*HEADER    TRANSCRIPTION                           22-JUN-17   5W8Y              
*TITLE     SOLUTION STRUCTURE OF XPH1, A HYBRID SEQUENCE OF XFASO 1 AND PFL 6,   
*TITLE    2 TWO CRO PROTEINS WITH DIFFERENT FOLDS                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROTEIN XPH1;                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: XYLELLA FASTIDIOSA SUBSP. SANDYI ANN-1;         
*SOURCE   3 ORGANISM_TAXID: 155920;                                              
*SOURCE   4 GENE: D934_07735, D934_08955;                                        
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET21B                                    
*KEYWDS    HELIX-TURN-HELIX, STRUCTURAL EVOLUTION, CONFORMATIONAL SWITCH,        
*KEYWDS   2 METAMORPHIC PROTEIN, DISULFIDE BOND, TRANSCRIPTION FACTOR,           
*KEYWDS   3 TRANSCRIPTION                                                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    V.K.KUMIROV,E.M.DYKSTRA,M.H.CORDES                                    
*REVDAT   1   11-JUL-18 5W8Y    0                                                
# Restraints file 1: xph1_dihe.tbl
assign (resid    1 and name C    ) (resid    2 and name N    )
       (resid    2 and name CA   ) (resid    2 and name C    )    1.0 -110.4   50.8 2
assign (resid    2 and name N    ) (resid    2 and name CA   )
       (resid    2 and name C    ) (resid    3 and name N    )    1.0  162.9   20.0 2
assign (resid    2 and name C    ) (resid    3 and name N    )
       (resid    3 and name CA   ) (resid    3 and name C    )    1.0  -59.7   20.0 2
assign (resid    3 and name N    ) (resid    3 and name CA   )
       (resid    3 and name C    ) (resid    4 and name N    )    1.0  -36.2   20.0 2
assign (resid    3 and name C    ) (resid    4 and name N    )
       (resid    4 and name CA   ) (resid    4 and name C    )    1.0  -64.2   20.0 2
assign (resid    4 and name N    ) (resid    4 and name CA   )
       (resid    4 and name C    ) (resid    5 and name N    )    1.0  -43.7   20.0 2
assign (resid    4 and name C    ) (resid    5 and name N    )
       (resid    5 and name CA   ) (resid    5 and name C    )    1.0  -62.6   20.0 2
assign (resid    5 and name N    ) (resid    5 and name CA   )
       (resid    5 and name C    ) (resid    6 and name N    )    1.0  -42.2   20.0 2
assign (resid    5 and name C    ) (resid    6 and name N    )
       (resid    6 and name CA   ) (resid    6 and name C    )    1.0  -66.7   20.0 2
assign (resid    6 and name N    ) (resid    6 and name CA   )
       (resid    6 and name C    ) (resid    7 and name N    )    1.0  -39.6   20.0 2
assign (resid    6 and name C    ) (resid    7 and name N    )
       (resid    7 and name CA   ) (resid    7 and name C    )    1.0  -65.1   20.0 2
assign (resid    7 and name N    ) (resid    7 and name CA   )
       (resid    7 and name C    ) (resid    8 and name N    )    1.0  -41.9   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  -62.8   20.0 2
assign (resid    8 and name N    ) (resid    8 and name CA   )
       (resid    8 and name C    ) (resid    9 and name N    )    1.0  -43.1   20.0 2
assign (resid    8 and name C    ) (resid    9 and name N    )
       (resid    9 and name CA   ) (resid    9 and name C    )    1.0  -65.4   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  -40.7   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  -67.9   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  -29.4   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  -81.6   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  -14.7   22.1 2
assign (resid   11 and name C    ) (resid   12 and name N    )
       (resid   12 and name CA   ) (resid   12 and name C    )    1.0   86.5   26.4 2
