD12      LEU  48  54.780  -0.804  -2.020
  416   HD13  LEU  48          HD13      LEU  48  53.908  -1.256  -3.530
  417   HD21  LEU  48          HD21      LEU  48  51.602  -2.724  -2.014
  418   HD22  LEU  48          HD22      LEU  48  52.363  -3.448  -3.467
  419   HD23  LEU  48          HD23      LEU  48  52.316  -4.374  -1.924
  420    H    TYR  49           HN       TYR  49  57.845  -4.255  -3.723
  421    HA   TYR  49           HA       TYR  49  58.104  -6.942  -3.065
  422    HB2  TYR  49           HB1      TYR  49  58.427  -6.007  -5.373
  423    HB3  TYR  49           HB2      TYR  49  59.847  -5.065  -4.827
  424    HD1  TYR  49           HD1      TYR  49  58.500  -8.565  -5.163
  425    HD2  TYR  49           HD2      TYR  49  62.013  -6.091  -4.936
  426    HE1  TYR  49           HE1      TYR  49  59.919 -10.504  -5.798
  427    HE2  TYR  49           HE2      TYR  49  63.414  -8.023  -5.581
  428    HH   TYR  49           HH       TYR  49  63.444 -10.182  -6.214
  429    H    ARG  50           HN       ARG  50  60.356  -4.192  -2.411
  430    HA   ARG  50           HA       ARG  50  62.339  -5.703  -1.120
  431    HB2  ARG  50           HB1      ARG  50  62.664  -3.421  -1.999
  432    HB3  ARG  50           HB2      ARG  50  61.495  -2.751  -0.835
  433    HG2  ARG  50           HG1      ARG  50  63.076  -3.474   1.051
  434    HG3  ARG  50           HG2      ARG  50  64.223  -4.070  -0.163
  435    HD2  ARG  50           HD1      ARG  50  63.271  -1.132  -0.133
  436    HD3  ARG  50           HD2      ARG  50  64.812  -1.688   0.639
  437    HE   ARG  50           HE       ARG  50  65.072  -2.784  -1.803
  438   HH11  ARG  50          HH11      ARG  50  65.889   0.047  -3.873
  439   HH12  ARG  50          HH12      ARG  50  66.060  -1.673  -3.619
  440   HH21  ARG  50          HH21      ARG  50  64.700   1.301  -2.229
  441   HH22  ARG  50          HH22      ARG  50  64.023   0.456  -0.879
  442    H    HIS  51           HN       HIS  51  59.455  -3.995   0.300
  443    HA   HIS  51           HA       HIS  51  60.102  -4.702   2.948
  444    HB2  HIS  51           HB1      HIS  51  58.568  -2.795   2.160
  445    HB3  HIS  51           HB2      HIS  51  57.320  -4.036   1.858
  446    HD1  HIS  51           HD1      HIS  51  56.700  -5.515   4.246
  447    HD2  HIS  51           HD2      HIS  51  58.685  -1.847   4.716
  448    HE1  HIS  51           HE1      HIS  51  56.411  -4.746   6.680
  449    H    ASN  52           HN       ASN  52  58.113  -6.435   0.412
  450    HA   ASN  52           HA       ASN  52  57.270  -8.438   2.144
  451    HB2  ASN  52           HB1      ASN  52  56.338  -7.973  -0.152
  452    HB3  ASN  52           HB2      ASN  52  57.875  -8.500  -0.905
  453   HD21  ASN  52          HD21      ASN  52  55.199 -11.282   0.663
  454   HD22  ASN  52          HD22      ASN  52  55.178  -9.639   1.256
  455    H    LEU  53           HN       LEU  53  60.316  -8.220   0.124
  456    HA   LEU  53           HA       LEU  53  61.280 -10.720   0.894
  457    HB2  LEU  53           HB1      LEU  53  61.946  -9.472  -1.145
  458    HB3  LEU  53           HB2      LEU  53  62.650  -8.167  -0.163
  459    HG   LEU  53           HG       LEU  53  64.150  -9.657  -1.360
  460   HD11  LEU  53          HD11      LEU  53  65.896 -10.010   0.536
  461   HD12  LEU  53          HD12      LEU  53  65.167  -8.364   0.469
  462   HD13  LEU  53          HD13      LEU  53  64.612  -9.548   1.709
  463   HD21  LEU  53          HD21      LEU  53  64.787 -11.946  -0.384
  464   HD22  LEU  53          HD22      LEU  53  63.355 -11.845   0.689
  465   HD23  LEU  53          HD23      LEU  53  63.136 -11.864  -1.097
  466    H    LYS  54           HN       LYS  54  61.900  -7.425   2.295
  467    HA   LYS  54           HA       LYS  54  63.248  -8.745   4.551
  468    HB2  LYS  54           HB1      LYS  54  64.716  -7.199   3.140
  469    HB3  LYS  54           HB2      LYS  54  63.539  -5.881   3.380
  470    HG2  LYS  54           HG1      LYS  54  64.026  -6.224   5.973
  471    HG3  LYS  54           HG2      LYS  54  65.445  -7.180   5.430
  472    HD2  LYS  54           HD1      LYS  54  64.834  -4.262   4.593
  473    HD3  LYS  54           HD2      LYS  54  65.916  -4.724   5.951
  474    HE2  LYS  54           HE1      LYS  54  67.561  -5.691   4.453
  475    HE3  LYS  54           HE2      LYS  54  66.425  -5.636   3.051
  476    HZ1  LYS  54           HZ1      LYS  54  67.976  -3.777   3.034
  477    HZ2  LYS  54           HZ2      LYS  54  66.385  -3.222   3.251
  478    HZ3  LYS  54           HZ3      LYS  54  67.450  -3.277   4.569
  479    H    GLY  55           HN       GLY  55  62.101  -8.669   6.464
  480    HA2  GLY  55           HA2      GLY  55  59.647  -7.199   6.449
  481    HA3  GLY  55           HA1      GLY  55  60.311  -8.300   7.732
  482    H    ARG  56           HN       ARG  56  60.497  -5.090   6.330
  483    HA   ARG  56           HA       ARG  56  61.286  -3.069   6.966
  484    HB2  ARG  56           HB1      ARG  56  59.287  -3.466   8.506
  485    HB3  ARG  56           HB2      ARG  56  60.434  -3.899   9.796
  486    HG2  ARG  56           HG1      ARG  56  61.494  -1.488   9.249
  487    HG3  ARG  56           HG2      ARG  56  59.953  -1.178   8.429
  488    HD2  ARG  56           HD1      ARG  56  58.644  -1.827  10.493
  489    HD3  ARG  56           HD2      ARG  56  60.190  -2.013  11.419
  490    HE   ARG  56           HE       ARG  56  59.045   0.508  10.356
  491   HH11  ARG  56          HH11      ARG  56  61.270   2.363  12.478
  492   HH12  ARG  56          HH12      ARG  56  59.931   2.419  11.356
  493   HH21  ARG  56          HH21      ARG  56  62.258   0.251  12.931
  494   HH22  ARG  56          HH22      ARG  56  61.597  -1.155  12.171
  495    H    SER  57           HN       SER  57  62.458  -2.832  10.020
  496    HA   SER  57           HA       SER  57  64.349  -4.957  10.097
  497    HB2  SER  57           HB1      SER  57  65.649  -3.219   8.721
  498    HB3  SER  57           HB2      SER  57  65.358  -2.015  10.015
  499    HG   SER  57           HG       SER  57  67.422  -3.230  10.047
  500    H    ALA  58           HN       ALA  58  64.885  -5.266  12.320
  501    HA   ALA  58           HA       ALA  58  64.601  -5.171  14.531
  502    HB1  ALA  58           HB1      ALA  58  66.146  -3.287  14.187
  503    HB2  ALA  58           HB2      ALA  58  64.755  -2.152  14.104
  504    HB3  ALA  58           HB3      ALA  58  65.106  -3.043  15.634
  505    H    ARG  59           HN       ARG  59  62.183  -5.876  13.745
  506    HA   ARG  59           HA       ARG  59  60.094  -4.102  14.275
  507    HB2  ARG  59           HB1      ARG  59  60.285  -7.138  14.214
  508    HB3  ARG  59           HB2      ARG  59  58.734  -6.354  14.594
  509    HG2  ARG  59           HG1      ARG  59  60.370  -5.920  11.999
  510    HG3  ARG  59           HG2      ARG  59  59.063  -7.108  12.151
  511    HD2  ARG  59           HD1      ARG  59  57.589  -5.052  13.069
  512    HD3  ARG  59           HD2      ARG  59  58.768  -4.042  12.137
  513    HE   ARG  59           HE       ARG  59  58.215  -5.959  10.328
  514   HH11  ARG  59          HH11      ARG  59  54.824  -3.783  11.290
  515   HH12  ARG  59          HH12      ARG  59  56.220  -3.854  12.338
  516   HH21  ARG  59          HH21      ARG  59  54.849  -5.058   9.310
  517   HH22  ARG  59          HH22      ARG  59  56.255  -5.992   8.932
  518    H    LYS  60           HN       LYS  60  58.983  -3.429  16.008
  519    HA   LYS  60           HA       LYS  60  58.750  -5.311  18.274
  520    HB2  LYS  60           HB1      LYS  60  58.222  -2.275  18.108
  521    HB3  LYS  60           HB2      LYS  60  57.784  -3.276  19.516
  522    HG2  LYS  60           HG1      LYS  60  60.257  -3.787  19.884
  523    HG3  LYS  60           HG2      LYS  60  60.663  -2.772  18.461
  524    HD2  LYS  60           HD1      LYS  60  59.747  -0.758  19.583
  525    HD3  LYS  60           HD2      LYS  60  59.108  -1.754  20.934
  526    HE2  LYS  60           HE1      LYS  60  62.125  -1.493  20.299
  527    HE3  LYS  60           HE2      LYS  60  61.249  -0.458  21.492
  528    HZ1  LYS  60           HZ1      LYS  60  62.285  -2.365  22.537
  529    HZ2  LYS  60           HZ2      LYS  60  60.595  -2.465  22.666
  530    HZ3  LYS  60           HZ3      LYS  60  61.418  -3.434  21.544
  531    H    LEU  61           HN       LEU  61  56.630  -6.171  18.512
  532    HA   LEU  61           HA       LEU  61  55.059  -5.965  16.214
  533    HB2  LEU  61           HB1      LEU  61  55.274  -7.998  17.650
  534    HB3  LEU  61           HB2      LEU  61  54.485  -7.150  19.001
  535    HG   LEU  61           HG       LEU  61  52.419  -6.899  17.491
  536   HD11  LEU  61          HD11      LEU  61  52.210  -8.591  15.581
  537   HD12  LEU  61          HD12      LEU  61  53.438  -7.313  15.257
  538   HD13  LEU  61          HD13      LEU  61  53.963  -8.963  15.755
  539   HD21  LEU  61          HD21      LEU  61  51.654  -9.261  17.937
  540   HD22  LEU  61          HD22      LEU  61  53.346  -9.754  18.268
  541   HD23  LEU  61          HD23      LEU  61  52.541  -8.546  19.333
  542    H    GLU  62           HN       GLU  62  54.643  -4.566  19.539
  543    HA   GLU  62           HA       GLU  62  52.118  -3.461  19.034
  544    HB2  GLU  62           HB1      GLU  62  54.284  -2.850  21.108
  545    HB3  GLU  62           HB2      GLU  62  52.689  -2.064  21.136
  546    HG2  GLU  62           HG1      GLU  62  51.568  -4.321  21.390
  547    HG3  GLU  62           HG2      GLU  62  53.174  -5.144  21.335
  Start of MODEL    8
    1    H1   ALA   1           HT1      ALA   1  61.947   7.666  12.969
    2    H2   ALA   1           HT2      ALA   1  62.782   6.767  11.797
    3    H3   ALA   1           HT3      ALA   1  61.150   7.171  11.555
    4    HA   ALA   1           HA       ALA   1  61.698   9.507  11.434
    5    HB1  ALA   1           HB1      ALA   1  63.572   9.346  13.062
    6    HB2  ALA   1           HB2      ALA   1  64.583   8.510  11.833
    7    HB3  ALA   1           HB3      ALA   1  64.092  10.230  11.584
    8    H    SER   2           HN       SER   2  64.070   7.177   9.911
    9    HA   SER   2           HA       SER   2  64.377   8.718   7.632
   10    HB2  SER   2           HB1      SER   2  66.054   7.034   8.423
   11    HB3  SER   2           HB2      SER   2  64.896   5.695   8.151
   12    HG   SER   2           HG       SER   2  66.557   6.103   6.493
   13    H    MET   3           HN       MET   3  62.219   5.892   8.218
   14    HA   MET   3           HA       MET   3  61.321   5.683   5.601
   15    HB2  MET   3           HB1      MET   3  59.574   4.221   6.499
   16    HB3  MET   3           HB2      MET   3  61.168   3.796   7.176
   17    HG2  MET   3           HG1      MET   3  60.532   5.081   9.320
   18    HG3  MET   3           HG2      MET   3  58.923   5.408   8.597
   19    HE1  MET   3           HE1      MET   3  57.150   2.012   8.454
   20    HE2  MET   3           HE2      MET   3  57.023   3.800   8.327
   21    HE3  MET   3           HE3      MET   3  58.015   2.883   7.142
   22    H    VAL   4           HN       VAL   4  60.431   8.120   7.967
   23    HA   VAL   4           HA       VAL   4  57.659   8.083   7.588
   24    HB   VAL   4           HB       VAL   4  59.523  10.162   8.766
   25   HG11  VAL   4          HG11      VAL   4  57.440  11.128   9.857
   26   HG12  VAL   4          HG12      VAL   4  57.407  11.323   8.080
   27   HG13  VAL   4          HG13      VAL   4  56.418  10.034   8.863
   28   HG21  VAL   4          HG21      VAL   4  58.573   9.184  10.947
   29   HG22  VAL   4          HG22      VAL   4  57.665   7.969   9.975
   30   HG23  VAL   4          HG23      VAL   4  59.466   7.962   9.986
   31    H    LEU   5           HN       LEU   5  60.166  10.407   6.261
   32    HA   LEU   5           HA       LEU   5  60.172  11.662   4.498
   33    HB2  LEU   5           HB1      LEU   5  58.468   9.380   3.461
   34    HB3  LEU   5           HB2      LEU   5  59.140  10.632   2.390
   35    HG   LEU   5           HG       LEU   5  60.874   9.014   4.365
   36   HD11  LEU   5          HD11      LEU   5  61.494   7.506   2.384
   37   HD12  LEU   5          HD12      LEU   5  59.768   7.348   2.874
   38   HD13  LEU   5          HD13      LEU   5  60.207   8.305   1.411
   39   HD21  LEU   5          HD21      LEU   5  62.762   9.603   2.802
   40   HD22  LEU   5          HD22      LEU   5  61.634  10.534   1.766
   41   HD23  LEU   5          HD23      LEU   5  61.943  11.067   3.458
   42    H    SER   6           HN       SER   6  57.319  11.272   2.656
   43    HA   SER   6           HA       SER   6  56.100  13.574   3.957
   44    HB2  SER   6           HB1      SER   6  55.550  12.134   1.272
   45    HB3  SER   6           HB2      SER   6  54.558  13.511   1.844
   46    HG   SER   6           HG       SER   6  56.375  13.973   0.343
   47    HA   PRO   7           HA       PRO   7  53.931  10.262   5.882
   48    HB2  PRO   7           HB2      PRO   7  52.424  11.538   7.769
   49    HB3  PRO   7           HB1      PRO   7  54.231  11.488   7.829
   50    HG2  PRO   7           HG2      PRO   7  52.596  13.787   6.699
   51    HG3  PRO   7           HG1      PRO   7  53.927  13.848   7.929
   52    HD2  PRO   7           HD2      PRO   7  54.416  14.208   5.224
   53    HD3  PRO   7           HD1      PRO   7  55.626  13.418   6.348
   54    H    ARG   8           HN       ARG   8  52.228  12.769   4.145
   55    HA   ARG   8           HA       ARG   8  49.578  11.947   4.506
   56    HB2  ARG   8           HB1      ARG   8  49.079  13.369   2.571
   57    HB3  ARG   8           HB2      ARG   8  50.116  14.208   3.749
   58    HG2  ARG   8           HG1      ARG   8  52.131  13.508   2.214
   59    HG3  ARG   8           HG2      ARG   8  50.931  12.964   1.026
   60    HD2  ARG   8           HD1      ARG   8  49.914  15.212   0.833
   61    HD3  ARG   8           HD2      ARG   8  51.058  15.888   2.064
   62    HE   ARG   8           HE       ARG   8  51.686  15.073  -0.696
   63   HH11  ARG   8          HH11      ARG   8  55.146  15.995  -0.234
   64   HH12  ARG   8          HH12      ARG   8  53.984  15.212  -1.276
   65   HH21  ARG   8          HH21      ARG   8  54.433  16.657   1.933
   66   HH22  ARG   8          HH22      ARG   8  52.786  16.378   2.386
   67    H    ASP   9           HN       ASP   9  51.937  10.942   1.861
   68    HA   ASP   9           HA       ASP   9  49.975   8.990   1.062
   69    HB2  ASP   9           HB1      ASP   9  51.631   8.476  -0.773
   70    HB3  ASP   9           HB2      ASP   9  51.107  10.195  -0.792
   71    H    GLU  10           HN       GLU  10  53.117   9.205   2.865
   72    HA   GLU  10           HA       GLU  10  53.799   6.529   2.521
   73    HB2  GLU  10           HB1      GLU  10  55.375   8.379   3.104
   74    HB3  GLU  10           HB2      GLU  10  54.617   8.535   4.704
   75    HG2  GLU  10           HG1      GLU  10  56.693   7.301   4.971
   76    HG3  GLU  10           HG2      GLU  10  55.375   6.089   5.191
   77    H    ARG  11           HN       ARG  11  52.007   8.120   5.290
   78    HA   ARG  11           HA       ARG  11  51.929   5.794   6.876
   79    HB2  ARG  11           HB1      ARG  11  51.470   8.034   7.768
   80    HB3  ARG  11           HB2      ARG  11  50.028   8.212   6.741
   81    HG2  ARG  11           HG1      ARG  11  48.992   6.208   7.990
   82    HG3  ARG  11           HG2      ARG  11  50.433   6.131   9.020
   83    HD2  ARG  11           HD1      ARG  11  48.775   8.716   8.864
   84    HD3  ARG  11           HD2      ARG  11  48.425   7.417  10.077
   85    HE   ARG  11           HE       ARG  11  50.762   9.195   9.990
   86   HH11  ARG  11          HH11      ARG  11  51.889   7.841  13.139
   87   HH12  ARG  11          HH12      ARG  11  52.120   9.060  11.908
   88   HH21  ARG  11          HH21      ARG  11  50.183   6.212  12.787
   89   HH22  ARG  11          HH22      ARG  11  49.219   6.325  11.355
   90    H    THR  12           HN       THR  12  49.611   7.025   4.419
   91    HA   THR  12           HA       THR  12  47.701   5.033   4.774
   92    HB   THR  12           HB       THR  12  48.475   6.699   2.338
   93    HG1  THR  12           HG1      THR  12  46.710   7.983   3.039
   94   HG21  THR  12          HG21      THR  12  46.085   6.305   1.524
   95   HG22  THR  12          HG22      THR  12  46.835   4.703   1.833
   96   HG23  THR  12          HG23      THR  12  45.687   5.402   3.030
   97    H    LEU  13           HN       LEU  13  50.528   5.194   2.474
   98    HA   LEU  13           HA       LEU  13  49.978   2.755   1.261
   99    HB2  LEU  13           HB1      LEU  13  51.454   4.506   0.319
  100    HB3  LEU  13           HB2      LEU  13  52.601   4.319   1.667
  101    HG   LEU  13           HG       LEU  13  51.939   1.930  -0.086
  102   HD11  LEU  13          HD11      LEU  13  53.827   2.673  -1.700
  103   HD12  LEU  13          HD12      LEU  13  52.383   3.749  -1.748
  104   HD13  LEU  13          HD13      LEU  13  53.863   4.263  -0.858
  105   HD21  LEU  13          HD21      LEU  13  54.362   1.324   0.249
  106   HD22  LEU  13          HD22      LEU  13  54.615   2.806   1.225
  107   HD23  LEU  13          HD23      LEU  13  53.494   1.526   1.814
  108    H    VAL  14           HN       VAL  14  52.077   3.504   4.164
  109    HA   VAL  14           HA       VAL  14  52.987   0.892   4.510
  110    HB   VAL  14           HB       VAL  14  52.711   3.217   6.415
  111   HG11  VAL  14          HG11      VAL  14  54.268   1.933   7.951
  112   HG12  VAL  14          HG12      VAL  14  52.672   1.137   7.811
  113   HG13  VAL  14          HG13      VAL  14  54.090   0.477   6.909
  114   HG21  VAL  14          HG21      VAL  14  55.284   3.176   6.068
  115   HG22  VAL  14          HG22      VAL  14  55.078   1.803   4.920
  116   HG23  VAL  14          HG23      VAL  14  54.411   3.428   4.523
  117    H    ARG  15           HN       ARG  15  50.052   2.547   5.941
  118    HA   ARG  15           HA       ARG  15  49.343   0.357   7.551
  119    HB2  ARG  15           HB1      ARG  15  48.440   2.637   7.834
  120    HB3  ARG  15           HB2      ARG  15  47.571   2.527   6.285
  121    HG2  ARG  15           HG1      ARG  15  46.248   0.540   7.222
  122    HG3  ARG  15           HG2      ARG  15  47.149   0.655   8.744
  123    HD2  ARG  15           HD1      ARG  15  45.063   1.689   9.219
  124    HD3  ARG  15           HD2      ARG  15  46.225   3.069   9.057
  125    HE   ARG  15           HE       ARG  15  45.407   2.914   6.534
  126   HH11  ARG  15          HH11      ARG  15  42.039   3.335   8.892
  127   HH12  ARG  15          HH12      ARG  15  43.479   2.521   9.453
  128   HH21  ARG  15          HH21      ARG  15  42.051   4.223   6.680
  129   HH22  ARG  15          HH22      ARG  15  43.493   4.064   5.737
  130    H    LYS  16           HN       LYS  16  48.353   1.106   4.109
  131    HA   LYS  16           HA       LYS  16  46.625  -1.050   3.905
  132    HB2  LYS  16           HB1      LYS  16  48.292   0.524   1.888
  133    HB3  LYS  16           HB2      LYS  16  47.222  -0.792   1.340
  134    HG2  LYS  16           HG1      LYS  16  45.841   1.136   3.191
  135    HG3  LYS  16           HG2      LYS  16  46.521   1.953   1.745
  136    HD2  LYS  16           HD1      LYS  16  44.200   1.295   1.296
  137    HD3  LYS  16           HD2      LYS  16  45.299   0.309   0.272
  138    HE2  LYS  16           HE1      LYS  16  45.060  -1.610   1.937
  139    HE3  LYS  16           HE2      LYS  16  43.841  -0.624   2.834
  140    HZ1  LYS  16           HZ1      LYS  16  42.805  -2.098   1.227
  141    HZ2  LYS  16           HZ2      LYS  16  42.545  -0.476   0.796
  142    HZ3  LYS  16           HZ3      LYS  16  43.690  -1.402  -0.043
  143    H    VAL  17           HN       VAL  17  50.243  -0.972   3.118
  144    HA   VAL  17           HA       VAL  17  50.101  -3.654   2.197
  145    HB   VAL  17           HB       VAL  17  52.508  -3.658   2.109
  146   HG11  VAL  17          HG11      VAL  17  52.672  -1.750   0.396
  147   HG12  VAL  17          HG12      VAL  17  51.178  -2.711   0.183
  148   HG13  VAL  17          HG13      VAL  17  51.106  -1.101   0.996
  149   HG21  VAL  17          HG21      VAL  17  53.837  -1.601   2.602
  150   HG22  VAL  17          HG22      VAL  17  52.394  -0.878   3.403
  151   HG23  VAL  17          HG23      VAL  17  53.154  -2.369   4.069
  152    H    GLN  18           HN       GLN  18  50.776  -2.147   5.437
  153    HA   GLN  18           HA       GLN  18  51.632  -4.521   6.615
  154    HB2  GLN  18           HB1      GLN  18  51.965  -2.270   7.580
  155    HB3  GLN  18           HB2      GLN  18  50.208  -2.048   7.782
  156    HG2  GLN  18           HG1      GLN  18  50.166  -3.932   9.491
  157    HG3  GLN  18           HG2      GLN  18  51.923  -4.204   9.246
  158   HE21  GLN  18          HE21      GLN  18  52.770  -1.719  11.595
  159   HE22  GLN  18          HE22      GLN  18  53.242  -3.135  10.678
  160    H    ILE  19           HN       ILE  19  48.227  -3.130   6.366
  161    HA   ILE  19           HA       ILE  19  47.102  -5.266   7.781
  162    HB   ILE  19           HB       ILE  19  46.027  -3.199   5.889
  163   HG12  ILE  19          HG11      ILE  19  45.729  -3.531   8.951
  164   HG13  ILE  19          HG12      ILE  19  46.866  -2.435   8.102
  165   HG21  ILE  19          HG21      ILE  19  43.670  -3.915   6.523
  166   HG22  ILE  19          HG22      ILE  19  44.521  -5.342   5.854
  167   HG23  ILE  19          HG23      ILE  19  44.309  -5.175   7.635
  168   HD11  ILE  19          HD11      ILE  19  44.900  -1.161   8.880
  169   HD12  ILE  19          HD12      ILE  19  44.911  -1.199   7.079
  170   HD13  ILE  19          HD13      ILE  19  43.779  -2.257   8.001
  171    H    ASN  20           HN       ASN  20  47.512  -4.764   4.155
  172    HA   ASN  20           HA       ASN  20  46.970  -7.625   3.976
  173    HB2  ASN  20           HB1      ASN  20  45.038  -6.226   3.073
  174    HB3  ASN  20           HB2      ASN  20  46.165  -5.402   1.951
  175   HD21  ASN  20          HD21      ASN  20  44.569  -8.012  -0.098
  176   HD22  ASN  20          HD22      ASN  20  44.207  -6.447   0.587
  177    HA   PRO  21           HA       PRO  21  51.160  -6.771   2.355
  178    HB2  PRO  21           HB2      PRO  21  52.334  -9.194   2.820
  179    HB3  PRO  21           HB1      PRO  21  51.985  -8.014   4.145
  180    HG2  PRO  21           HG2      PRO  21  50.216 -10.371   3.375
  181    HG3  PRO  21           HG1      PRO  21  50.841  -9.925   5.018
  182    HD2  PRO  21           HD2      PRO  21  48.355  -9.092   4.122
  183    HD3  PRO  21           HD1      PRO  21  49.385  -8.081   5.247
  184    H    ARG  22           HN       ARG  22  48.668  -8.907   1.285
  185    HA   ARG  22           HA       ARG  22  50.154  -9.830  -1.052
  186    HB2  ARG  22           HB1      ARG  22  47.318 -10.380  -0.040
  187    HB3  ARG  22           HB2      ARG  22  47.985 -11.134  -1.508
  188    HG2  ARG  22           HG1      ARG  22  49.004 -11.470   1.412
  189    HG3  ARG  22           HG2      ARG  22  48.079 -12.680   0.503
  190    HD2  ARG  22           HD1      ARG  22  50.887 -11.742  -0.354
  191    HD3  ARG  22           HD2      ARG  22  50.543 -13.274   0.549
  192    HE   ARG  22           HE       ARG  22  48.951 -13.810  -1.374
  193   HH11  ARG  22          HH11      ARG  22  50.664 -13.838  -4.523
  194   HH12  ARG  22          HH12      ARG  22  49.366 -14.499  -3.559
  195   HH21  ARG  22          HH21      ARG  22  52.120 -12.259  -3.499
  196   HH22  ARG  22          HH22      ARG  22  51.816 -11.797  -1.859
  197    H    THR  23           HN       THR  23  48.640  -6.933  -0.335
  198    HA   THR  23           HA       THR  23  46.909  -6.705  -2.513
  199    HB   THR  23           HB       THR  23  46.754  -5.275  -0.536
  200    HG1  THR  23           HG1      THR  23  46.501  -3.300  -1.634
  201   HG21  THR  23          HG21      THR  23  48.344  -3.351  -0.199
  202   HG22  THR  23          HG22      THR  23  49.271  -4.890  -0.196
  203   HG23  THR  23          HG23      THR  23  49.290  -3.832  -1.652
  204    H    THR  24           HN       THR  24  47.059  -5.821  -4.557
  205    HA   THR  24           HA       THR  24  49.710  -5.757  -5.651
  206    HB   THR  24           HB       THR  24  48.542  -5.476  -7.825
  207    HG1  THR  24           HG1      THR  24  46.287  -5.796  -7.825
  208   HG21  THR  24          HG21      THR  24  47.521  -7.826  -7.847
  209   HG22  THR  24          HG22      THR  24  48.964  -7.836  -6.778
  210   HG23  THR  24          HG23      THR  24  47.314  -7.780  -6.060
  211    H    ALA  25           HN       ALA  25  50.256  -4.016  -7.293
  212    HA   ALA  25           HA       ALA  25  50.377  -1.521  -6.009
  213    HB1  ALA  25           HB1      ALA  25  52.090  -2.387  -7.593
  214    HB2  ALA  25           HB2      ALA  25  50.910  -2.267  -8.944
  215    HB3  ALA  25           HB3      ALA  25  51.487  -0.774  -8.110
  216    H    LYS  26           HN       LYS  26  47.988  -2.771  -8.324
  217    HA   LYS  26           HA       LYS  26  47.073  -0.347  -9.306
  218    HB2  LYS  26           HB1      LYS  26  45.769  -3.083  -8.947
  219    HB3  LYS  26           HB2      LYS  26  44.922  -1.750  -9.776
  220    HG2  LYS  26           HG1      LYS  26  46.867  -1.593 -11.440
  221    HG3  LYS  26           HG2      LYS  26  47.692  -2.935 -10.580
  222    HD2  LYS  26           HD1      LYS  26  45.843  -4.483 -11.188
  223    HD3  LYS  26           HD2      LYS  26  44.922  -3.131 -11.930
  224    HE2  LYS  26           HE1      LYS  26  46.725  -2.802 -13.653
  225    HE3  LYS  26           HE2      LYS  26  47.714  -4.105 -12.891
  226    HZ1  LYS  26           HZ1      LYS  26  46.456  -4.910 -14.777
  227    HZ2  LYS  26           HZ2      LYS  26  45.921  -5.655 -13.348
  228    HZ3  LYS  26           HZ3      LYS  26  44.995  -4.429 -14.062
  229    H    ASP  27           HN       ASP  27  45.979  -2.150  -6.294
  230    HA   ASP  27           HA       ASP  27  43.861  -0.433  -5.751
  231    HB2  ASP  27           HB1      ASP  27  44.291  -2.748  -4.730
  232    HB3  ASP  27           HB2      ASP  27  45.653  -2.044  -3.794
  233    H    LEU  28           HN       LEU  28  47.361  -0.260  -4.830
  234    HA   LEU  28           HA       LEU  28  47.167   2.064  -3.318
  235    HB2  LEU  28           HB1      LEU  28  49.441   0.737  -4.843
  236    HB3  LEU  28           HB2      LEU  28  49.701   2.302  -4.038
  237    HG   LEU  28           HG       LEU  28  49.010   1.280  -1.876
  238   HD11  LEU  28          HD11      LEU  28  49.112  -1.280  -1.601
  239   HD12  LEU  28          HD12      LEU  28  47.686  -0.736  -2.559
  240   HD13  LEU  28          HD13      LEU  28  49.119  -1.441  -3.394
  241   HD21  LEU  28          HD21      LEU  28  51.168  -0.024  -1.525
  242   HD22  LEU  28          HD22      LEU  28  51.415  -0.063  -3.300
  243   HD23  LEU  28          HD23      LEU  28  51.393   1.515  -2.433
  244    H    VAL  29           HN       VAL  29  47.755   1.637  -6.895
  245    HA   VAL  29           HA       VAL  29  48.120   4.334  -7.473
  246    HB   VAL  29           HB       VAL  29  47.113   2.015  -9.137
  247   HG11  VAL  29          HG11      VAL  29  47.628   3.459 -11.158
  248   HG12  VAL  29          HG12      VAL  29  46.258   4.112 -10.211
  249   HG13  VAL  29          HG13      VAL  29  47.889   4.873 -10.078
  250   HG21  VAL  29          HG21      VAL  29  49.501   2.241 -10.095
  251   HG22  VAL  29          HG22      VAL  29  49.824   3.556  -8.907
  252   HG23  VAL  29          HG23      VAL  29  49.515   1.875  -8.341
  253    H    LYS  30           HN       LYS  30  44.983   2.406  -7.352
  254    HA   LYS  30           HA       LYS  30  43.421   4.502  -8.284
  255    HB2  LYS  30           HB1      LYS  30  42.860   2.124  -6.443
  256    HB3  LYS  30           HB2      LYS  30  41.551   3.236  -6.919
  257    HG2  LYS  30           HG1      LYS  30  41.954   2.668  -9.351
  258    HG3  LYS  30           HG2      LYS  30  43.332   1.615  -8.884
  259    HD2  LYS  30           HD1      LYS  30  41.822   0.081  -7.678
  260    HD3  LYS  30           HD2      LYS  30  40.444   1.220  -7.850
  261    HE2  LYS  30           HE1      LYS  30  41.826  -0.173 -10.243
  262    HE3  LYS  30           HE2      LYS  30  40.333  -0.780  -9.431
  263    HZ1  LYS  30           HZ1      LYS  30  39.828   0.583 -11.353
  264    HZ2  LYS  30           HZ2      LYS  30  39.271   1.332  -9.933
  265    HZ3  LYS  30           HZ3      LYS  30  40.676   1.898 -10.694
  266    H    MET  31           HN       MET  31  44.240   3.695  -4.754
  267    HA   MET  31           HA       MET  31  42.715   5.868  -3.844
  268    HB2  MET  31           HB1      MET  31  43.758   5.562  -1.697
  269    HB3  MET  31           HB2      MET  31  43.265   3.978  -2.349
  270    HG2  MET  31           HG1      MET  31  45.699   3.560  -3.038
  271    HG3  MET  31           HG2      MET  31  46.139   5.149  -2.334
  272    HE1  MET  31           HE1      MET  31  47.961   3.248   0.195
  273    HE2  MET  31           HE2      MET  31  47.916   3.171  -1.600
  274    HE3  MET  31           HE3      MET  31  47.780   4.757  -0.764
  275    H    LEU  32           HN       LEU  32  46.104   5.633  -4.996
  276    HA   LEU  32           HA       LEU  32  47.012   8.073  -4.013
  277    HB2  LEU  32           HB1      LEU  32  48.435   6.196  -4.921
  278    HB3  LEU  32           HB2      LEU  32  47.759   6.460  -6.546
  279    HG   LEU  32           HG       LEU  32  48.770   8.853  -6.405
  280   HD11  LEU  32          HD11      LEU  32  50.747   9.064  -4.802
  281   HD12  LEU  32          HD12      LEU  32  49.163   8.956  -3.951
  282   HD13  LEU  32          HD13      LEU  32  50.250   7.520  -4.022
  283   HD21  LEU  32          HD21      LEU  32  51.033   8.009  -7.110
  284   HD22  LEU  32          HD22      LEU  32  50.652   6.385  -6.452
  285   HD23  LEU  32          HD23      LEU  32  49.697   7.039  -7.831
  286    H    GLU  33           HN       GLU  33  45.417   7.233  -7.172
  287    HA   GLU  33           HA       GLU  33  45.445   9.798  -8.254
  288    HB2  GLU  33           HB1      GLU  33  43.586   7.403  -8.659
  289    HB3  GLU  33           HB2      GLU  33  43.428   8.891  -9.619
  290    HG2  GLU  33           HG1      GLU  33  45.759   8.589 -10.523
  291    HG3  GLU  33           HG2      GLU  33  46.005   7.127  -9.496
  292    H    GLU  34           HN       GLU  34  42.922   8.185  -6.154
  293    HA   GLU  34           HA       GLU  34  41.173  10.346  -6.114
  294    HB2  GLU  34           HB1      GLU  34  40.597   8.036  -5.403
  295    HB3  GLU  34           HB2      GLU  34  41.734   8.140  -4.040
  296    HG2  GLU  34           HG1      GLU  34  40.343   9.940  -2.979
  297    HG3  GLU  34           HG2      GLU  34  39.210   9.937  -4.383
  298    H    THR  35           HN       THR  35  43.988   9.595  -3.970
  299    HA   THR  35           HA       THR  35  43.633  11.742  -2.228
  300    HB   THR  35           HB       THR  35  46.141  10.234  -3.072
  301    HG1  THR  35           HG1      THR  35  45.776   9.152  -1.086
  302   HG21  THR  35          HG21      THR  35  47.158  11.029  -0.866
  303   HG22  THR  35          HG22      THR  35  46.611  12.476  -1.778
  304   HG23  THR  35          HG23      THR  35  45.620  11.846  -0.413
  305    H    GLY  36           HN       GLY  36  45.616  11.518  -5.266
  306    HA2  GLY  36           HA2      GLY  36  45.796  13.228  -6.739
  307    HA3  GLY  36           HA1      GLY  36  45.337  14.395  -5.424
  308    H    THR  37           HN       THR  37  47.850  12.122  -4.604
  309    HA   THR  37           HA       THR  37  49.793  14.291  -4.820
  310    HB   THR  37           HB       THR  37  49.827  11.645  -3.273
  311    HG1  THR  37           HG1      THR  37  49.712  13.002  -1.441