assign (resid   12 and name N    ) (resid   12 and name CA   )
       (resid   12 and name C    ) (resid   13 and name N    )    1.0    1.5   39.4 2
assign (resid   12 and name C    ) (resid   13 and name N    )
       (resid   13 and name CA   ) (resid   13 and name C    )    1.0 -147.6   60.8 2
assign (resid   13 and name N    ) (resid   13 and name CA   )
       (resid   13 and name C    ) (resid   14 and name N    )    1.0  156.1   21.0 2
assign (resid   13 and name C    ) (resid   14 and name N    )
       (resid   14 and name CA   ) (resid   14 and name C    )    1.0  -62.4   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  -39.8   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  -59.9   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  -41.0   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  -66.8   20.0 2
assign (resid   16 and name N    ) (resid   16 and name CA   )
       (resid   16 and name C    ) (resid   17 and name N    )    1.0  -36.8   20.0 2
assign (resid   16 and name C    ) (resid   17 and name N    )
       (resid   17 and name CA   ) (resid   17 and name C    )    1.0  -65.1   20.0 2
assign (resid   17 and name N    ) (resid   17 and name CA   )
       (resid   17 and name C    ) (resid   18 and name N    )    1.0  -43.9   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  -61.1   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  -42.5   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  -65.3   20.0 2
assign (resid   19 and name N    ) (resid   19 and name CA   )
       (resid   19 and name C    ) (resid   20 and name N    )    1.0  -39.1   20.0 2
assign (resid   19 and name C    ) (resid   20 and name N    )
       (resid   20 and name CA   ) (resid   20 and name C    )    1.0  -64.1   20.0 2
assign (resid   20 and name N    ) (resid   20 and name CA   )
       (resid   20 and name C    ) (resid   21 and name N    )    1.0  -34.8   20.0 2
assign (resid   20 and name C    ) (resid   21 and name N    )
       (resid   21 and name CA   ) (resid   21 and name C    )    1.0  -88.6   20.0 2
assign (resid   21 and name N    ) (resid   21 and name CA   )
       (resid   21 and name C    ) (resid   22 and name N    )    1.0  -12.6   20.0 2
assign (resid   21 and name C    ) (resid   22 and name N    )
       (resid   22 and name CA   ) (resid   22 and name C    )    1.0   71.1   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   36.7   20.0 2
assign (resid   22 and name C    ) (resid   23 and name N    )
       (resid   23 and name CA   ) (resid   23 and name C    )    1.0 -126.1   20.0 2
assign (resid   23 and name N    ) (resid   23 and name CA   )
       (resid   23 and name C    ) (resid   24 and name N    )    1.0  164.9   20.0 2
assign (resid   23 and name C    ) (resid   24 and name N    )
       (resid   24 and name CA   ) (resid   24 and name C    )    1.0  -73.3   20.0 2
assign (resid   24 and name N    ) (resid   24 and name CA   )
       (resid   24 and name C    ) (resid   25 and name N    )    1.0  154.4   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  -59.2   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  -37.5   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  -64.2   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  -34.2   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  -68.4   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  -40.5   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  -65.5   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  -38.9   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  -64.5   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  -40.2   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  -64.9   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  -41.5   20.0 2
assign (resid   30 and name C    ) (resid   31 and name N    )