  312   HG21  THR  37          HG21      THR  37  51.898  12.532  -2.097
  313   HG22  THR  37          HG22      THR  37  52.186  12.591  -3.869
  314   HG23  THR  37          HG23      THR  37  51.770  14.097  -2.975
  315    H    LYS  38           HN       LYS  38  51.495  14.164  -6.331
  316    HA   LYS  38           HA       LYS  38  51.610  11.714  -7.827
  317    HB2  LYS  38           HB1      LYS  38  53.113  14.367  -8.018
  318    HB3  LYS  38           HB2      LYS  38  53.514  12.983  -9.068
  319    HG2  LYS  38           HG1      LYS  38  50.704  14.299  -8.907
  320    HG3  LYS  38           HG2      LYS  38  51.958  14.772 -10.101
  321    HD2  LYS  38           HD1      LYS  38  50.946  13.195 -11.437
  322    HD3  LYS  38           HD2      LYS  38  51.912  12.024 -10.478
  323    HE2  LYS  38           HE1      LYS  38  49.732  12.131  -8.834
  324    HE3  LYS  38           HE2      LYS  38  48.919  12.601 -10.377
  325    HZ1  LYS  38           HZ1      LYS  38  48.930  10.217 -10.049
  326    HZ2  LYS  38           HZ2      LYS  38  49.861  10.632 -11.407
  327    HZ3  LYS  38           HZ3      LYS  38  50.625  10.194  -9.958
  328    H    VAL  39           HN       VAL  39  52.836  10.032  -7.383
  329    HA   VAL  39           HA       VAL  39  55.593  10.433  -6.481
  330    HB   VAL  39           HB       VAL  39  55.567   8.360  -5.221
  331   HG11  VAL  39          HG11      VAL  39  54.177   9.191  -3.233
  332   HG12  VAL  39          HG12      VAL  39  55.167  10.499  -3.948
  333   HG13  VAL  39          HG13      VAL  39  53.401  10.407  -4.306
  334   HG21  VAL  39          HG21      VAL  39  53.369   7.251  -4.607
  335   HG22  VAL  39          HG22      VAL  39  52.517   8.342  -5.761
  336   HG23  VAL  39          HG23      VAL  39  53.723   7.148  -6.360
  337    H    SER  40           HN       SER  40  56.987   8.502  -7.296
  338    HA   SER  40           HA       SER  40  56.118   7.903  -9.922
  339    HB2  SER  40           HB1      SER  40  58.550   6.964  -8.270
  340    HB3  SER  40           HB2      SER  40  58.352   6.569 -10.006
  341    HG   SER  40           HG       SER  40  59.646   8.516  -9.429
  342    H    ILE  41           HN       ILE  41  55.560   5.905 -10.876
  343    HA   ILE  41           HA       ILE  41  54.238   4.054  -9.255
  344    HB   ILE  41           HB       ILE  41  55.168   4.024 -12.126
  345   HG12  ILE  41          HG11      ILE  41  53.524   5.773 -11.741
  346   HG13  ILE  41          HG12      ILE  41  52.772   4.465 -12.710
  347   HG21  ILE  41          HG21      ILE  41  53.607   2.045 -12.508
  348   HG22  ILE  41          HG22      ILE  41  54.744   1.612 -11.193
  349   HG23  ILE  41          HG23      ILE  41  53.056   2.101 -10.796
  350   HD11  ILE  41          HD11      ILE  41  51.169   5.303 -11.050
  351   HD12  ILE  41          HD12      ILE  41  51.610   3.605 -10.645
  352   HD13  ILE  41          HD13      ILE  41  52.308   4.972  -9.700
  353    H    SER  42           HN       SER  42  57.500   3.985 -10.770
  354    HA   SER  42           HA       SER  42  58.028   1.305 -10.324
  355    HB2  SER  42           HB1      SER  42  59.320   2.751 -11.917
  356    HB3  SER  42           HB2      SER  42  59.968   3.720 -10.556
  357    HG   SER  42           HG       SER  42  61.337   1.996 -11.465
  358    H    THR  43           HN       THR  43  58.698   4.174  -8.150
  359    HA   THR  43           HA       THR  43  60.026   2.613  -6.256
  360    HB   THR  43           HB       THR  43  59.566   4.468  -4.666
  361    HG1  THR  43           HG1      THR  43  58.816   6.393  -5.606
  362   HG21  THR  43          HG21      THR  43  61.135   6.060  -5.931
  363   HG22  THR  43          HG22      THR  43  61.610   4.367  -6.300
  364   HG23  THR  43          HG23      THR  43  60.660   5.316  -7.499
  365    H    VAL  44           HN       VAL  44  56.480   3.357  -6.595
  366    HA   VAL  44           HA       VAL  44  55.725   2.198  -4.164
  367    HB   VAL  44           HB       VAL  44  54.281   2.481  -6.820
  368   HG11  VAL  44          HG11      VAL  44  52.152   2.085  -5.492
  369   HG12  VAL  44          HG12      VAL  44  53.184   0.624  -5.540
  370   HG13  VAL  44          HG13      VAL  44  53.137   1.647  -4.053
  371   HG21  VAL  44          HG21      VAL  44  53.120   4.383  -5.535
  372   HG22  VAL  44          HG22      VAL  44  54.207   4.063  -4.134
  373   HG23  VAL  44          HG23      VAL  44  54.883   4.652  -5.695
  374    H    LYS  45           HN       LYS  45  56.133   0.703  -7.466
  375    HA   LYS  45           HA       LYS  45  55.519  -1.894  -6.657
  376    HB2  LYS  45           HB1      LYS  45  57.286  -0.789  -8.892
  377    HB3  LYS  45           HB2      LYS  45  56.978  -2.536  -8.718
  378    HG2  LYS  45           HG1      LYS  45  54.468  -2.079  -8.947
  379    HG3  LYS  45           HG2      LYS  45  54.821  -0.329  -9.131
  380    HD2  LYS  45           HD1      LYS  45  54.433  -1.231 -11.340
  381    HD3  LYS  45           HD2      LYS  45  56.193  -0.899 -11.206
  382    HE2  LYS  45           HE1      LYS  45  56.661  -3.327 -10.824
  383    HE3  LYS  45           HE2      LYS  45  54.895  -3.694 -10.865
  384    HZ1  LYS  45           HZ1      LYS  45  55.949  -4.097 -12.991
  385    HZ2  LYS  45           HZ2      LYS  45  54.823  -2.833 -13.120
  386    HZ3  LYS  45           HZ3      LYS  45  56.483  -2.488 -13.081
  387    H    ARG  46           HN       ARG  46  58.681  -0.166  -6.679
  388    HA   ARG  46           HA       ARG  46  60.279  -2.336  -5.908
  389    HB2  ARG  46           HB1      ARG  46  61.160  -0.236  -6.834
  390    HB3  ARG  46           HB2      ARG  46  60.638   0.673  -5.394
  391    HG2  ARG  46           HG1      ARG  46  62.217  -0.772  -3.983
  392    HG3  ARG  46           HG2      ARG  46  62.711  -1.651  -5.441
  393    HD2  ARG  46           HD1      ARG  46  63.569   0.462  -6.507
  394    HD3  ARG  46           HD2      ARG  46  63.219   1.375  -4.982
  395    HE   ARG  46           HE       ARG  46  64.594  -0.933  -4.192
  396   HH11  ARG  46          HH11      ARG  46  66.900   2.026  -5.926
  397   HH12  ARG  46          HH12      ARG  46  65.186   1.874  -6.228
  398   HH21  ARG  46          HH21      ARG  46  67.920   0.412  -4.478
  399   HH22  ARG  46          HH22      ARG  46  66.914  -0.803  -3.766
  400    H    VAL  47           HN       VAL  47  58.504   0.058  -3.761
  401    HA   VAL  47           HA       VAL  47  59.438  -1.013  -1.367
  402    HB   VAL  47           HB       VAL  47  56.891   0.459  -2.084
  403   HG11  VAL  47          HG11      VAL  47  56.625   0.875   0.405
  404   HG12  VAL  47          HG12      VAL  47  56.413  -0.854  -0.002
  405   HG13  VAL  47          HG13      VAL  47  57.957  -0.286   0.739
  406   HG21  VAL  47          HG21      VAL  47  58.178   2.342  -0.855
  407   HG22  VAL  47          HG22      VAL  47  59.569   1.217  -0.648
  408   HG23  VAL  47          HG23      VAL  47  59.070   1.753  -2.292
  409    H    LEU  48           HN       LEU  48  56.421  -1.967  -3.308
  410    HA   LEU  48           HA       LEU  48  55.729  -3.977  -1.544
  411    HB2  LEU  48           HB1      LEU  48  55.265  -3.549  -4.518
  412    HB3  LEU  48           HB2      LEU  48  54.685  -5.040  -3.739
  413    HG   LEU  48           HG       LEU  48  53.984  -2.209  -2.687
  414   HD11  LEU  48          HD11      LEU  48  51.733  -2.513  -3.860
  415   HD12  LEU  48          HD12      LEU  48  53.090  -2.408  -5.040
  416   HD13  LEU  48          HD13      LEU  48  52.355  -4.007  -4.648
  417   HD21  LEU  48          HD21      LEU  48  52.086  -3.421  -1.574
  418   HD22  LEU  48          HD22      LEU  48  52.652  -4.981  -2.251
  419   HD23  LEU  48          HD23      LEU  48  53.682  -4.088  -1.075
  420    H    TYR  49           HN       TYR  49  57.942  -4.269  -4.526
  421    HA   TYR  49           HA       TYR  49  58.375  -6.949  -4.055
  422    HB2  TYR  49           HB1      TYR  49  59.787  -4.797  -5.606
  423    HB3  TYR  49           HB2      TYR  49  60.780  -6.228  -5.197
  424    HD1  TYR  49           HD1      TYR  49  60.099  -8.433  -5.945
  425    HD2  TYR  49           HD2      TYR  49  57.839  -4.992  -7.189
  426    HE1  TYR  49           HE1      TYR  49  58.968  -9.805  -7.670
  427    HE2  TYR  49           HE2      TYR  49  56.683  -6.376  -8.885
  428    HH   TYR  49           HH       TYR  49  56.431  -8.428  -9.773
  429    H    ARG  50           HN       ARG  50  60.281  -4.135  -2.643
  430    HA   ARG  50           HA       ARG  50  62.204  -5.856  -1.508
  431    HB2  ARG  50           HB1      ARG  50  62.502  -3.432  -1.899
  432    HB3  ARG  50           HB2      ARG  50  61.271  -3.045  -0.673
  433    HG2  ARG  50           HG1      ARG  50  63.723  -4.741   0.088
  434    HG3  ARG  50           HG2      ARG  50  63.938  -2.996  -0.145
  435    HD2  ARG  50           HD1      ARG  50  61.816  -4.043   1.803
  436    HD3  ARG  50           HD2      ARG  50  63.525  -3.721   2.309
  437    HE   ARG  50           HE       ARG  50  62.539  -1.494   0.826
  438   HH11  ARG  50          HH11      ARG  50  61.725  -1.813   4.874
  439   HH12  ARG  50          HH12      ARG  50  62.024  -3.201   3.856
  440   HH21  ARG  50          HH21      ARG  50  61.803   0.348   3.861
  441   HH22  ARG  50          HH22      ARG  50  62.189   0.455   2.178
  442    H    HIS  51           HN       HIS  51  59.147  -4.493  -0.066
  443    HA   HIS  51           HA       HIS  51  59.471  -5.780   2.384
  444    HB2  HIS  51           HB1      HIS  51  58.018  -3.821   2.111
  445    HB3  HIS  51           HB2      HIS  51  56.966  -4.713   0.977
  446    HD1  HIS  51           HD1      HIS  51  58.129  -5.286   4.646
  447    HD2  HIS  51           HD2      HIS  51  54.671  -5.465   2.273
  448    HE1  HIS  51           HE1      HIS  51  56.165  -6.005   6.136
  449    H    ASN  52           HN       ASN  52  57.551  -6.929  -0.561
  450    HA   ASN  52           HA       ASN  52  56.638  -9.183   0.806
  451    HB2  ASN  52           HB1      ASN  52  57.008  -8.542  -2.186
  452    HB3  ASN  52           HB2      ASN  52  56.329 -10.118  -1.672
  453   HD21  ASN  52          HD21      ASN  52  53.542  -7.694  -0.227
  454   HD22  ASN  52          HD22      ASN  52  54.928  -8.287   0.654
  455    H    LEU  53           HN       LEU  53  59.619  -8.671  -1.223
  456    HA   LEU  53           HA       LEU  53  60.136 -11.423  -1.442
  457    HB2  LEU  53           HB1      LEU  53  60.904  -9.563  -3.020
  458    HB3  LEU  53           HB2      LEU  53  62.023  -8.997  -1.757
  459    HG   LEU  53           HG       LEU  53  63.106 -11.388  -1.883
  460   HD11  LEU  53          HD11      LEU  53  62.674 -12.568  -4.107
  461   HD12  LEU  53          HD12      LEU  53  61.209 -12.514  -3.062
  462   HD13  LEU  53          HD13      LEU  53  61.362 -11.387  -4.459
  463   HD21  LEU  53          HD21      LEU  53  64.470 -10.762  -3.883
  464   HD22  LEU  53          HD22      LEU  53  63.263  -9.527  -4.362
  465   HD23  LEU  53          HD23      LEU  53  64.180  -9.334  -2.825
  466    H    LYS  54           HN       LYS  54  61.370  -8.843   0.804
  467    HA   LYS  54           HA       LYS  54  62.533 -10.990   2.395
  468    HB2  LYS  54           HB1      LYS  54  64.342  -9.926   1.038
  469    HB3  LYS  54           HB2      LYS  54  63.843  -8.308   1.593
  470    HG2  LYS  54           HG1      LYS  54  65.886  -9.022   2.781
  471    HG3  LYS  54           HG2      LYS  54  64.528  -8.922   3.949
  472    HD2  LYS  54           HD1      LYS  54  64.297 -11.351   3.998
  473    HD3  LYS  54           HD2      LYS  54  65.388 -11.546   2.584
  474    HE2  LYS  54           HE1      LYS  54  66.347 -10.336   5.266
  475    HE3  LYS  54           HE2      LYS  54  66.439 -12.099   4.890
  476    HZ1  LYS  54           HZ1      LYS  54  68.476 -10.948   4.326
  477    HZ2  LYS  54           HZ2      LYS  54  67.733 -11.555   2.926
  478    HZ3  LYS  54           HZ3      LYS  54  67.645  -9.900   3.280
  479    H    GLY  55           HN       GLY  55  61.809 -10.960   4.478
  480    HA2  GLY  55           HA2      GLY  55  60.478  -8.550   5.396
  481    HA3  GLY  55           HA1      GLY  55  60.523 -10.191   6.176
  482    H    ARG  56           HN       ARG  56  62.085  -7.066   5.830
  483    HA   ARG  56           HA       ARG  56  64.440  -7.785   7.339
  484    HB2  ARG  56           HB1      ARG  56  63.269  -5.105   6.402
  485    HB3  ARG  56           HB2      ARG  56  64.862  -5.228   7.185
  486    HG2  ARG  56           HG1      ARG  56  65.662  -6.683   5.257
  487    HG3  ARG  56           HG2      ARG  56  64.050  -6.616   4.520
  488    HD2  ARG  56           HD1      ARG  56  65.334  -4.972   3.315
  489    HD3  ARG  56           HD2      ARG  56  64.246  -4.015   4.403
  490    HE   ARG  56           HE       ARG  56  66.724  -4.583   5.715
  491   HH11  ARG  56          HH11      ARG  56  68.100  -1.338   4.812
  492   HH12  ARG  56          HH12      ARG  56  68.297  -2.780   5.780
  493   HH21  ARG  56          HH21      ARG  56  66.206  -1.201   3.385
  494   HH22  ARG  56          HH22      ARG  56  65.115  -2.543   3.322
  495    H    SER  57           HN       SER  57  62.740  -8.640   9.072
  496    HA   SER  57           HA       SER  57  61.378  -6.750  10.610
  497    HB2  SER  57           HB1      SER  57  60.652  -9.130  10.365
  498    HB3  SER  57           HB2      SER  57  62.155  -9.711  11.148
  499    HG   SER  57           HG       SER  57  60.178  -9.566  12.470
  500    H    ALA  58           HN       ALA  58  64.473  -8.504  11.201
  501    HA   ALA  58           HA       ALA  58  64.912  -7.268  13.756
  502    HB1  ALA  58           HB1      ALA  58  65.749  -9.551  13.194
  503    HB2  ALA  58           HB2      ALA  58  66.785  -8.858  11.899
  504    HB3  ALA  58           HB3      ALA  58  67.108  -8.457  13.628
  505    H    ARG  59           HN       ARG  59  65.746  -6.539  10.486
  506    HA   ARG  59           HA       ARG  59  67.115  -5.142   9.374
  507    HB2  ARG  59           HB1      ARG  59  66.158  -3.335  10.685
  508    HB3  ARG  59           HB2      ARG  59  67.341  -3.588  11.991
  509    HG2  ARG  59           HG1      ARG  59  69.206  -3.019  10.328
  510    HG3  ARG  59           HG2      ARG  59  67.990  -2.760   9.064
  511    HD2  ARG  59           HD1      ARG  59  67.932  -1.148  11.692
  512    HD3  ARG  59           HD2      ARG  59  68.754  -0.558  10.189
  513    HE   ARG  59           HE       ARG  59  66.135  -1.484   9.531
  514   HH11  ARG  59          HH11      ARG  59  66.648   2.395  10.869
  515   HH12  ARG  59          HH12      ARG  59  67.797   1.125  11.210
  516   HH21  ARG  59          HH21      ARG  59  64.694   1.817   9.606
  517   HH22  ARG  59          HH22      ARG  59  64.529   0.185   9.054
  518    H    LYS  60           HN       LYS  60  69.034  -5.847   8.581
  519    HA   LYS  60           HA       LYS  60  70.970  -6.809  10.548
  520    HB2  LYS  60           HB1      LYS  60  70.613  -7.330   7.542
  521    HB3  LYS  60           HB2      LYS  60  72.033  -7.916   8.446
  522    HG2  LYS  60           HG1      LYS  60  70.363  -9.205   9.983
  523    HG3  LYS  60           HG2      LYS  60  69.066  -8.731   8.836
  524    HD2  LYS  60           HD1      LYS  60  71.623 -10.330   8.121
  525    HD3  LYS  60           HD2      LYS  60  70.011 -11.054   8.441
  526    HE2  LYS  60           HE1      LYS  60  69.065  -9.941   6.424
  527    HE3  LYS  60           HE2      LYS  60  70.638  -9.111   6.117
  528    HZ1  LYS  60           HZ1      LYS  60  70.424 -11.151   4.829
  529    HZ2  LYS  60           HZ2      LYS  60  71.690 -11.289   5.952
  530    HZ3  LYS  60           HZ3      LYS  60  70.212 -12.066   6.242
  531    H    LEU  61           HN       LEU  61  70.702  -4.825   7.533
  532    HA   LEU  61           HA       LEU  61  72.763  -3.092   8.558
  533    HB2  LEU  61           HB1      LEU  61  74.025  -3.019   6.463