       (resid   31 and name CA   ) (resid   31 and name C    )    1.0  -61.1   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  -40.9   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  -64.1   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  -40.7   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  -68.8   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  -30.7   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  -92.5   20.4 2
assign (resid   34 and name N    ) (resid   34 and name CA   )
       (resid   34 and name C    ) (resid   35 and name N    )    1.0   -3.2   25.6 2
assign (resid   34 and name C    ) (resid   35 and name N    )
       (resid   35 and name CA   ) (resid   35 and name C    )    1.0   73.8   20.8 2
assign (resid   35 and name N    ) (resid   35 and name CA   )
       (resid   35 and name C    ) (resid   36 and name N    )    1.0   23.3   29.6 2
assign (resid   35 and name C    ) (resid   36 and name N    )
       (resid   36 and name CA   ) (resid   36 and name C    )    1.0 -132.7   33.0 2
assign (resid   36 and name N    ) (resid   36 and name CA   )
       (resid   36 and name C    ) (resid   37 and name N    )    1.0  156.8   20.0 2
assign (resid   36 and name C    ) (resid   37 and name N    )
       (resid   37 and name CA   ) (resid   37 and name C    )    1.0  -86.4   36.2 2
assign (resid   37 and name N    ) (resid   37 and name CA   )
       (resid   37 and name C    ) (resid   38 and name N    )    1.0  125.4   34.1 2
assign (resid   38 and name N    ) (resid   38 and name CA   )
       (resid   38 and name C    ) (resid   39 and name N    )    1.0  148.0   20.0 2
assign (resid   38 and name C    ) (resid   39 and name N    )
       (resid   39 and name CA   ) (resid   39 and name C    )    1.0  -59.3   20.0 2
assign (resid   39 and name N    ) (resid   39 and name CA   )
       (resid   39 and name C    ) (resid   40 and name N    )    1.0  138.2   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  -60.8   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  -38.4   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  -66.3   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  -37.1   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  -67.7   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  -37.1   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  -68.6   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  -36.3   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  -64.3   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  -29.9   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  -70.0   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  -25.7   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 -106.6   20.0 2
assign (resid   48 and name N    ) (resid   48 and name CA   )
       (resid   48 and name C    ) (resid   49 and name N    )    1.0    1.0   26.9 2
assign (resid   49 and name C    ) (resid   50 and name N    )
       (resid   50 and name CA   ) (resid   50 and name C    )    1.0  -86.2   55.0 2
assign (resid   50 and name N    ) (resid   50 and name CA   )
       (resid   50 and name C    ) (resid   51 and name N    )    1.0  -13.8   55.9 2
assign (resid   51 and name C    ) (resid   52 and name N    )
       (resid   52 and name CA   ) (resid   52 and name C    )    1.0  -70.3   20.0 2
assign (resid   52 and name N    ) (resid   52 and name CA   )
       (resid   52 and name C    ) (resid   53 and name N    )    1.0  -31.3   20.0 2
assign (resid   52 and name C    ) (resid   53 and name N    )
       (resid   53 and name CA   ) (resid   53 and name C    )    1.0 -129.7   21.5 2
assign (resid   53 and name N    ) (resid   53 and name CA   )