  534    HB3  LEU  61           HB2      LEU  61  74.135  -4.651   7.160
  535    HG   LEU  61           HG       LEU  61  72.056  -4.008   5.022
  536   HD11  LEU  61          HD11      LEU  61  73.814  -4.713   3.270
  537   HD12  LEU  61          HD12      LEU  61  74.224  -3.162   4.089
  538   HD13  LEU  61          HD13      LEU  61  75.066  -4.683   4.562
  539   HD21  LEU  61          HD21      LEU  61  72.404  -6.407   4.354
  540   HD22  LEU  61          HD22      LEU  61  73.626  -6.613   5.649
  541   HD23  LEU  61          HD23      LEU  61  71.914  -6.259   6.080
  542    H    GLU  62           HN       GLU  62  72.669  -0.942   7.231
  543    HA   GLU  62           HA       GLU  62  69.832  -0.586   6.682
  544    HB2  GLU  62           HB1      GLU  62  70.827   0.640   8.615
  545    HB3  GLU  62           HB2      GLU  62  72.003   1.418   7.533
  546    HG2  GLU  62           HG1      GLU  62  70.159   2.602   6.318
  547    HG3  GLU  62           HG2      GLU  62  68.910   1.748   7.303
  Start of MODEL    9
    1    H1   ALA   1           HT1      ALA   1  63.128  12.149  -4.804
    2    H2   ALA   1           HT2      ALA   1  62.383  11.568  -3.394
    3    H3   ALA   1           HT3      ALA   1  63.463  10.578  -4.253
    4    HA   ALA   1           HA       ALA   1  65.305  12.049  -3.725
    5    HB1  ALA   1           HB1      ALA   1  63.912  14.125  -3.747
    6    HB2  ALA   1           HB2      ALA   1  63.111  13.618  -2.219
    7    HB3  ALA   1           HB3      ALA   1  64.866  14.037  -2.226
    8    H    SER   2           HN       SER   2  62.846  11.800  -1.107
    9    HA   SER   2           HA       SER   2  64.377   9.640   0.112
   10    HB2  SER   2           HB1      SER   2  62.968  11.985   1.553
   11    HB3  SER   2           HB2      SER   2  63.584  10.536   2.407
   12    HG   SER   2           HG       SER   2  64.987  12.482   2.323
   13    H    MET   3           HN       MET   3  62.925   8.324   1.535
   14    HA   MET   3           HA       MET   3  60.830   7.390  -0.010
   15    HB2  MET   3           HB1      MET   3  62.313   6.061   1.491
   16    HB3  MET   3           HB2      MET   3  61.627   6.863   2.928
   17    HG2  MET   3           HG1      MET   3  59.375   5.779   2.421
   18    HG3  MET   3           HG2      MET   3  60.094   5.005   0.972
   19    HE1  MET   3           HE1      MET   3  59.823   1.789   2.841
   20    HE2  MET   3           HE2      MET   3  58.650   3.105   2.495
   21    HE3  MET   3           HE3      MET   3  59.864   2.635   1.257
   22    H    VAL   4           HN       VAL   4  60.819   9.637   2.693
   23    HA   VAL   4           HA       VAL   4  58.071   9.198   3.372
   24    HB   VAL   4           HB       VAL   4  58.510  10.759   5.237
   25   HG11  VAL   4          HG11      VAL   4  60.166   9.187   6.405
   26   HG12  VAL   4          HG12      VAL   4  58.898   8.282   5.526
   27   HG13  VAL   4          HG13      VAL   4  60.550   8.435   4.818
   28   HG21  VAL   4          HG21      VAL   4  60.910  11.478   5.665
   29   HG22  VAL   4          HG22      VAL   4  61.363  10.873   4.029
   30   HG23  VAL   4          HG23      VAL   4  60.213  12.247   4.204
   31    H    LEU   5           HN       LEU   5  58.670  10.624   0.725
   32    HA   LEU   5           HA       LEU   5  58.791  13.359   1.061
   33    HB2  LEU   5           HB1      LEU   5  59.574  12.004  -0.912
   34    HB3  LEU   5           HB2      LEU   5  57.890  11.609  -1.330
   35    HG   LEU   5           HG       LEU   5  59.035  13.118  -2.758
   36   HD11  LEU   5          HD11      LEU   5  57.243  14.990  -3.011
   37   HD12  LEU   5          HD12      LEU   5  56.602  13.310  -2.903
   38   HD13  LEU   5          HD13      LEU   5  56.524  14.399  -1.470
   39   HD21  LEU   5          HD21      LEU   5  59.409  15.595  -2.139
   40   HD22  LEU   5          HD22      LEU   5  59.073  15.163  -0.432
   41   HD23  LEU   5          HD23      LEU   5  60.469  14.414  -1.286
   42    H    SER   6           HN       SER   6  55.845  11.304   0.308
   43    HA   SER   6           HA       SER   6  54.267  13.655   1.040
   44    HB2  SER   6           HB1      SER   6  53.572  11.331  -0.882
   45    HB3  SER   6           HB2      SER   6  52.365  12.547  -0.358
   46    HG   SER   6           HG       SER   6  53.496  12.903  -2.444
   47    HA   PRO   7           HA       PRO   7  53.899  10.400   4.155
   48    HB2  PRO   7           HB2      PRO   7  53.113  11.820   6.345
   49    HB3  PRO   7           HB1      PRO   7  54.784  11.907   5.661
   50    HG2  PRO   7           HG2      PRO   7  52.586  13.908   5.056
   51    HG3  PRO   7           HG1      PRO   7  54.279  14.222   5.626
   52    HD2  PRO   7           HD2      PRO   7  53.609  14.220   2.934
   53    HD3  PRO   7           HD1      PRO   7  55.246  13.670   3.539
   54    H    ARG   8           HN       ARG   8  51.217  12.561   3.184
   55    HA   ARG   8           HA       ARG   8  49.105  11.155   4.393
   56    HB2  ARG   8           HB1      ARG   8  49.375  12.749   1.792
   57    HB3  ARG   8           HB2      ARG   8  47.804  12.051   2.252
   58    HG2  ARG   8           HG1      ARG   8  49.233  13.790   4.313
   59    HG3  ARG   8           HG2      ARG   8  48.644  14.625   2.864
   60    HD2  ARG   8           HD1      ARG   8  46.847  14.742   4.542
   61    HD3  ARG   8           HD2      ARG   8  46.286  13.651   3.210
   62    HE   ARG   8           HE       ARG   8  47.636  12.422   5.544
   63   HH11  ARG   8          HH11      ARG   8  44.708  10.403   6.085
   64   HH12  ARG   8          HH12      ARG   8  46.406  10.630   6.426
   65   HH21  ARG   8          HH21      ARG   8  43.671  11.888   4.541
   66   HH22  ARG   8          HH22      ARG   8  44.622  13.158   3.849
   67    H    ASP   9           HN       ASP   9  50.729  10.605   1.154
   68    HA   ASP   9           HA       ASP   9  49.069   8.310   0.782
   69    HB2  ASP   9           HB1      ASP   9  51.464   9.529  -0.750
   70    HB3  ASP   9           HB2      ASP   9  50.556   8.093  -1.335
   71    H    GLU  10           HN       GLU  10  52.553   9.009   1.679
   72    HA   GLU  10           HA       GLU  10  53.359   6.390   1.203
   73    HB2  GLU  10           HB1      GLU  10  54.888   8.332   1.183
   74    HB3  GLU  10           HB2      GLU  10  54.627   8.597   2.921
   75    HG2  GLU  10           HG1      GLU  10  56.795   7.458   2.561
   76    HG3  GLU  10           HG2      GLU  10  55.693   6.288   3.383
   77    H    ARG  11           HN       ARG  11  52.374   7.972   4.350
   78    HA   ARG  11           HA       ARG  11  53.046   5.664   5.861
   79    HB2  ARG  11           HB1      ARG  11  51.164   7.963   6.454
   80    HB3  ARG  11           HB2      ARG  11  51.582   6.713   7.649
   81    HG2  ARG  11           HG1      ARG  11  54.137   7.483   6.775
   82    HG3  ARG  11           HG2      ARG  11  53.267   9.001   6.484
   83    HD2  ARG  11           HD1      ARG  11  53.464   7.581   9.210
   84    HD3  ARG  11           HD2      ARG  11  54.242   9.151   8.749
   85    HE   ARG  11           HE       ARG  11  52.066  10.164   8.542
   86   HH11  ARG  11          HH11      ARG  11  50.646   7.214  11.060
   87   HH12  ARG  11          HH12      ARG  11  52.099   7.001  10.114
   88   HH21  ARG  11          HH21      ARG  11  49.455   9.263  10.830
   89   HH22  ARG  11          HH22      ARG  11  50.093  10.475   9.771
   90    H    THR  12           HN       THR  12  49.995   6.773   4.330
   91    HA   THR  12           HA       THR  12  48.377   4.691   5.223
   92    HB   THR  12           HB       THR  12  48.332   6.277   2.617
   93    HG1  THR  12           HG1      THR  12  46.720   7.474   3.715
   94   HG21  THR  12          HG21      THR  12  45.851   5.662   2.501
   95   HG22  THR  12          HG22      THR  12  46.795   4.141   2.645
   96   HG23  THR  12          HG23      THR  12  45.955   4.816   4.087
   97    H    LEU  13           HN       LEU  13  50.535   4.928   2.359
   98    HA   LEU  13           HA       LEU  13  49.768   2.554   1.140
   99    HB2  LEU  13           HB1      LEU  13  51.050   4.490   0.113
  100    HB3  LEU  13           HB2      LEU  13  52.448   4.122   1.150
  101    HG   LEU  13           HG       LEU  13  52.710   3.639  -1.129
  102   HD11  LEU  13          HD11      LEU  13  53.595   1.193  -1.049
  103   HD12  LEU  13          HD12      LEU  13  54.147   2.253   0.300
  104   HD13  LEU  13          HD13      LEU  13  52.834   1.049   0.575
  105   HD21  LEU  13          HD21      LEU  13  51.593   1.634  -2.279
  106   HD22  LEU  13          HD22      LEU  13  50.474   1.518  -0.883
  107   HD23  LEU  13          HD23      LEU  13  50.496   3.009  -1.892
  108    H    VAL  14           HN       VAL  14  52.553   3.157   3.520
  109    HA   VAL  14           HA       VAL  14  53.283   0.444   3.461
  110    HB   VAL  14           HB       VAL  14  54.621   0.828   5.423
  111   HG11  VAL  14          HG11      VAL  14  56.150   2.531   4.252
  112   HG12  VAL  14          HG12      VAL  14  55.527   1.301   3.112
  113   HG13  VAL  14          HG13      VAL  14  54.800   2.952   3.141
  114   HG21  VAL  14          HG21      VAL  14  54.922   3.154   6.318
  115   HG22  VAL  14          HG22      VAL  14  53.482   3.690   5.375
  116   HG23  VAL  14          HG23      VAL  14  53.307   2.473   6.691
  117    H    ARG  15           HN       ARG  15  51.021   2.294   5.658
  118    HA   ARG  15           HA       ARG  15  50.554   0.132   7.383
  119    HB2  ARG  15           HB1      ARG  15  49.896   2.420   7.934
  120    HB3  ARG  15           HB2      ARG  15  48.794   2.517   6.539
  121    HG2  ARG  15           HG1      ARG  15  47.452   2.213   8.558
  122    HG3  ARG  15           HG2      ARG  15  47.343   0.706   7.632
  123    HD2  ARG  15           HD1      ARG  15  47.613  -0.069   9.837
  124    HD3  ARG  15           HD2      ARG  15  49.277  -0.248   9.146
  125    HE   ARG  15           HE       ARG  15  48.953   2.360  10.276
  126   HH11  ARG  15          HH11      ARG  15  50.421   1.384  13.440
  127   HH12  ARG  15          HH12      ARG  15  49.816   2.696  12.458
  128   HH21  ARG  15          HH21      ARG  15  50.308  -0.826  12.534
  129   HH22  ARG  15          HH22      ARG  15  49.595  -1.036  10.972
  130    H    LYS  16           HN       LYS  16  48.725   1.040   4.330
  131    HA   LYS  16           HA       LYS  16  46.925  -1.067   4.600
  132    HB2  LYS  16           HB1      LYS  16  46.482   0.879   3.209
  133    HB3  LYS  16           HB2      LYS  16  47.848   0.487   2.134
  134    HG2  LYS  16           HG1      LYS  16  46.699  -1.543   1.301
  135    HG3  LYS  16           HG2      LYS  16  45.453  -1.436   2.589
  136    HD2  LYS  16           HD1      LYS  16  45.845   0.808   0.518
  137    HD3  LYS  16           HD2      LYS  16  44.884  -0.658   0.130
  138    HE2  LYS  16           HE1      LYS  16  44.279   1.095   2.610
  139    HE3  LYS  16           HE2      LYS  16  43.529   1.393   0.996
  140    HZ1  LYS  16           HZ1      LYS  16  42.151   0.002   2.390
  141    HZ2  LYS  16           HZ2      LYS  16  42.685  -0.868   1.033
  142    HZ3  LYS  16           HZ3      LYS  16  43.391  -1.145   2.549
  143    H    VAL  17           HN       VAL  17  50.104  -0.970   2.751
  144    HA   VAL  17           HA       VAL  17  49.848  -3.571   1.784
  145    HB   VAL  17           HB       VAL  17  52.244  -1.807   2.320
  146   HG11  VAL  17          HG11      VAL  17  53.532  -3.380   0.803
  147   HG12  VAL  17          HG12      VAL  17  53.064  -4.175   2.336
  148   HG13  VAL  17          HG13      VAL  17  52.147  -4.527   0.823
  149   HG21  VAL  17          HG21      VAL  17  52.108  -1.628  -0.259
  150   HG22  VAL  17          HG22      VAL  17  50.628  -2.656  -0.222
  151   HG23  VAL  17          HG23      VAL  17  50.621  -1.023   0.536
  152    H    GLN  18           HN       GLN  18  51.301  -2.374   4.921
  153    HA   GLN  18           HA       GLN  18  52.377  -4.845   5.639
  154    HB2  GLN  18           HB1      GLN  18  52.825  -2.449   6.577
  155    HB3  GLN  18           HB2      GLN  18  51.310  -2.602   7.502
  156    HG2  GLN  18           HG1      GLN  18  53.014  -3.173   9.102
  157    HG3  GLN  18           HG2      GLN  18  52.449  -4.787   8.558
  158   HE21  GLN  18          HE21      GLN  18  56.049  -3.208   7.125
  159   HE22  GLN  18          HE22      GLN  18  54.728  -2.144   7.557
  160    H    ILE  19           HN       ILE  19  49.175  -3.344   6.405
  161    HA   ILE  19           HA       ILE  19  48.395  -5.546   8.030
  162    HB   ILE  19           HB       ILE  19  47.047  -3.050   7.038
  163   HG12  ILE  19          HG11      ILE  19  48.792  -2.577   8.670
  164   HG13  ILE  19          HG12      ILE  19  47.192  -2.294   9.426
  165   HG21  ILE  19          HG21      ILE  19  45.118  -3.556   8.604
  166   HG22  ILE  19          HG22      ILE  19  45.314  -4.946   7.490
  167   HG23  ILE  19          HG23      ILE  19  45.927  -5.054   9.181
  168   HD11  ILE  19          HD11      ILE  19  48.703  -3.362  11.036
  169   HD12  ILE  19          HD12      ILE  19  47.369  -4.502  10.626
  170   HD13  ILE  19          HD13      ILE  19  49.012  -4.737   9.919
  171    H    ASN  20           HN       ASN  20  47.581  -4.452   4.642
  172    HA   ASN  20           HA       ASN  20  46.084  -6.950   4.393
  173    HB2  ASN  20           HB1      ASN  20  45.783  -4.248   2.883
  174    HB3  ASN  20           HB2      ASN  20  44.804  -5.696   2.493
  175   HD21  ASN  20          HD21      ASN  20  42.928  -5.363   5.698
  176   HD22  ASN  20          HD22      ASN  20  43.784  -6.620   4.839
  177    HA   PRO  21           HA       PRO  21  49.807  -6.978   1.702
  178    HB2  PRO  21           HB2      PRO  21  50.535  -9.615   1.855
  179    HB3  PRO  21           HB1      PRO  21  50.771  -8.464   3.230
  180    HG2  PRO  21           HG2      PRO  21  48.420 -10.384   2.879
  181    HG3  PRO  21           HG1      PRO  21  49.483 -10.169   4.334
  182    HD2  PRO  21           HD2      PRO  21  47.096  -8.796   4.086
  183    HD3  PRO  21           HD1      PRO  21  48.555  -8.102   4.944
  184    H    ARG  22           HN       ARG  22  46.736  -8.264   1.196
  185    HA   ARG  22           HA       ARG  22  47.314  -9.804  -1.182
  186    HB2  ARG  22           HB1      ARG  22  44.722  -9.033   0.253
  187    HB3  ARG  22           HB2      ARG  22  44.736 -10.080  -1.186
  188    HG2  ARG  22           HG1      ARG  22  46.279 -11.694   0.155
  189    HG3  ARG  22           HG2      ARG  22  46.064 -10.650   1.573
  190    HD2  ARG  22           HD1      ARG  22  43.579 -10.955   1.543
  191    HD3  ARG  22           HD2      ARG  22  43.708 -12.079   0.128
  192    HE   ARG  22           HE       ARG  22  45.537 -12.944   2.117
  193   HH11  ARG  22          HH11      ARG  22  43.229 -15.315   3.586
  194   HH12  ARG  22          HH12      ARG  22  44.901 -14.875   3.338
  195   HH21  ARG  22          HH21      ARG  22  41.557 -13.968   2.535
  196   HH22  ARG  22          HH22      ARG  22  42.067 -12.596   1.613
  197    H    THR  23           HN       THR  23  47.195  -6.457  -0.831
  198    HA   THR  23           HA       THR  23  45.261  -5.944  -2.832
  199    HB   THR  23           HB       THR  23  46.059  -3.600  -2.745
  200    HG1  THR  23           HG1      THR  23  47.491  -3.076  -1.060
  201   HG21  THR  23          HG21      THR  23  45.244  -3.200  -0.350
  202   HG22  THR  23          HG22      THR  23  44.303  -4.556  -1.059
  203   HG23  THR  23          HG23      THR  23  45.643  -4.897   0.095
  204    H    THR  24           HN       THR  24  45.679  -4.588  -4.791
  205    HA   THR  24           HA       THR  24  48.166  -5.337  -6.147
  206    HB   THR  24           HB       THR  24  45.325  -5.245  -7.267
  207    HG1  THR  24           HG1      THR  24  45.719  -7.458  -7.696