       (resid   53 and name C    ) (resid   54 and name N    )    1.0  142.3   29.4 2
assign (resid   53 and name C    ) (resid   54 and name N    )
       (resid   54 and name CA   ) (resid   54 and name C    )    1.0  -82.9   20.0 2
assign (resid   54 and name N    ) (resid   54 and name CA   )
       (resid   54 and name C    ) (resid   55 and name N    )    1.0  121.3   29.1 2
assign (resid   54 and name C    ) (resid   55 and name N    )
       (resid   55 and name CA   ) (resid   55 and name C    )    1.0  -74.3   22.1 2
assign (resid   55 and name N    ) (resid   55 and name CA   )
       (resid   55 and name C    ) (resid   56 and name N    )    1.0  125.9   20.0 2
assign (resid   55 and name C    ) (resid   56 and name N    )
       (resid   56 and name CA   ) (resid   56 and name C    )    1.0 -119.9   26.7 2
assign (resid   56 and name N    ) (resid   56 and name CA   )
       (resid   56 and name C    ) (resid   57 and name N    )    1.0  144.3   28.9 2
assign (resid   56 and name C    ) (resid   57 and name N    )
       (resid   57 and name CA   ) (resid   57 and name C    )    1.0 -116.2   25.0 2
assign (resid   57 and name N    ) (resid   57 and name CA   )
       (resid   57 and name C    ) (resid   58 and name N    )    1.0  139.3   22.8 2
assign (resid   57 and name C    ) (resid   58 and name N    )
       (resid   58 and name CA   ) (resid   58 and name C    )    1.0  -76.4   21.5 2
assign (resid   58 and name N    ) (resid   58 and name CA   )
       (resid   58 and name C    ) (resid   59 and name N    )    1.0  136.8   23.1 2
assign (resid   58 and name C    ) (resid   59 and name N    )
       (resid   59 and name CA   ) (resid   59 and name C    )    1.0  -67.5   20.0 2
assign (resid   59 and name N    ) (resid   59 and name CA   )
       (resid   59 and name C    ) (resid   60 and name N    )    1.0  140.9   23.3 2
assign (resid    4 and name N    ) (resid    4 and name CA   )
       (resid    4 and name CB   ) (resid    4 and name CG1  )    1.0  -60.0   40.0 2
assign (resid    6 and name N    ) (resid    6 and name CA   )
       (resid    6 and name CB   ) (resid    6 and name CG1  )    1.0  -60.0   40.0 2
assign (resid    8 and name N    ) (resid    8 and name CA   )
       (resid    8 and name CB   ) (resid    8 and name CG1  )    1.0  -60.0   40.0 2
assign (resid   11 and name N    ) (resid   11 and name CA   )
       (resid   11 and name CB   ) (resid   11 and name CG   )    1.0  -60.0   40.0 2
assign (resid   13 and name N    ) (resid   13 and name CA   )
       (resid   13 and name CB   ) (resid   13 and name OG   )    1.0   60.0   40.0 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
       (resid   14 and name CB   ) (resid   14 and name CG1  )    1.0  180.0   40.0 2
assign (resid   21 and name N    ) (resid   21 and name CA   )
       (resid   21 and name CB   ) (resid   21 and name CG   )    1.0  -60.0   40.0 2
assign (resid   23 and name N    ) (resid   23 and name CA   )
       (resid   23 and name CB   ) (resid   23 and name CG1  )    1.0  -60.0   40.0 2
assign (resid   28 and name N    ) (resid   28 and name CA   )
       (resid   28 and name CB   ) (resid   28 and name CG1  )    1.0  -60.0   40.0 2
assign (resid   43 and name N    ) (resid   43 and name CA   )
       (resid   43 and name CB   ) (resid   43 and name CG1  )    1.0  -60.0   40.0 2
assign (resid   45 and name N    ) (resid   45 and name CA   )
       (resid   45 and name CB   ) (resid   45 and name CG1  )    1.0  -60.0   40.0 2
assign (resid   48 and name N    ) (resid   48 and name CA   )
       (resid   48 and name CB   ) (resid   48 and name CG   )    1.0  -60.0   40.0 2
assign (resid   49 and name N    ) (resid   49 and name CA   )
       (resid   49 and name CB   ) (resid   49 and name OG1  )    1.0   60.0   40.0 2