  208   HG21  THR  24          HG21      THR  24  46.359  -6.066  -9.454
  209   HG22  THR  24          HG22      THR  24  47.234  -4.580  -8.955
  210   HG23  THR  24          HG23      THR  24  47.978  -6.195  -8.679
  211    H    ALA  25           HN       ALA  25  48.899  -3.730  -7.656
  212    HA   ALA  25           HA       ALA  25  48.873  -1.205  -6.474
  213    HB1  ALA  25           HB1      ALA  25  50.784  -2.199  -7.708
  214    HB2  ALA  25           HB2      ALA  25  49.876  -2.045  -9.251
  215    HB3  ALA  25           HB3      ALA  25  50.376  -0.567  -8.343
  216    H    LYS  26           HN       LYS  26  46.702  -2.405  -8.970
  217    HA   LYS  26           HA       LYS  26  45.819  -0.006 -10.016
  218    HB2  LYS  26           HB1      LYS  26  44.486  -2.694  -9.431
  219    HB3  LYS  26           HB2      LYS  26  43.543  -1.379 -10.177
  220    HG2  LYS  26           HG1      LYS  26  46.218  -2.417 -11.360
  221    HG3  LYS  26           HG2      LYS  26  44.637  -3.160 -11.775
  222    HD2  LYS  26           HD1      LYS  26  44.727  -0.147 -11.994
  223    HD3  LYS  26           HD2      LYS  26  45.859  -1.000 -13.098
  224    HE2  LYS  26           HE1      LYS  26  43.649  -0.528 -14.208
  225    HE3  LYS  26           HE2      LYS  26  43.958  -2.302 -14.089
  226    HZ1  LYS  26           HZ1      LYS  26  41.715  -1.732 -13.466
  227    HZ2  LYS  26           HZ2      LYS  26  42.557  -2.359 -12.131
  228    HZ3  LYS  26           HZ3      LYS  26  42.269  -0.692 -12.243
  229    H    ASP  27           HN       ASP  27  44.780  -1.621  -6.885
  230    HA   ASP  27           HA       ASP  27  42.814   0.266  -6.304
  231    HB2  ASP  27           HB1      ASP  27  43.046  -2.045  -5.273
  232    HB3  ASP  27           HB2      ASP  27  44.545  -1.510  -4.439
  233    H    LEU  28           HN       LEU  28  46.342   0.173  -5.603
  234    HA   LEU  28           HA       LEU  28  46.396   2.393  -3.946
  235    HB2  LEU  28           HB1      LEU  28  48.423   0.930  -5.701
  236    HB3  LEU  28           HB2      LEU  28  48.927   2.403  -4.840
  237    HG   LEU  28           HG       LEU  28  48.572   1.411  -2.716
  238   HD11  LEU  28          HD11      LEU  28  47.967  -1.064  -2.358
  239   HD12  LEU  28          HD12      LEU  28  46.582  -0.111  -3.002
  240   HD13  LEU  28          HD13      LEU  28  47.528  -1.186  -4.098
  241   HD21  LEU  28          HD21      LEU  28  50.238  -0.512  -2.833
  242   HD22  LEU  28          HD22      LEU  28  50.043  -0.543  -4.615
  243   HD23  LEU  28          HD23      LEU  28  50.708   0.925  -3.813
  244    H    VAL  29           HN       VAL  29  46.945   2.233  -7.621
  245    HA   VAL  29           HA       VAL  29  47.495   4.984  -7.736
  246    HB   VAL  29           HB       VAL  29  47.120   4.894 -10.118
  247   HG11  VAL  29          HG11      VAL  29  49.022   3.216 -10.526
  248   HG12  VAL  29          HG12      VAL  29  49.359   4.282  -9.129
  249   HG13  VAL  29          HG13      VAL  29  48.800   2.588  -8.857
  250   HG21  VAL  29          HG21      VAL  29  46.695   2.690 -11.245
  251   HG22  VAL  29          HG22      VAL  29  46.300   1.962  -9.646
  252   HG23  VAL  29          HG23      VAL  29  45.278   3.280 -10.323
  253    H    LYS  30           HN       LYS  30  44.419   3.145  -7.902
  254    HA   LYS  30           HA       LYS  30  42.763   5.254  -8.639
  255    HB2  LYS  30           HB1      LYS  30  42.209   2.840  -8.721
  256    HB3  LYS  30           HB2      LYS  30  42.299   2.725  -6.945
  257    HG2  LYS  30           HG1      LYS  30  40.279   4.185  -6.730
  258    HG3  LYS  30           HG2      LYS  30  40.247   4.433  -8.508
  259    HD2  LYS  30           HD1      LYS  30  38.577   2.726  -7.864
  260    HD3  LYS  30           HD2      LYS  30  39.880   1.962  -8.834
  261    HE2  LYS  30           HE1      LYS  30  39.215   0.470  -6.974
  262    HE3  LYS  30           HE2      LYS  30  40.906   1.043  -6.711
  263    HZ1  LYS  30           HZ1      LYS  30  39.592   1.152  -4.710
  264    HZ2  LYS  30           HZ2      LYS  30  40.044   2.711  -5.204
  265    HZ3  LYS  30           HZ3      LYS  30  38.457   2.172  -5.453
  266    H    MET  31           HN       MET  31  43.769   4.167  -5.292
  267    HA   MET  31           HA       MET  31  42.398   6.143  -3.915
  268    HB2  MET  31           HB1      MET  31  43.387   4.132  -2.870
  269    HB3  MET  31           HB2      MET  31  45.035   4.657  -3.303
  270    HG2  MET  31           HG1      MET  31  44.823   6.620  -1.701
  271    HG3  MET  31           HG2      MET  31  43.133   6.142  -1.339
  272    HE1  MET  31           HE1      MET  31  47.050   3.897  -0.131
  273    HE2  MET  31           HE2      MET  31  46.522   4.078  -1.839
  274    HE3  MET  31           HE3      MET  31  46.964   5.529  -0.877
  275    H    LEU  32           HN       LEU  32  45.774   6.221  -5.264
  276    HA   LEU  32           HA       LEU  32  46.416   8.743  -4.298
  277    HB2  LEU  32           HB1      LEU  32  47.404   6.950  -6.540
  278    HB3  LEU  32           HB2      LEU  32  48.054   8.602  -6.428
  279    HG   LEU  32           HG       LEU  32  49.279   8.182  -4.613
  280   HD11  LEU  32          HD11      LEU  32  49.011   6.290  -2.869
  281   HD12  LEU  32          HD12      LEU  32  47.619   7.433  -2.896
  282   HD13  LEU  32          HD13      LEU  32  47.475   5.816  -3.678
  283   HD21  LEU  32          HD21      LEU  32  50.376   5.876  -4.797
  284   HD22  LEU  32          HD22      LEU  32  49.032   5.356  -5.862
  285   HD23  LEU  32          HD23      LEU  32  50.110   6.702  -6.374
  286    H    GLU  33           HN       GLU  33  44.934   7.813  -7.533
  287    HA   GLU  33           HA       GLU  33  44.714  10.424  -8.465
  288    HB2  GLU  33           HB1      GLU  33  43.111   7.892  -9.033
  289    HB3  GLU  33           HB2      GLU  33  42.784   9.421  -9.879
  290    HG2  GLU  33           HG1      GLU  33  45.144   9.452 -10.780
  291    HG3  GLU  33           HG2      GLU  33  45.536   7.939  -9.882
  292    H    GLU  34           HN       GLU  34  42.404   8.506  -6.384
  293    HA   GLU  34           HA       GLU  34  40.354  10.370  -6.426
  294    HB2  GLU  34           HB1      GLU  34  40.121   8.005  -5.699
  295    HB3  GLU  34           HB2      GLU  34  41.173   8.300  -4.296
  296    HG2  GLU  34           HG1      GLU  34  39.469   9.871  -3.322
  297    HG3  GLU  34           HG2      GLU  34  38.400   9.640  -4.757
  298    H    THR  35           HN       THR  35  43.177  10.133  -4.041
  299    HA   THR  35           HA       THR  35  42.207  12.438  -2.687
  300    HB   THR  35           HB       THR  35  43.474  10.662  -1.561
  301    HG1  THR  35           HG1      THR  35  44.818  12.090  -0.402
  302   HG21  THR  35          HG21      THR  35  45.983  10.597  -1.750
  303   HG22  THR  35          HG22      THR  35  45.270  10.316  -3.374
  304   HG23  THR  35          HG23      THR  35  45.963  11.927  -2.964
  305    H    GLY  36           HN       GLY  36  44.446  11.916  -5.428
  306    HA2  GLY  36           HA2      GLY  36  44.582  13.486  -7.077
  307    HA3  GLY  36           HA1      GLY  36  44.250  14.781  -5.848
  308    H    THR  37           HN       THR  37  46.662  12.468  -4.907
  309    HA   THR  37           HA       THR  37  48.765  14.328  -5.734
  310    HB   THR  37           HB       THR  37  48.507  12.650  -3.203
  311    HG1  THR  37           HG1      THR  37  48.639  14.705  -2.202
  312   HG21  THR  37          HG21      THR  37  50.729  13.650  -2.485
  313   HG22  THR  37          HG22      THR  37  50.954  12.855  -4.079
  314   HG23  THR  37          HG23      THR  37  50.804  14.646  -3.982
  315    H    LYS  38           HN       LYS  38  50.445  13.479  -6.911
  316    HA   LYS  38           HA       LYS  38  50.136  10.731  -7.649
  317    HB2  LYS  38           HB1      LYS  38  52.079  12.933  -8.528
  318    HB3  LYS  38           HB2      LYS  38  52.123  11.289  -9.217
  319    HG2  LYS  38           HG1      LYS  38  49.722  11.597 -10.033
  320    HG3  LYS  38           HG2      LYS  38  49.700  13.241  -9.314
  321    HD2  LYS  38           HD1      LYS  38  50.077  13.502 -11.679
  322    HD3  LYS  38           HD2      LYS  38  51.639  13.852 -10.864
  323    HE2  LYS  38           HE1      LYS  38  52.512  11.591 -11.466
  324    HE3  LYS  38           HE2      LYS  38  50.926  11.149 -12.205
  325    HZ1  LYS  38           HZ1      LYS  38  52.511  11.905 -13.854
  326    HZ2  LYS  38           HZ2      LYS  38  51.201  12.982 -13.755
  327    HZ3  LYS  38           HZ3      LYS  38  52.690  13.395 -13.059
  328    H    VAL  39           HN       VAL  39  51.349   8.994  -7.085
  329    HA   VAL  39           HA       VAL  39  54.039   9.444  -5.973
  330    HB   VAL  39           HB       VAL  39  52.086   7.177  -5.361
  331   HG11  VAL  39          HG11      VAL  39  53.892   6.402  -3.747
  332   HG12  VAL  39          HG12      VAL  39  54.452   6.341  -5.445
  333   HG13  VAL  39          HG13      VAL  39  54.989   7.684  -4.367
  334   HG21  VAL  39          HG21      VAL  39  52.227   8.089  -2.970
  335   HG22  VAL  39          HG22      VAL  39  53.196   9.478  -3.584
  336   HG23  VAL  39          HG23      VAL  39  51.486   9.262  -4.104
  337    H    SER  40           HN       SER  40  55.649   8.521  -7.246
  338    HA   SER  40           HA       SER  40  54.897   7.413  -9.691
  339    HB2  SER  40           HB1      SER  40  57.595   7.469  -8.214
  340    HB3  SER  40           HB2      SER  40  57.437   6.932  -9.916
  341    HG   SER  40           HG       SER  40  57.964   9.253  -9.506
  342    H    ILE  41           HN       ILE  41  55.253   5.295 -10.603
  343    HA   ILE  41           HA       ILE  41  54.216   3.351  -8.897
  344    HB   ILE  41           HB       ILE  41  55.329   3.234 -11.686
  345   HG12  ILE  41          HG11      ILE  41  53.425   4.701 -11.645
  346   HG13  ILE  41          HG12      ILE  41  52.891   3.158 -12.383
  347   HG21  ILE  41          HG21      ILE  41  54.091   0.987 -11.884
  348   HG22  ILE  41          HG22      ILE  41  55.176   0.884 -10.462
  349   HG23  ILE  41          HG23      ILE  41  53.415   1.177 -10.229
  350   HD11  ILE  41          HD11      ILE  41  51.146   4.019 -10.888
  351   HD12  ILE  41          HD12      ILE  41  51.812   2.491 -10.206
  352   HD13  ILE  41          HD13      ILE  41  52.288   4.081  -9.501
  353    H    SER  42           HN       SER  42  57.577   3.899 -10.085
  354    HA   SER  42           HA       SER  42  58.542   1.411  -9.457
  355    HB2  SER  42           HB1      SER  42  60.820   2.517  -9.546
  356    HB3  SER  42           HB2      SER  42  59.800   2.891 -10.970
  357    HG   SER  42           HG       SER  42  60.931   4.700  -9.884
  358    H    THR  43           HN       THR  43  58.325   4.307  -7.210
  359    HA   THR  43           HA       THR  43  59.776   3.018  -5.192
  360    HB   THR  43           HB       THR  43  58.685   4.589  -3.615
  361    HG1  THR  43           HG1      THR  43  57.510   6.293  -4.542
  362   HG21  THR  43          HG21      THR  43  59.831   6.650  -4.623
  363   HG22  THR  43          HG22      THR  43  60.809   5.198  -5.019
  364   HG23  THR  43          HG23      THR  43  59.736   5.927  -6.269
  365    H    VAL  44           HN       VAL  44  56.261   2.963  -5.993
  366    HA   VAL  44           HA       VAL  44  55.428   1.470  -3.780
  367    HB   VAL  44           HB       VAL  44  54.352   1.694  -6.611
  368   HG11  VAL  44          HG11      VAL  44  52.186   0.770  -5.656
  369   HG12  VAL  44          HG12      VAL  44  53.496  -0.447  -5.621
  370   HG13  VAL  44          HG13      VAL  44  53.026   0.415  -4.107
  371   HG21  VAL  44          HG21      VAL  44  52.658   3.222  -5.438
  372   HG22  VAL  44          HG22      VAL  44  53.579   3.019  -3.903
  373   HG23  VAL  44          HG23      VAL  44  54.337   3.838  -5.316
  374    H    LYS  45           HN       LYS  45  56.662   0.426  -7.026
  375    HA   LYS  45           HA       LYS  45  56.380  -2.314  -6.618
  376    HB2  LYS  45           HB1      LYS  45  58.362  -0.666  -8.283
  377    HB3  LYS  45           HB2      LYS  45  58.318  -2.447  -8.370
  378    HG2  LYS  45           HG1      LYS  45  55.891  -0.618  -9.006
  379    HG3  LYS  45           HG2      LYS  45  57.065  -1.172 -10.246
  380    HD2  LYS  45           HD1      LYS  45  56.443  -3.543  -9.780
  381    HD3  LYS  45           HD2      LYS  45  55.341  -3.010  -8.465
  382    HE2  LYS  45           HE1      LYS  45  53.979  -3.532 -10.431
  383    HE3  LYS  45           HE2      LYS  45  53.965  -1.739 -10.223
  384    HZ1  LYS  45           HZ1      LYS  45  54.317  -2.382 -12.502
  385    HZ2  LYS  45           HZ2      LYS  45  55.690  -1.588 -11.895
  386    HZ3  LYS  45           HZ3      LYS  45  55.701  -3.272 -12.088
  387    H    ARG  46           HN       ARG  46  59.215  -0.150  -5.835
  388    HA   ARG  46           HA       ARG  46  60.795  -2.192  -4.762
  389    HB2  ARG  46           HB1      ARG  46  60.633   0.776  -4.167
  390    HB3  ARG  46           HB2      ARG  46  61.784  -0.260  -3.290
  391    HG2  ARG  46           HG1      ARG  46  62.708  -0.963  -5.637
  392    HG3  ARG  46           HG2      ARG  46  61.655   0.273  -6.351
  393    HD2  ARG  46           HD1      ARG  46  64.023   1.112  -6.010
  394    HD3  ARG  46           HD2      ARG  46  62.789   2.138  -5.170
  395    HE   ARG  46           HE       ARG  46  63.283   0.960  -3.085
  396   HH11  ARG  46          HH11      ARG  46  67.068   0.343  -4.572
  397   HH12  ARG  46          HH12      ARG  46  65.714   0.657  -5.629
  398   HH21  ARG  46          HH21      ARG  46  66.647   0.227  -2.225
  399   HH22  ARG  46          HH22      ARG  46  65.033   0.499  -1.666
  400    H    VAL  47           HN       VAL  47  58.262  -0.176  -3.041
  401    HA   VAL  47           HA       VAL  47  58.816  -1.182  -0.500
  402    HB   VAL  47           HB       VAL  47  56.274  -0.091  -1.749
  403   HG11  VAL  47          HG11      VAL  47  55.425   0.187   0.628
  404   HG12  VAL  47          HG12      VAL  47  55.590  -1.538   0.182
  405   HG13  VAL  47          HG13      VAL  47  56.831  -0.756   1.235
  406   HG21  VAL  47          HG21      VAL  47  56.915   1.926  -0.271
  407   HG22  VAL  47          HG22      VAL  47  58.404   1.048   0.237
  408   HG23  VAL  47          HG23      VAL  47  58.187   1.555  -1.476
  409    H    LEU  48           HN       LEU  48  56.476  -2.442  -3.049
  410    HA   LEU  48           HA       LEU  48  55.707  -4.632  -1.537
  411    HB2  LEU  48           HB1      LEU  48  55.922  -4.114  -4.548
  412    HB3  LEU  48           HB2      LEU  48  55.258  -5.645  -3.930
  413    HG   LEU  48           HG       LEU  48  54.126  -2.867  -3.170
  414   HD11  LEU  48          HD11      LEU  48  52.301  -3.365  -4.894
  415   HD12  LEU  48          HD12      LEU  48  53.921  -3.171  -5.660
  416   HD13  LEU  48          HD13      LEU  48  53.222  -4.817  -5.427
  417   HD21  LEU  48          HD21      LEU  48  52.082  -4.180  -2.544
  418   HD22  LEU  48          HD22      LEU  48  52.900  -5.712  -2.985
  419   HD23  LEU  48          HD23      LEU  48  53.527  -4.725  -1.617
  420    H    TYR  49           HN       TYR  49  58.516  -4.291  -3.838
  421    HA   TYR  49           HA       TYR  49  59.186  -6.986  -3.837
  422    HB2  TYR  49           HB1      TYR  49  59.983  -5.291  -5.532
  423    HB3  TYR  49           HB2      TYR  49  60.906  -4.427  -4.265
  424    HD1  TYR  49           HD1      TYR  49  60.583  -7.725  -6.046
  425    HD2  TYR  49           HD2      TYR  49  63.167  -5.093  -3.830
  426    HE1  TYR  49           HE1      TYR  49  62.549  -9.097  -6.694
  427    HE2  TYR  49           HE2      TYR  49  65.118  -6.463  -4.487
  428    HH   TYR  49           HH       TYR  49  65.859  -8.197  -5.671
  429    H    ARG  50           HN       ARG  50  60.352  -4.316  -1.695
  430    HA   ARG  50           HA       ARG  50  62.272  -5.966  -0.337
  431    HB2  ARG  50           HB2      ARG  50  62.307  -3.418  -0.429
  432    HB3  ARG  50           HB1      ARG  50  60.825  -3.355   0.503
  433    HG2  ARG  50           HG2      ARG  50  62.029  -4.373   2.507
  434    HG3  ARG  50           HG1      ARG  50  63.494  -4.564   1.537
  435    HD2  ARG  50           HD2      ARG  50  63.612  -2.045   1.229
  436    HD3  ARG  50           HD1      ARG  50  62.108  -1.861   2.165
  437    HE   ARG  50           HE       ARG  50  64.002  -3.407   3.799
  438   HH11  ARG  50          HH11      ARG  50  63.627  -0.162   2.639
  439   HH12  ARG  50          HH12      ARG  50  64.584   0.528   4.038
  440   HH21  ARG  50          HH21      ARG  50  65.074  -2.604   5.361
  441   HH22  ARG  50          HH22      ARG  50  65.355  -0.811   5.494
  442    H    HIS  51           HN       HIS  51  58.738  -5.184   0.518
  443    HA   HIS  51           HA       HIS  51  58.792  -6.673   2.873
  444    HB2  HIS  51           HB1      HIS  51  56.509  -5.969   0.988
  445    HB3  HIS  51           HB2      HIS  51  56.251  -6.952   2.457
  446    HD1  HIS  51           HD1      HIS  51  57.176  -3.397   1.376
  447    HD2  HIS  51           HD2      HIS  51  56.413  -5.506   4.918
  448    HE1  HIS  51           HE1      HIS  51  57.047  -1.708   3.299
  449    H    ASN  52           HN       ASN  52  58.058  -7.883  -0.561
  450    HA   ASN  52           HA       ASN  52  57.537 -10.447   0.330
  451    HB2  ASN  52           HB1      ASN  52  58.497  -9.276  -2.305
  452    HB3  ASN  52           HB2      ASN  52  58.403 -11.055  -2.134
  453   HD21  ASN  52          HD21      ASN  52  54.990  -8.794  -2.626
  454   HD22  ASN  52          HD22      ASN  52  56.579  -8.067  -2.640
  455    H    LEU  53           HN       LEU  53  60.831  -8.989  -0.540
  456    HA   LEU  53           HA       LEU  53  62.152 -11.380  -0.170
  457    HB2  LEU  53           HB1      LEU  53  62.937  -8.462  -0.097
  458    HB3  LEU  53           HB2      LEU  53  64.122  -9.636   0.518
  459    HG   LEU  53           HG       LEU  53  64.188 -10.779  -1.594
  460   HD11  LEU  53          HD11      LEU  53  63.165  -9.804  -3.745
  461   HD12  LEU  53          HD12      LEU  53  61.929 -10.466  -2.614
  462   HD13  LEU  53          HD13      LEU  53  62.184  -8.686  -2.731
  463   HD21  LEU  53          HD21      LEU  53  65.276  -8.922  -2.973
  464   HD22  LEU  53          HD22      LEU  53  64.558  -7.712  -1.861
  465   HD23  LEU  53          HD23      LEU  53  65.738  -8.918  -1.232
  466    H    LYS  54           HN       LYS  54  61.338  -8.870   2.434
  467    HA   LYS  54           HA       LYS  54  62.892 -10.621   4.169
  468    HB2  LYS  54           HB1      LYS  54  63.450  -8.698   5.574
  469    HB3  LYS  54           HB2      LYS  54  63.985  -8.397   3.900
  470    HG2  LYS  54           HG1      LYS  54  62.667  -6.515   3.739
  471    HG3  LYS  54           HG2      LYS  54  61.219  -7.392   4.334
  472    HD2  LYS  54           HD1      LYS  54  62.380  -7.185   6.716
  473    HD3  LYS  54           HD2      LYS  54  63.421  -5.950   5.928
  474    HE2  LYS  54           HE1      LYS  54  61.350  -4.649   5.241
  475    HE3  LYS  54           HE2      LYS  54  60.320  -5.870   6.083
  476    HZ1  LYS  54           HZ1      LYS  54  60.776  -3.960   7.475
  477    HZ2  LYS  54           HZ2      LYS  54  61.484  -5.355   8.134
  478    HZ3  LYS  54           HZ3      LYS  54  62.450  -4.209   7.342
  479    H    GLY  55           HN       GLY  55  59.611  -9.898   3.677
  480    HA2  GLY  55           HA2      GLY  55  59.024  -8.392   5.904
  481    HA3  GLY  55           HA1      GLY  55  57.877  -9.339   4.860
  482    H    ARG  56           HN       ARG  56  58.403  -8.638   7.809
  483    HA   ARG  56           HA       ARG  56  58.320  -9.439   9.888
  484    HB2  ARG  56           HB1      ARG  56  56.473 -10.828  10.491
  485    HB3  ARG  56           HB2      ARG  56  56.034  -9.414   9.502
  486    HG2  ARG  56           HG1      ARG  56  55.946 -11.053   7.482
  487    HG3  ARG  56           HG2      ARG  56  56.143 -12.378   8.644
  488    HD2  ARG  56           HD1      ARG  56  53.866 -10.300   8.873
  489    HD3  ARG  56           HD2      ARG  56  53.662 -11.950   8.154
  490    HE   ARG  56           HE       ARG  56  54.288 -11.334  10.995
  491   HH11  ARG  56          HH11      ARG  56  53.056 -14.990   9.537
  492   HH12  ARG  56          HH12      ARG  56  53.597 -13.708   8.481
  493   HH21  ARG  56          HH21      ARG  56  52.949 -14.546  11.865
  494   HH22  ARG  56          HH22      ARG  56  53.447 -12.991  12.436
  495    H    SER  57           HN       SER  57  60.601 -10.411   9.141
  496    HA   SER  57           HA       SER  57  60.883 -13.173   9.128
  497    HB2  SER  57           HB1      SER  57  63.342 -12.688   9.379
  498    HB3  SER  57           HB2      SER  57  62.591 -11.719   8.071
  499    HG   SER  57           HG       SER  57  64.014 -10.594   9.635
  500    H    ALA  58           HN       ALA  58  60.060 -11.299  11.755
  501    HA   ALA  58           HA       ALA  58  61.727 -12.377  13.821
  502    HB1  ALA  58           HB1      ALA  58  60.742 -10.076  13.880
  503    HB2  ALA  58           HB2      ALA  58  59.086 -10.774  13.867
  504    HB3  ALA  58           HB3      ALA  58  60.169 -11.038  15.286
  505    H    ARG  59           HN       ARG  59  61.395 -14.590  13.228
  506    HA   ARG  59           HA       ARG  59  60.881 -16.661  13.880
  507    HB2  ARG  59           HB1      ARG  59  58.843 -15.430  15.738
  508    HB3  ARG  59           HB2      ARG  59  59.154 -17.180  15.650
  509    HG2  ARG  59           HG1      ARG  59  61.673 -16.553  16.163
  510    HG3  ARG  59           HG2      ARG  59  61.091 -14.917  16.522
  511    HD2  ARG  59           HD1      ARG  59  61.122 -15.976  18.678
  512    HD3  ARG  59           HD2      ARG  59  59.370 -15.975  18.218
  513    HE   ARG  59           HE       ARG  59  59.400 -18.251  17.848
  514   HH11  ARG  59          HH11      ARG  59  63.355 -18.656  18.965
  515   HH12  ARG  59          HH12      ARG  59  62.670 -17.114  18.509
  516   HH21  ARG  59          HH21      ARG  59  61.931 -20.564  18.929
  517   HH22  ARG  59          HH22      ARG  59  60.270 -20.345  18.495
  518    H    LYS  60           HN       LYS  60  59.322 -18.457  13.649
  519    HA   LYS  60           HA       LYS  60  57.614 -17.902  11.418
  520    HB2  LYS  60           HB1      LYS  60  58.237 -20.459  12.996
  521    HB3  LYS  60           HB2      LYS  60  57.175 -20.445  11.565
  522    HG2  LYS  60           HG1      LYS  60  59.169 -19.554  10.195
  523    HG3  LYS  60           HG2      LYS  60  60.191 -19.737  11.660
  524    HD2  LYS  60           HD1      LYS  60  59.744 -22.176  11.724
  525    HD3  LYS  60           HD2      LYS  60  58.515 -22.027  10.421
  526    HE2  LYS  60           HE1      LYS  60  60.389 -21.249   8.838
  527    HE3  LYS  60           HE2      LYS  60  61.573 -21.640  10.143
  528    HZ1  LYS  60           HZ1      LYS  60  61.239 -23.505   8.638
  529    HZ2  LYS  60           HZ2      LYS  60  60.686 -23.893  10.195
  530    HZ3  LYS  60           HZ3      LYS  60  59.574 -23.524   8.970
  531    H    LEU  61           HN       LEU  61  56.211 -16.415  12.823
  532    HA   LEU  61           HA       LEU  61  54.367 -17.801  14.536
  533    HB2  LEU  61           HB1      LEU  61  54.580 -14.901  13.550
  534    HB3  LEU  61           HB2      LEU  61  53.362 -15.441  14.731
  535    HG   LEU  61           HG       LEU  61  56.420 -15.616  15.096
  536   HD11  LEU  61          HD11      LEU  61  56.086 -13.666  16.742
  537   HD12  LEU  61          HD12      LEU  61  55.703 -13.229  15.037
  538   HD13  LEU  61          HD13      LEU  61  54.371 -13.554  16.208
  539   HD21  LEU  61          HD21      LEU  61  55.931 -16.008  17.537
  540   HD22  LEU  61          HD22      LEU  61  54.171 -16.033  17.196
  541   HD23  LEU  61          HD23      LEU  61  55.237 -17.301  16.491
  542    H    GLU  62           HN       GLU  62  53.778 -19.281  12.652
  543    HA   GLU  62           HA       GLU  62  52.421 -18.324  10.428
  544    HB2  GLU  62           HB1      GLU  62  53.534 -20.532  10.569
  545    HB3  GLU  62           HB2      GLU  62  52.375 -21.073  11.804
  546    HG2  GLU  62           HG1      GLU  62  50.497 -20.941  10.142
  547    HG3  GLU  62           HG2      GLU  62  51.617 -20.305   8.879
  Start of MODEL   10
    1    H1   ALA   1           HT1      ALA   1  65.014   4.627   1.258
    2    H2   ALA   1           HT2      ALA   1  63.946   5.935   1.434
    3    H3   ALA   1           HT3      ALA   1  63.907   4.991   0.023
    4    HA   ALA   1           HA       ALA   1  63.172   3.072   1.272
    5    HB1  ALA   1           HB1      ALA   1  64.445   3.679   3.321
    6    HB2  ALA   1           HB2      ALA   1  63.280   5.003   3.668
    7    HB3  ALA   1           HB3      ALA   1  62.741   3.282   3.731
    8    H    SER   2           HN       SER   2  61.725   6.158   2.619
    9    HA   SER   2           HA       SER   2  59.283   5.460   1.177
   10    HB2  SER   2           HB1      SER   2  59.573   6.688   3.996
   11    HB3  SER   2           HB2      SER   2  58.009   6.605   3.127
   12    HG   SER   2           HG       SER   2  58.539   4.845   4.675
   13    H    MET   3           HN       MET   3  58.008   7.266   0.463
   14    HA   MET   3           HA       MET   3  59.658   9.148  -0.703
   15    HB2  MET   3           HB1      MET   3  57.591   9.939  -1.792
   16    HB3  MET   3           HB2      MET   3  57.767   8.167  -1.879
   17    HG2  MET   3           HG1      MET   3  56.119   8.019   0.145
   18    HG3  MET   3           HG2      MET   3  55.887   9.790  -0.015
   19    HE1  MET   3           HE1      MET   3  54.555   6.397  -2.889
   20    HE2  MET   3           HE2      MET   3  56.281   6.728  -2.517
   21    HE3  MET   3           HE3      MET   3  55.163   6.209  -1.210
   22    H    VAL   4           HN       VAL   4  57.443   9.531   2.063
   23    HA   VAL   4           HA       VAL   4  56.855  11.176   3.391
   24    HB   VAL   4           HB       VAL   4  59.642  12.245   3.159
   25   HG11  VAL   4          HG11      VAL   4  59.247  12.651   5.649
   26   HG12  VAL   4          HG12      VAL   4  58.086  13.559   4.636
   27   HG13  VAL   4          HG13      VAL   4  57.563  12.046   5.469
   28   HG21  VAL   4          HG21      VAL   4  60.174  10.471   4.959
   29   HG22  VAL   4          HG22      VAL   4  58.530   9.774   4.727
   30   HG23  VAL   4          HG23      VAL   4  59.741   9.710   3.396
   31    H    LEU   5           HN       LEU   5  55.751  11.850   0.975
   32    HA   LEU   5           HA       LEU   5  56.499  14.617   0.493
   33    HB2  LEU   5           HB1      LEU   5  56.747  13.078  -1.410
   34    HB3  LEU   5           HB2      LEU   5  55.076  12.496  -1.221
   35    HG   LEU   5           HG       LEU   5  54.200  14.724  -1.901
   36   HD11  LEU   5          HD11      LEU   5  55.804  16.457  -2.890
   37   HD12  LEU   5          HD12      LEU   5  56.068  16.232  -1.123
   38   HD13  LEU   5          HD13      LEU   5  57.199  15.480  -2.308
   39   HD21  LEU   5          HD21      LEU   5  54.946  14.625  -4.306
   40   HD22  LEU   5          HD22      LEU   5  56.314  13.559  -3.853
   41   HD23  LEU   5          HD23      LEU   5  54.621  12.989  -3.627
   42    H    SER   6           HN       SER   6  53.560  12.494   1.026
   43    HA   SER   6           HA       SER   6  52.261  14.860   2.121
   44    HB2  SER   6           HB1      SER   6  51.255  14.497  -0.171
   45    HB3  SER   6           HB2      SER   6  51.029  12.754   0.173
   46    HG   SER   6           HG       SER   6  49.150  14.199   0.395
   47    HA   PRO   7           HA       PRO   7  52.084  11.951   5.396
   48    HB2  PRO   7           HB2      PRO   7  50.249  13.002   7.133
   49    HB3  PRO   7           HB1      PRO   7  51.822  13.817   6.773
   50    HG2  PRO   7           HG2      PRO   7  49.177  14.498   5.438
   51    HG3  PRO   7           HG1      PRO   7  50.356  15.616   6.246
   52    HD2  PRO   7           HD2      PRO   7  50.389  15.116   3.514
   53    HD3  PRO   7           HD1      PRO   7  51.920  15.445   4.461
   54    H    ARG   8           HN       ARG   8  49.045  12.697   3.675
   55    HA   ARG   8           HA       ARG   8  47.434  10.751   4.936
   56    HB2  ARG   8           HB1      ARG   8  46.571  12.731   3.698
   57    HB3  ARG   8           HB2      ARG   8  47.245  12.121   2.169
   58    HG2  ARG   8           HG1      ARG   8  44.903  11.646   2.059
   59    HG3  ARG   8           HG2      ARG   8  45.638  10.078   2.438
   60    HD2  ARG   8           HD1      ARG   8  44.726  11.773   4.803
   61    HD3  ARG   8           HD2      ARG   8  43.481  10.862   3.852
   62    HE   ARG   8           HE       ARG   8  45.044   8.854   4.174
   63   HH11  ARG   8          HH11      ARG   8  45.116  10.490   7.957
   64   HH12  ARG   8          HH12      ARG   8  44.921  11.476   6.527
   65   HH21  ARG   8          HH21      ARG   8  45.335   8.135   7.666
   66   HH22  ARG   8          HH22      ARG   8  45.253   7.492   6.062
   67    H    ASP   9           HN       ASP   9  49.320  10.598   1.775
   68    HA   ASP   9           HA       ASP   9  48.380   7.959   1.410
   69    HB2  ASP   9           HB1      ASP   9  49.830   7.970  -0.628
   70    HB3  ASP   9           HB2      ASP   9  48.599   9.278  -0.589
   71    H    GLU  10           HN       GLU  10  51.552   9.371   2.737
   72    HA   GLU  10           HA       GLU  10  52.894   6.961   2.318
   73    HB2  GLU  10           HB1      GLU  10  54.643   7.810   3.754
   74    HB3  GLU  10           HB2      GLU  10  54.107   9.106   2.660
   75    HG2  GLU  10           HG1      GLU  10  52.775  10.134   4.543
   76    HG3  GLU  10           HG2      GLU  10  53.344   8.836   5.660
   77    H    ARG  11           HN       ARG  11  51.083   8.151   5.236
   78    HA   ARG  11           HA       ARG  11  51.854   5.964   6.863
   79    HB2  ARG  11           HB1      ARG  11  49.480   7.885   6.955
   80    HB3  ARG  11           HB2      ARG  11  49.770   6.691   8.242
   81    HG2  ARG  11           HG1      ARG  11  51.659   9.005   7.384
   82    HG3  ARG  11           HG2      ARG  11  50.617   9.022   8.818
   83    HD2  ARG  11           HD1      ARG  11  51.825   7.036   9.796
   84    HD3  ARG  11           HD2      ARG  11  53.014   7.092   8.430
   85    HE   ARG  11           HE       ARG  11  53.876   9.108   9.180
   86   HH11  ARG  11          HH11      ARG  11  51.478   9.157  12.543
   87   HH12  ARG  11          HH12      ARG  11  51.117   8.156  11.158
   88   HH21  ARG  11          HH21      ARG  11  53.420  10.535  12.447
   89   HH22  ARG  11          HH22      ARG  11  54.415  10.459  11.033
   90    H    THR  12           HN       THR  12  48.981   6.528   4.757
   91    HA   THR  12           HA       THR  12  47.666   4.188   5.567
   92    HB   THR  12           HB       THR  12  47.464   5.814   2.995
   93    HG1  THR  12           HG1      THR  12  45.661   6.743   4.051
   94   HG21  THR  12          HG21      THR  12  45.093   4.819   2.843
   95   HG22  THR  12          HG22      THR  12  46.248   3.455   3.018
   96   HG23  THR  12          HG23      THR  12  45.300   4.016   4.442
   97    H    LEU  13           HN       LEU  13  49.844   4.897   2.750
   98    HA   LEU  13           HA       LEU  13  49.477   2.416   1.543
   99    HB2  LEU  13           HB1      LEU  13  50.267   4.452   0.379
  100    HB3  LEU  13           HB2      LEU  13  51.745   4.490   1.368
  101    HG   LEU  13           HG       LEU  13  51.155   2.063  -0.364
  102   HD11  LEU  13          HD11      LEU  13  52.339   3.289  -2.310
  103   HD12  LEU  13          HD12      LEU  13  50.745   4.013  -1.888