# Restraints file 2: xph1_hbond.tbl
assign (resid    2 and name O    ) (resid    6 and name HN   )   2.50   2.50   0.00
assign (resid    2 and name O    ) (resid    6 and name N    )   3.50   3.50   0.00
assign (resid    3 and name O    ) (resid    7 and name HN   )   2.50   2.50   0.00
assign (resid    3 and name O    ) (resid    7 and name N    )   3.50   3.50   0.00
assign (resid    4 and name O    ) (resid    8 and name HN   )   2.50   2.50   0.00
assign (resid    4 and name O    ) (resid    8 and name N    )   3.50   3.50   0.00
assign (resid    5 and name O    ) (resid    9 and name HN   )   2.50   2.50   0.00
assign (resid    5 and name O    ) (resid    9 and name N    )   3.50   3.50   0.00
assign (resid    6 and name O    ) (resid   10 and name HN   )   2.50   2.50   0.00
assign (resid    6 and name O    ) (resid   10 and name N    )   3.50   3.50   0.00
assign (resid    7 and name O    ) (resid   11 and name HN   )   2.50   2.50   0.00
assign (resid    7 and name O    ) (resid   11 and name N    )   3.50   3.50   0.00
assign (resid   14 and name O    ) (resid   18 and name HN   )   2.50   2.50   0.00
assign (resid   14 and name O    ) (resid   18 and name N    )   3.50   3.50   0.00
assign (resid   15 and name O    ) (resid   19 and name HN   )   2.50   2.50   0.00
assign (resid   15 and name O    ) (resid   19 and name N    )   3.50   3.50   0.00
assign (resid   16 and name O    ) (resid   20 and name HN   )   2.50   2.50   0.00
assign (resid   16 and name O    ) (resid   20 and name N    )   3.50   3.50   0.00
assign (resid   17 and name O    ) (resid   21 and name HN   )   2.50   2.50   0.00
assign (resid   17 and name O    ) (resid   21 and name N    )   3.50   3.50   0.00
assign (resid   25 and name O    ) (resid   29 and name HN   )   2.50   2.50   0.00
assign (resid   25 and name O    ) (resid   29 and name N    )   3.50   3.50   0.00
assign (resid   26 and name O    ) (resid   30 and name HN   )   2.50   2.50   0.00
assign (resid   26 and name O    ) (resid   30 and name N    )   3.50   3.50   0.00
assign (resid   27 and name O    ) (resid   31 and name HN   )   2.50   2.50   0.00
assign (resid   27 and name O    ) (resid   31 and name N    )   3.50   3.50   0.00
assign (resid   28 and name O    ) (resid   32 and name HN   )   2.50   2.50   0.00
assign (resid   28 and name O    ) (resid   32 and name N    )   3.50   3.50   0.00
assign (resid   29 and name O    ) (resid   33 and name HN   )   2.50   2.50   0.00
assign (resid   29 and name O    ) (resid   33 and name N    )   3.50   3.50   0.00
assign (resid   30 and name O    ) (resid   34 and name HN   )   2.50   2.50   0.00
assign (resid   30 and name O    ) (resid   34 and name N    )   3.50   3.50   0.00
assign (resid   41 and name O    ) (resid   45 and name HN   )   2.50   2.50   0.00
assign (resid   41 and name O    ) (resid   45 and name N    )   3.50   3.50   0.00
assign (resid   42 and name O    ) (resid   46 and name HN   )   2.50   2.50   0.00
assign (resid   42 and name O    ) (resid   46 and name N    )   3.50   3.50   0.00
assign (resid   43 and name O    ) (resid   47 and name HN   )   2.50   2.50   0.00
assign (resid   43 and name O    ) (resid   47 and name N    )   3.50   3.50   0.00
assign (resid   44 and name O    ) (resid   48 and name HN   )   2.50   2.50   0.00
assign (resid   44 and name O    ) (resid   48 and name N    )   3.50   3.50   0.00
assign (resid   45 and name O    ) (resid   49 and name HN   )   2.50   2.50   0.00
assign (resid   45 and name O    ) (resid   49 and name N    )   3.50   3.50   0.00
# Restraints file 3: xph1_noe.tbl
assign (resid   28 and name HA   ) (resid   28 and name HD1* )   3.91   3.91   0.00
assign (resid   18 and name HA   ) (resid   28 and name HD1* )   4.28   4.28   0.00
assign (resid   28 and name HD1* ) (resid   31 and name HZ3  )   4.85   4.85   0.00