  104   HD13  LEU  13          HD13      LEU  13  52.270   4.808  -1.348
  105   HD21  LEU  13          HD21      LEU  13  53.649   2.014  -0.676
  106   HD22  LEU  13          HD22      LEU  13  53.826   3.488   0.327
  107   HD23  LEU  13          HD23      LEU  13  53.196   1.973   1.067
  108    H    VAL  14           HN       VAL  14  52.100   3.508   3.951
  109    HA   VAL  14           HA       VAL  14  53.486   1.095   3.583
  110    HB   VAL  14           HB       VAL  14  54.762   1.576   5.563
  111   HG11  VAL  14          HG11      VAL  14  55.745   3.761   4.637
  112   HG12  VAL  14          HG12      VAL  14  55.424   2.573   3.338
  113   HG13  VAL  14          HG13      VAL  14  54.292   3.955   3.596
  114   HG21  VAL  14          HG21      VAL  14  54.479   3.712   6.809
  115   HG22  VAL  14          HG22      VAL  14  52.888   3.956   5.999
  116   HG23  VAL  14          HG23      VAL  14  53.150   2.541   7.081
  117    H    ARG  15           HN       ARG  15  50.820   2.000   5.847
  118    HA   ARG  15           HA       ARG  15  51.028  -0.302   7.459
  119    HB2  ARG  15           HB1      ARG  15  49.615   1.743   7.953
  120    HB3  ARG  15           HB2      ARG  15  48.523   1.317   6.614
  121    HG2  ARG  15           HG1      ARG  15  48.439  -1.055   8.038
  122    HG3  ARG  15           HG2      ARG  15  48.886   0.022   9.375
  123    HD2  ARG  15           HD1      ARG  15  46.363   0.318   7.636
  124    HD3  ARG  15           HD2      ARG  15  46.428  -0.126   9.390
  125    HE   ARG  15           HE       ARG  15  46.821   2.531   8.207
  126   HH11  ARG  15          HH11      ARG  15  46.956   3.983  11.496
  127   HH12  ARG  15          HH12      ARG  15  46.949   4.270   9.773
  128   HH21  ARG  15          HH21      ARG  15  46.962   1.720  12.247
  129   HH22  ARG  15          HH22      ARG  15  46.917   0.459  11.064
  130    H    LYS  16           HN       LYS  16  49.031   0.256   4.431
  131    HA   LYS  16           HA       LYS  16  47.981  -2.339   4.463
  132    HB2  LYS  16           HB1      LYS  16  48.363  -0.335   2.198
  133    HB3  LYS  16           HB2      LYS  16  47.575  -1.914   1.942
  134    HG2  LYS  16           HG1      LYS  16  45.922  -1.228   3.871
  135    HG3  LYS  16           HG2      LYS  16  46.649   0.410   3.780
  136    HD2  LYS  16           HD1      LYS  16  45.223  -1.103   1.489
  137    HD3  LYS  16           HD2      LYS  16  44.510   0.209   2.488
  138    HE2  LYS  16           HE1      LYS  16  46.351   1.779   1.600
  139    HE3  LYS  16           HE2      LYS  16  46.832   0.462   0.463
  140    HZ1  LYS  16           HZ1      LYS  16  45.245   1.982  -0.534
  141    HZ2  LYS  16           HZ2      LYS  16  44.564   0.434  -0.377
  142    HZ3  LYS  16           HZ3      LYS  16  44.114   1.671   0.693
  143    H    VAL  17           HN       VAL  17  50.917  -0.990   2.798
  144    HA   VAL  17           HA       VAL  17  51.525  -3.322   1.419
  145    HB   VAL  17           HB       VAL  17  53.159  -0.960   2.350
  146   HG11  VAL  17          HG11      VAL  17  54.922  -1.739   0.702
  147   HG12  VAL  17          HG12      VAL  17  54.751  -2.871   2.078
  148   HG13  VAL  17          HG13      VAL  17  54.022  -3.280   0.479
  149   HG21  VAL  17          HG21      VAL  17  52.982  -0.432  -0.173
  150   HG22  VAL  17          HG22      VAL  17  51.963  -1.904  -0.379
  151   HG23  VAL  17          HG23      VAL  17  51.374  -0.520   0.610
  152    H    GLN  18           HN       GLN  18  52.634  -2.261   4.781
  153    HA   GLN  18           HA       GLN  18  54.206  -4.531   5.120
  154    HB2  GLN  18           HB1      GLN  18  54.396  -2.415   6.421
  155    HB3  GLN  18           HB2      GLN  18  52.798  -2.688   7.161
  156    HG2  GLN  18           HG1      GLN  18  53.719  -4.804   8.296
  157    HG3  GLN  18           HG2      GLN  18  55.323  -4.482   7.560
  158   HE21  GLN  18          HE21      GLN  18  55.451  -1.337   9.702
  159   HE22  GLN  18          HE22      GLN  18  55.329  -1.568   7.970
  160    H    ILE  19           HN       ILE  19  50.696  -3.972   6.073
  161    HA   ILE  19           HA       ILE  19  50.643  -6.482   7.412
  162    HB   ILE  19           HB       ILE  19  48.562  -4.428   6.722
  163   HG12  ILE  19          HG11      ILE  19  49.876  -5.202   9.413
  164   HG13  ILE  19          HG12      ILE  19  50.243  -3.764   8.409
  165   HG21  ILE  19          HG21      ILE  19  46.933  -5.726   8.196
  166   HG22  ILE  19          HG22      ILE  19  47.533  -6.840   6.927
  167   HG23  ILE  19          HG23      ILE  19  48.202  -6.936   8.596
  168   HD11  ILE  19          HD11      ILE  19  48.783  -3.121  10.289
  169   HD12  ILE  19          HD12      ILE  19  47.881  -2.929   8.741
  170   HD13  ILE  19          HD13      ILE  19  47.550  -4.340   9.815
  171    H    ASN  20           HN       ASN  20  49.536  -5.292   4.187
  172    HA   ASN  20           HA       ASN  20  48.607  -7.996   3.644
  173    HB2  ASN  20           HB1      ASN  20  47.457  -5.241   2.808
  174    HB3  ASN  20           HB2      ASN  20  46.854  -6.767   2.092
  175   HD21  ASN  20          HD21      ASN  20  45.307  -7.810   5.285
  176   HD22  ASN  20          HD22      ASN  20  46.268  -8.494   3.997
  177    HA   PRO  21           HA       PRO  21  51.802  -6.601   0.482
  178    HB2  PRO  21           HB2      PRO  21  53.407  -8.816   0.419
  179    HB3  PRO  21           HB1      PRO  21  53.507  -7.594   1.747
  180    HG2  PRO  21           HG2      PRO  21  51.943 -10.207   1.865
  181    HG3  PRO  21           HG1      PRO  21  53.151  -9.565   3.056
  182    HD2  PRO  21           HD2      PRO  21  50.434  -9.116   3.348
  183    HD3  PRO  21           HD1      PRO  21  51.697  -7.907   3.889
  184    H    ARG  22           HN       ARG  22  49.592  -9.188   0.759
  185    HA   ARG  22           HA       ARG  22  49.678 -10.335  -1.800
  186    HB2  ARG  22           HB1      ARG  22  47.452 -10.007   0.268
  187    HB3  ARG  22           HB2      ARG  22  47.219 -10.979  -1.205
  188    HG2  ARG  22           HG1      ARG  22  49.252 -12.413  -0.459
  189    HG3  ARG  22           HG2      ARG  22  49.338 -11.458   1.033
  190    HD2  ARG  22           HD1      ARG  22  48.146 -13.529   1.557
  191    HD3  ARG  22           HD2      ARG  22  46.963 -12.162   1.676
  192    HE   ARG  22           HE       ARG  22  46.919 -13.070  -0.991
  193   HH11  ARG  22          HH11      ARG  22  44.876 -15.319   1.814
  194   HH12  ARG  22          HH12      ARG  22  46.252 -14.324   2.226
  195   HH21  ARG  22          HH21      ARG  22  44.180 -15.364  -0.474
  196   HH22  ARG  22          HH22      ARG  22  45.036 -14.381  -1.611
  197    H    THR  23           HN       THR  23  48.443  -7.120  -0.862
  198    HA   THR  23           HA       THR  23  46.283  -7.132  -2.615
  199    HB   THR  23           HB       THR  23  46.433  -5.624  -0.693
  200    HG1  THR  23           HG1      THR  23  45.730  -3.745  -1.770
  201   HG21  THR  23          HG21      THR  23  47.831  -3.525  -0.802
  202   HG22  THR  23          HG22      THR  23  48.911  -4.950  -0.973
  203   HG23  THR  23          HG23      THR  23  48.462  -3.984  -2.425
  204    H    THR  24           HN       THR  24  45.882  -6.388  -4.667
  205    HA   THR  24           HA       THR  24  48.020  -6.194  -6.479
  206    HB   THR  24           HB       THR  24  45.086  -5.412  -6.719
  207    HG1  THR  24           HG1      THR  24  44.960  -7.429  -7.798
  208   HG21  THR  24          HG21      THR  24  45.430  -5.652  -9.244
  209   HG22  THR  24          HG22      THR  24  46.659  -4.493  -8.631
  210   HG23  THR  24          HG23      THR  24  47.129  -6.192  -8.994
  211    H    ALA  25           HN       ALA  25  49.009  -4.463  -7.468
  212    HA   ALA  25           HA       ALA  25  49.355  -2.141  -5.929
  213    HB1  ALA  25           HB1      ALA  25  51.106  -3.174  -7.363
  214    HB2  ALA  25           HB2      ALA  25  50.178  -2.717  -8.834
  215    HB3  ALA  25           HB3      ALA  25  50.875  -1.437  -7.768
  216    H    LYS  26           HN       LYS  26  47.047  -2.778  -8.436
  217    HA   LYS  26           HA       LYS  26  46.493  -0.244  -9.392
  218    HB2  LYS  26           HB1      LYS  26  45.689  -2.377 -10.384
  219    HB3  LYS  26           HB2      LYS  26  44.677  -2.697  -8.952
  220    HG2  LYS  26           HG1      LYS  26  43.258  -1.893 -10.800
  221    HG3  LYS  26           HG2      LYS  26  43.287  -0.641  -9.513
  222    HD2  LYS  26           HD1      LYS  26  45.024   0.631 -10.825
  223    HD3  LYS  26           HD2      LYS  26  44.989  -0.642 -12.093
  224    HE2  LYS  26           HE1      LYS  26  42.602  -0.133 -12.612
  225    HE3  LYS  26           HE2      LYS  26  42.533   1.063 -11.262
  226    HZ1  LYS  26           HZ1      LYS  26  42.919   2.123 -13.388
  227    HZ2  LYS  26           HZ2      LYS  26  44.262   2.331 -12.371
  228    HZ3  LYS  26           HZ3      LYS  26  44.326   1.207 -13.637
  229    H    ASP  27           HN       ASP  27  45.312  -1.836  -6.322
  230    HA   ASP  27           HA       ASP  27  43.456   0.111  -5.660
  231    HB2  ASP  27           HB1      ASP  27  43.702  -2.222  -4.626
  232    HB3  ASP  27           HB2      ASP  27  45.220  -1.683  -3.830
  233    H    LEU  28           HN       LEU  28  47.026  -0.060  -4.942
  234    HA   LEU  28           HA       LEU  28  47.126   2.307  -3.474
  235    HB2  LEU  28           HB1      LEU  28  49.188   0.805  -5.169
  236    HB3  LEU  28           HB2      LEU  28  49.621   2.329  -4.361
  237    HG   LEU  28           HG       LEU  28  49.100   1.299  -2.161
  238   HD11  LEU  28          HD11      LEU  28  48.997  -1.260  -1.961
  239   HD12  LEU  28          HD12      LEU  28  47.533  -0.573  -2.755
  240   HD13  LEU  28          HD13      LEU  28  48.810  -1.369  -3.747
  241   HD21  LEU  28          HD21      LEU  28  51.174  -0.169  -2.107
  242   HD22  LEU  28          HD22      LEU  28  51.197  -0.189  -3.899
  243   HD23  LEU  28          HD23      LEU  28  51.412   1.365  -3.019
  244    H    VAL  29           HN       VAL  29  47.464   1.700  -7.037
  245    HA   VAL  29           HA       VAL  29  48.177   4.300  -7.742
  246    HB   VAL  29           HB       VAL  29  46.814   2.075  -9.282
  247   HG11  VAL  29          HG11      VAL  29  47.514   3.338 -11.371
  248   HG12  VAL  29          HG12      VAL  29  46.279   4.235 -10.439
  249   HG13  VAL  29          HG13      VAL  29  48.010   4.736 -10.354
  250   HG21  VAL  29          HG21      VAL  29  49.196   1.873 -10.254
  251   HG22  VAL  29          HG22      VAL  29  49.734   3.173  -9.127
  252   HG23  VAL  29          HG23      VAL  29  49.162   1.591  -8.485
  253    H    LYS  30           HN       LYS  30  44.860   2.771  -7.539
  254    HA   LYS  30           HA       LYS  30  43.472   5.037  -8.347
  255    HB2  LYS  30           HB1      LYS  30  42.490   2.766  -8.198
  256    HB3  LYS  30           HB2      LYS  30  42.704   2.750  -6.429
  257    HG2  LYS  30           HG1      LYS  30  41.047   4.667  -6.227
  258    HG3  LYS  30           HG2      LYS  30  40.875   4.701  -8.013
  259    HD2  LYS  30           HD1      LYS  30  38.972   3.561  -6.865
  260    HD3  LYS  30           HD2      LYS  30  39.837   2.479  -8.008
  261    HE2  LYS  30           HE1      LYS  30  40.937   1.269  -6.183
  262    HE3  LYS  30           HE2      LYS  30  40.395   2.485  -4.963
  263    HZ1  LYS  30           HZ1      LYS  30  39.012   0.516  -4.953
  264    HZ2  LYS  30           HZ2      LYS  30  38.111   1.868  -5.446
  265    HZ3  LYS  30           HZ3      LYS  30  38.622   0.726  -6.591
  266    H    MET  31           HN       MET  31  44.501   4.066  -4.981
  267    HA   MET  31           HA       MET  31  43.312   6.217  -3.687
  268    HB2  MET  31           HB1      MET  31  44.156   4.143  -2.593
  269    HB3  MET  31           HB2      MET  31  45.835   4.572  -3.007
  270    HG2  MET  31           HG1      MET  31  45.623   6.647  -1.504
  271    HG3  MET  31           HG2      MET  31  43.948   6.145  -1.102
  272    HE1  MET  31           HE1      MET  31  47.908   3.977   0.111
  273    HE2  MET  31           HE2      MET  31  47.345   4.082  -1.593
  274    HE3  MET  31           HE3      MET  31  47.809   5.575  -0.704
  275    H    LEU  32           HN       LEU  32  46.650   5.907  -5.082
  276    HA   LEU  32           HA       LEU  32  47.527   8.433  -4.347
  277    HB2  LEU  32           HB1      LEU  32  48.226   6.527  -6.643
  278    HB3  LEU  32           HB2      LEU  32  49.134   8.035  -6.392
  279    HG   LEU  32           HG       LEU  32  48.786   5.877  -4.208
  280   HD11  LEU  32          HD11      LEU  32  51.141   5.101  -4.860
  281   HD12  LEU  32          HD12      LEU  32  49.930   4.816  -6.163
  282   HD13  LEU  32          HD13      LEU  32  51.081   6.198  -6.286
  283   HD21  LEU  32          HD21      LEU  32  50.826   6.932  -3.194
  284   HD22  LEU  32          HD22      LEU  32  50.871   8.155  -4.504
  285   HD23  LEU  32          HD23      LEU  32  49.477   8.113  -3.364
  286    H    GLU  33           HN       GLU  33  45.848   7.361  -7.410
  287    HA   GLU  33           HA       GLU  33  45.917   9.842  -8.668
  288    HB2  GLU  33           HB1      GLU  33  45.428   7.679  -9.804
  289    HB3  GLU  33           HB2      GLU  33  43.907   7.520  -8.897
  290    HG2  GLU  33           HG1      GLU  33  42.983   9.560 -10.037
  291    HG3  GLU  33           HG2      GLU  33  44.538   9.811 -10.917
  292    H    GLU  34           HN       GLU  34  43.403   8.436  -6.426
  293    HA   GLU  34           HA       GLU  34  41.671  10.613  -6.537
  294    HB2  GLU  34           HB1      GLU  34  41.057   8.359  -5.681
  295    HB3  GLU  34           HB2      GLU  34  42.176   8.546  -4.312
  296    HG2  GLU  34           HG1      GLU  34  40.800  10.440  -3.406
  297    HG3  GLU  34           HG2      GLU  34  39.691  10.361  -4.826
  298    H    THR  35           HN       THR  35  44.472   9.963  -4.313
  299    HA   THR  35           HA       THR  35  44.133  12.259  -2.762
  300    HB   THR  35           HB       THR  35  46.658  10.710  -3.491
  301    HG1  THR  35           HG1      THR  35  46.345   9.790  -1.425
  302   HG21  THR  35          HG21      THR  35  47.657  11.711  -1.354
  303   HG22  THR  35          HG22      THR  35  47.069  13.067  -2.374
  304   HG23  THR  35          HG23      THR  35  46.096  12.516  -0.963
  305    H    GLY  36           HN       GLY  36  46.051  11.712  -5.757
  306    HA2  GLY  36           HA2      GLY  36  46.123  13.336  -7.418
  307    HA3  GLY  36           HA1      GLY  36  46.054  14.613  -6.128
  308    H    THR  37           HN       THR  37  48.097  12.677  -4.721
  309    HA   THR  37           HA       THR  37  50.434  14.061  -5.407
  310    HB   THR  37           HB       THR  37  50.040  11.366  -4.009
  311    HG1  THR  37           HG1      THR  37  50.275  12.603  -2.106
  312   HG21  THR  37          HG21      THR  37  52.307  11.816  -2.911
  313   HG22  THR  37          HG22      THR  37  52.518  11.951  -4.690
  314   HG23  THR  37          HG23      THR  37  52.394  13.439  -3.685
  315    H    LYS  38           HN       LYS  38  52.136  13.644  -6.913
  316    HA   LYS  38           HA       LYS  38  51.451  11.481  -8.719
  317    HB2  LYS  38           HB1      LYS  38  53.618  13.656  -8.848
  318    HB3  LYS  38           HB2      LYS  38  53.251  12.526 -10.177
  319    HG2  LYS  38           HG1      LYS  38  51.373  14.720  -9.013
  320    HG3  LYS  38           HG2      LYS  38  52.220  14.781 -10.595
  321    HD2  LYS  38           HD1      LYS  38  50.853  12.774 -11.335
  322    HD3  LYS  38           HD2      LYS  38  49.989  12.822  -9.762
  323    HE2  LYS  38           HE1      LYS  38  49.973  15.069 -11.900
  324    HE3  LYS  38           HE2      LYS  38  48.623  13.926 -11.539
  325    HZ1  LYS  38           HZ1      LYS  38  48.328  16.045 -10.448
  326    HZ2  LYS  38           HZ2      LYS  38  48.543  14.815  -9.298
  327    HZ3  LYS  38           HZ3      LYS  38  49.811  15.887  -9.638
  328    H    VAL  39           HN       VAL  39  52.272   9.510  -8.420
  329    HA   VAL  39           HA       VAL  39  54.987   9.184  -7.354
  330    HB   VAL  39           HB       VAL  39  52.506   7.577  -6.583
  331   HG11  VAL  39          HG11      VAL  39  54.092   6.412  -4.972
  332   HG12  VAL  39          HG12      VAL  39  54.557   6.135  -6.677
  333   HG13  VAL  39          HG13      VAL  39  55.469   7.328  -5.677
  334   HG21  VAL  39          HG21      VAL  39  52.947   8.507  -4.244
  335   HG22  VAL  39          HG22      VAL  39  54.228   9.568  -4.935
  336   HG23  VAL  39          HG23      VAL  39  52.507   9.786  -5.420
  337    H    SER  40           HN       SER  40  56.204   7.560  -8.566
  338    HA   SER  40           HA       SER  40  54.868   6.798 -10.942
  339    HB2  SER  40           HB1      SER  40  56.987   5.822 -11.670
  340    HB3  SER  40           HB2      SER  40  57.362   7.404 -10.917
  341    HG   SER  40           HG       SER  40  58.710   5.537 -10.346
  342    H    ILE  41           HN       ILE  41  54.788   4.562 -11.828
  343    HA   ILE  41           HA       ILE  41  53.674   2.711 -10.045
  344    HB   ILE  41           HB       ILE  41  54.749   2.480 -12.857
  345   HG12  ILE  41          HG11      ILE  41  52.919   4.056 -12.825
  346   HG13  ILE  41          HG12      ILE  41  52.334   2.539 -13.579
  347   HG21  ILE  41          HG21      ILE  41  53.406   0.293 -12.998
  348   HG22  ILE  41          HG22      ILE  41  54.495   0.179 -11.580
  349   HG23  ILE  41          HG23      ILE  41  52.749   0.555 -11.345
  350   HD11  ILE  41          HD11      ILE  41  50.598   3.472 -12.119
  351   HD12  ILE  41          HD12      ILE  41  51.182   1.916 -11.427
  352   HD13  ILE  41          HD13      ILE  41  51.711   3.482 -10.707
  353    H    SER  42           HN       SER  42  56.969   3.069 -11.439
  354    HA   SER  42           HA       SER  42  57.951   0.613 -10.611
  355    HB2  SER  42           HB1      SER  42  59.041   2.046 -12.355
  356    HB3  SER  42           HB2      SER  42  59.396   3.314 -11.140
  357    HG   SER  42           HG       SER  42  61.136   1.789 -11.719
  358    H    THR  43           HN       THR  43  58.026   3.851  -8.849
  359    HA   THR  43           HA       THR  43  59.526   2.801  -6.759
  360    HB   THR  43           HB       THR  43  58.693   4.725  -5.405
  361    HG1  THR  43           HG1      THR  43  57.743   6.392  -6.615
  362   HG21  THR  43          HG21      THR  43  60.112   6.353  -6.771
  363   HG22  THR  43          HG22      THR  43  60.835   4.713  -6.878
  364   HG23  THR  43          HG23      THR  43  59.869   5.360  -8.252
  365    H    VAL  44           HN       VAL  44  55.835   2.880  -7.104
  366    HA   VAL  44           HA       VAL  44  55.501   1.942  -4.476
  367    HB   VAL  44           HB       VAL  44  53.284   1.215  -5.062
  368   HG11  VAL  44          HG11      VAL  44  52.466   3.561  -5.705
  369   HG12  VAL  44          HG12      VAL  44  53.715   3.616  -4.425
  370   HG13  VAL  44          HG13      VAL  44  54.155   4.012  -6.129
  371   HG21  VAL  44          HG21      VAL  44  52.311   1.719  -7.315
  372   HG22  VAL  44          HG22      VAL  44  53.966   2.050  -7.946
  373   HG23  VAL  44          HG23      VAL  44  53.525   0.403  -7.369
  374    H    LYS  45           HN       LYS  45  56.074   0.190  -7.601
  375    HA   LYS  45           HA       LYS  45  55.735  -2.377  -6.577
  376    HB2  LYS  45           HB1      LYS  45  57.390  -1.231  -8.871
  377    HB3  LYS  45           HB2      LYS  45  57.375  -2.983  -8.540
  378    HG2  LYS  45           HG1      LYS  45  54.722  -1.467  -8.949
  379    HG3  LYS  45           HG2      LYS  45  55.734  -1.891 -10.372
  380    HD2  LYS  45           HD1      LYS  45  53.996  -3.558 -10.096
  381    HD3  LYS  45           HD2      LYS  45  55.580  -4.314  -9.720
  382    HE2  LYS  45           HE1      LYS  45  55.075  -4.226  -7.284
  383    HE3  LYS  45           HE2      LYS  45  53.496  -3.422  -7.629
  384    HZ1  LYS  45           HZ1      LYS  45  53.258  -5.813  -7.384
  385    HZ2  LYS  45           HZ2      LYS  45  52.876  -5.340  -8.970
  386    HZ3  LYS  45           HZ3      LYS  45  54.360  -6.093  -8.644
  387    H    ARG  46           HN       ARG  46  58.739  -0.320  -6.678
  388    HA   ARG  46           HA       ARG  46  60.410  -2.267  -5.527
  389    HB2  ARG  46           HB1      ARG  46  60.475   0.777  -5.483
  390    HB3  ARG  46           HB2      ARG  46  61.787  -0.192  -4.772
  391    HG2  ARG  46           HG1      ARG  46  60.821  -0.331  -7.729
  392    HG3  ARG  46           HG2      ARG  46  62.211   0.630  -7.192
  393    HD2  ARG  46           HD1      ARG  46  63.542  -1.285  -6.579
  394    HD3  ARG  46           HD2      ARG  46  62.156  -2.436  -6.769
  395    HE   ARG  46           HE       ARG  46  63.719  -1.156  -8.910
  396   HH11  ARG  46          HH11      ARG  46  61.746  -2.857 -11.412
  397   HH12  ARG  46          HH12      ARG  46  63.016  -1.696 -11.106
  398   HH21  ARG  46          HH21      ARG  46  60.550  -3.719  -9.545
  399   HH22  ARG  46          HH22      ARG  46  61.006  -3.198  -7.959
  400    H    VAL  47           HN       VAL  47  58.359   0.269  -3.873
  401    HA   VAL  47           HA       VAL  47  59.164  -0.378  -1.282
  402    HB   VAL  47           HB       VAL  47  56.629   0.845  -2.405
  403   HG11  VAL  47          HG11      VAL  47  56.166   1.661  -0.052
  404   HG12  VAL  47          HG12      VAL  47  56.039  -0.119  -0.171
  405   HG13  VAL  47          HG13      VAL  47  57.505   0.632   0.567
  406   HG21  VAL  47          HG21      VAL  47  57.752   2.963  -1.431
  407   HG22  VAL  47          HG22      VAL  47  59.167   1.957  -0.950
  408   HG23  VAL  47          HG23      VAL  47  58.765   2.188  -2.690
  409    H    LEU  48           HN       LEU  48  56.360  -1.703  -3.246
  410    HA   LEU  48           HA       LEU  48  55.522  -3.510  -1.327
  411    HB2  LEU  48           HB1      LEU  48  55.433  -3.452  -4.392
  412    HB3  LEU  48           HB2      LEU  48  54.719  -4.823  -3.512
  413    HG   LEU  48           HG       LEU  48  53.881  -1.912  -2.905
  414   HD11  LEU  48          HD11      LEU  48  51.937  -2.300  -4.526
  415   HD12  LEU  48          HD12      LEU  48  53.519  -2.295  -5.388
  416   HD13  LEU  48          HD13      LEU  48  52.684  -3.854  -5.039
  417   HD21  LEU  48          HD21      LEU  48  51.757  -3.016  -2.177
  418   HD22  LEU  48          HD22      LEU  48  52.406  -4.628  -2.618
  419   HD23  LEU  48          HD23      LEU  48  53.175  -3.684  -1.292
  420    H    TYR  49           HN       TYR  49  58.032  -3.938  -3.936
  421    HA   TYR  49           HA       TYR  49  58.333  -6.686  -3.511
  422    HB2  TYR  49           HB1      TYR  49  59.056  -5.326  -5.591
  423    HB3  TYR  49           HB2      TYR  49  60.435  -4.706  -4.634
  424    HD1  TYR  49           HD1      TYR  49  58.782  -7.676  -6.086
  425    HD2  TYR  49           HD2      TYR  49  62.382  -6.285  -4.188
  426    HE1  TYR  49           HE1      TYR  49  59.954  -9.752  -6.775
  427    HE2  TYR  49           HE2      TYR  49  63.540  -8.357  -4.877
  428    HH   TYR  49           HH       TYR  49  63.399 -10.287  -6.028
  429    H    ARG  50           HN       ARG  50  60.208  -3.842  -2.140
  430    HA   ARG  50           HA       ARG  50  61.875  -5.420  -0.569
  431    HB2  ARG  50           HB1      ARG  50  60.878  -2.581  -0.319
  432    HB3  ARG  50           HB2      ARG  50  61.799  -3.276   1.036
  433    HG2  ARG  50           HG1      ARG  50  62.783  -3.194  -1.904
  434    HG3  ARG  50           HG2      ARG  50  63.136  -1.906  -0.737
  435    HD2  ARG  50           HD1      ARG  50  64.326  -3.387   0.823
  436    HD3  ARG  50           HD2      ARG  50  63.835  -4.881  -0.078
  437    HE   ARG  50           HE       ARG  50  65.414  -4.524  -1.660
  438   HH11  ARG  50          HH11      ARG  50  66.699  -0.944  -0.045
  439   HH12  ARG  50          HH12      ARG  50  65.168  -1.665   0.385
  440   HH21  ARG  50          HH21      ARG  50  68.069  -2.100  -1.627
  441   HH22  ARG  50          HH22      ARG  50  67.509  -3.616  -2.245
  442    H    HIS  51           HN       HIS  51  58.591  -4.081   0.422
  443    HA   HIS  51           HA       HIS  51  58.877  -5.070   3.028
  444    HB2  HIS  51           HB1      HIS  51  56.478  -4.224   1.360
  445    HB3  HIS  51           HB2      HIS  51  56.264  -4.904   2.996
  446    HD1  HIS  51           HD1      HIS  51  58.525  -2.086   1.492
  447    HD2  HIS  51           HD2      HIS  51  56.085  -2.865   4.811
  448    HE1  HIS  51           HE1      HIS  51  58.593  -0.038   3.038
  449    H    ASN  52           HN       ASN  52  57.392  -6.602   0.068
  450    HA   ASN  52           HA       ASN  52  56.571  -8.868   1.464
  451    HB2  ASN  52           HB1      ASN  52  55.759  -8.005  -0.801
  452    HB3  ASN  52           HB2      ASN  52  57.310  -8.523  -1.532
  453   HD21  ASN  52          HD21      ASN  52  55.783 -11.623  -2.289
  454   HD22  ASN  52          HD22      ASN  52  56.679 -10.234  -2.853
  455    H    LEU  53           HN       LEU  53  59.695  -8.193  -0.356
  456    HA   LEU  53           HA       LEU  53  60.730 -10.737   0.066
  457    HB2  LEU  53           HB1      LEU  53  61.565  -9.163  -1.670
  458    HB3  LEU  53           HB2      LEU  53  62.054  -7.987  -0.427
  459    HG   LEU  53           HG       LEU  53  63.712  -9.690   0.429
  460   HD11  LEU  53          HD11      LEU  53  64.437 -11.550  -1.187
  461   HD12  LEU  53          HD12      LEU  53  62.796 -11.804  -0.488
  462   HD13  LEU  53          HD13      LEU  53  62.975 -11.207  -2.179
  463   HD21  LEU  53          HD21      LEU  53  65.389  -9.260  -1.421
  464   HD22  LEU  53          HD22      LEU  53  64.060  -8.720  -2.496
  465   HD23  LEU  53          HD23      LEU  53  64.424  -7.802  -0.990
  466    H    LYS  54           HN       LYS  54  61.246  -7.675   2.006
  467    HA   LYS  54           HA       LYS  54  62.329  -9.385   4.122
  468    HB2  LYS  54           HB1      LYS  54  64.190  -8.180   2.813
  469    HB3  LYS  54           HB2      LYS  54  63.391  -6.626   3.163
  470    HG2  LYS  54           HG1      LYS  54  63.717  -7.189   5.695
  471    HG3  LYS  54           HG2      LYS  54  64.730  -8.572   5.164
  472    HD2  LYS  54           HD1      LYS  54  65.239  -5.601   4.481
  473    HD3  LYS  54           HD2      LYS  54  66.017  -6.497   5.829
  474    HE2  LYS  54           HE1      LYS  54  67.073  -8.077   4.155
  475    HE3  LYS  54           HE2      LYS  54  66.339  -7.118   2.814
  476    HZ1  LYS  54           HZ1      LYS  54  68.596  -6.403   3.307
  477    HZ2  LYS  54           HZ2      LYS  54  67.491  -5.163   3.659
  478    HZ3  LYS  54           HZ3      LYS  54  68.179  -6.066   4.918
  479    H    GLY  55           HN       GLY  55  61.025  -9.138   5.953
  480    HA2  GLY  55           HA2      GLY  55  59.257  -6.831   5.908
  481    HA3  GLY  55           HA1      GLY  55  59.177  -8.299   6.974
  482    H    ARG  56           HN       ARG  56  60.372  -5.007   6.590
  483    HA   ARG  56           HA       ARG  56  62.157  -5.129   8.796
  484    HB2  ARG  56           HB1      ARG  56  62.243  -2.707   8.729
  485    HB3  ARG  56           HB2      ARG  56  62.495  -3.372   7.099
  486    HG2  ARG  56           HG1      ARG  56  60.256  -2.676   6.389
  487    HG3  ARG  56           HG2      ARG  56  59.719  -2.399   8.056
  488    HD2  ARG  56           HD1      ARG  56  62.034  -0.740   6.886
  489    HD3  ARG  56           HD2      ARG  56  60.307  -0.216   6.728
  490    HE   ARG  56           HE       ARG  56  60.081  -0.163   9.116
  491   HH11  ARG  56          HH11      ARG  56  64.176   0.130   9.450
  492   HH12  ARG  56          HH12      ARG  56  63.409  -0.350   7.955
  493   HH21  ARG  56          HH21      ARG  56  62.806   0.482  11.347
  494   HH22  ARG  56          HH22      ARG  56  61.094   0.292  11.182
  495    H    SER  57           HN       SER  57  62.013  -4.227  10.943
  496    HA   SER  57           HA       SER  57  59.413  -3.207  11.680
  497    HB2  SER  57           HB1      SER  57  59.396  -5.652  12.340
  498    HB3  SER  57           HB2      SER  57  60.951  -5.448  13.206
  499    HG   SER  57           HG       SER  57  58.933  -5.382  14.481
  500    H    ALA  58           HN       ALA  58  62.844  -3.838  12.661
  501    HA   ALA  58           HA       ALA  58  62.805  -1.282  14.156
  502    HB1  ALA  58           HB1      ALA  58  62.931  -3.275  15.646
  503    HB2  ALA  58           HB2      ALA  58  64.346  -3.890  14.725
  504    HB3  ALA  58           HB3      ALA  58  64.481  -2.364  15.681
  505    H    ARG  59           HN       ARG  59  65.660  -3.245  13.534
  506    HA   ARG  59           HA       ARG  59  66.678  -1.193  11.671
  507    HB2  ARG  59           HB1      ARG  59  68.137  -2.543  14.011
  508    HB3  ARG  59           HB2      ARG  59  68.969  -1.550  12.790
  509    HG2  ARG  59           HG1      ARG  59  67.412   0.417  13.554
  510    HG3  ARG  59           HG2      ARG  59  66.849  -0.630  14.869
  511    HD2  ARG  59           HD1      ARG  59  69.830   0.082  14.482
  512    HD3  ARG  59           HD2      ARG  59  68.732   0.907  15.664
  513    HE   ARG  59           HE       ARG  59  68.267  -1.550  16.444
  514   HH11  ARG  59          HH11      ARG  59  71.322  -2.816  17.849
  515   HH12  ARG  59          HH12      ARG  59  69.576  -2.849  17.881
  516   HH21  ARG  59          HH21      ARG  59  72.379  -1.289  16.354
  517   HH22  ARG  59          HH22      ARG  59  71.382  -0.309  15.335
  518    H    LYS  60           HN       LYS  60  68.060  -1.913  10.065
  519    HA   LYS  60           HA       LYS  60  68.861  -3.267   8.557
  520    HB2  LYS  60           HB1      LYS  60  69.658  -4.865  11.001
  521    HB3  LYS  60           HB2      LYS  60  70.243  -5.250   9.361
  522    HG2  LYS  60           HG1      LYS  60  71.234  -2.897   9.207
  523    HG3  LYS  60           HG2      LYS  60  70.644  -2.560  10.868
  524    HD2  LYS  60           HD1      LYS  60  72.291  -3.885  11.865
  525    HD3  LYS  60           HD2      LYS  60  72.283  -5.086  10.529
  526    HE2  LYS  60           HE1      LYS  60  73.597  -2.292  10.316
  527    HE3  LYS  60           HE2      LYS  60  74.478  -3.805  10.749
  528    HZ1  LYS  60           HZ1      LYS  60  74.614  -3.325   8.392
  529    HZ2  LYS  60           HZ2      LYS  60  73.751  -4.763   8.654
  530    HZ3  LYS  60           HZ3      LYS  60  72.923  -3.341   8.248
  531    H    LEU  61           HN       LEU  61  68.813  -6.431   9.712
  532    HA   LEU  61           HA       LEU  61  67.106  -7.247   7.679
  533    HB2  LEU  61           HB1      LEU  61  69.089  -8.510   8.539
  534    HB3  LEU  61           HB2      LEU  61  68.301  -8.718  10.120
  535    HG   LEU  61           HG       LEU  61  66.466 -10.057   8.927
  536   HD11  LEU  61          HD11      LEU  61  67.078 -11.005   6.629
  537   HD12  LEU  61          HD12      LEU  61  66.792  -9.228   6.598
  538   HD13  LEU  61          HD13      LEU  61  68.475  -9.872   6.562
  539   HD21  LEU  61          HD21      LEU  61  67.865 -12.139   8.737
  540   HD22  LEU  61          HD22      LEU  61  69.362 -11.155   8.752
  541   HD23  LEU  61          HD23      LEU  61  68.287 -11.172  10.196
  542    H    GLU  62           HN       GLU  62  66.597  -7.068  11.257
  543    HA   GLU  62           HA       GLU  62  63.748  -7.587  10.811
  544    HB2  GLU  62           HB1      GLU  62  65.574  -8.615  13.062
  545    HB3  GLU  62           HB2      GLU  62  63.801  -8.698  13.149
  546    HG2  GLU  62           HG1      GLU  62  65.453 -10.051  10.906
  547    HG3  GLU  62           HG2      GLU  62  64.950 -10.897  12.417