assign (resid   28 and name HD1* ) (resid   31 and name HE3  )   4.76   4.76   0.00
assign (resid   17 and name HG   ) (resid   28 and name HD1* )   4.74   4.74   0.00
assign (resid   28 and name HG2* ) (resid   28 and name HD1* )   3.71   3.71   0.00
assign (resid   45 and name HA   ) (resid   45 and name HD1* )   4.03   4.03   0.00
assign (resid   31 and name HZ3  ) (resid   45 and name HD1* )   4.57   4.57   0.00
assign (resid    1 and name HB*  ) (resid    6 and name HD1* )   4.61   4.61   0.00
assign (resid   43 and name HB   ) (resid   43 and name HD1* )   3.92   3.92   0.00
assign (resid   43 and name HA   ) (resid   43 and name HD1* )   4.73   4.73   0.00
assign (resid    8 and name HD1* ) (resid   32 and name HD2  )   4.38   4.38   0.00
assign (resid    8 and name HD1* ) (resid   14 and name HA   )   4.79   4.79   0.00
assign (resid    8 and name HD1* ) (resid   32 and name HD1  )   4.38   4.38   0.00
assign (resid    4 and name HB   ) (resid    4 and name HD1* )   3.66   3.66   0.00
assign (resid    4 and name HD1* ) (resid   32 and name HA   )   4.15   4.15   0.00
assign (resid    4 and name HA   ) (resid    4 and name HD1* )   4.13   4.13   0.00
assign (resid    8 and name HG2* ) (resid   14 and name HG2* )   3.54   3.54   0.00
assign (resid    8 and name HA   ) (resid    8 and name HG2* )   3.72   3.72   0.00
assign (resid    8 and name HG2* ) (resid   14 and name HA   )   4.30   4.30   0.00
assign (resid    8 and name HG2* ) (resid   13 and name HA   )   4.16   4.16   0.00
assign (resid   43 and name HG2* ) (resid   43 and name HG11 )   3.84   3.84   0.00
assign (resid   43 and name HG2* ) (resid   43 and name HG12 )   3.84   3.84   0.00
assign (resid   43 and name HA   ) (resid   43 and name HG2* )   3.85   3.85   0.00
assign (resid    6 and name HA   ) (resid    6 and name HG2* )   3.77   3.77   0.00
assign (resid    6 and name HG2* ) (resid    6 and name HD1* )   3.72   3.72   0.00
assign (resid    4 and name HA   ) (resid   45 and name HG2* )   4.74   4.74   0.00
assign (resid   45 and name HA   ) (resid   45 and name HG2* )   3.97   3.97   0.00
assign (resid   42 and name HA   ) (resid   45 and name HG2* )   4.14   4.14   0.00
assign (resid   23 and name HG2* ) (resid   28 and name HD1* )   3.64   3.64   0.00
assign (resid   21 and name HB1  ) (resid   23 and name HG2* )   3.98   3.98   0.00
assign (resid   23 and name HA   ) (resid   23 and name HG2* )   4.21   4.21   0.00
assign (resid   23 and name HG2* ) (resid   31 and name HH2  )   4.42   4.42   0.00
assign (resid   23 and name HG2* ) (resid   31 and name HZ2  )   4.91   4.91   0.00
assign (resid   23 and name HG2* ) (resid   28 and name HG2* )   4.02   4.02   0.00
assign (resid   28 and name HA   ) (resid   28 and name HG2* )   3.81   3.81   0.00
assign (resid   14 and name HA   ) (resid   28 and name HG2* )   4.35   4.35   0.00
assign (resid   23 and name HG1* ) (resid   31 and name HH2  )   4.00   4.00   0.00
assign (resid   23 and name HG1* ) (resid   31 and name HZ2  )   4.14   4.14   0.00
assign (resid    3 and name HB*  ) (resid   53 and name HG2* )   3.65   3.65   0.00
assign (resid    3 and name HB*  ) (resid   53 and name HG1* )   3.63   3.63   0.00
assign (resid    4 and name HA   ) (resid    4 and name HG2* )   3.66   3.66   0.00
assign (resid    4 and name HG2* ) (resid   31 and name HB1  )   4.61   4.61   0.00
assign (resid   23 and name HG1* ) (resid   31 and name HE3  )   4.91   4.91   0.00
assign (resid    3 and name HA   ) (resid   53 and name HG2* )   4.18   4.18   0.00
assign (resid    3 and name HA   ) (resid   53 and name HG1* )   4.00   4.00   0.00
assign (resid   53 and name HA   ) (resid   53 and name HG2* )   3.65   3.65   0.00
assign (resid   53 and name HA   ) (resid   53 and name HG1* )   3.97   3.97   0.00
assign (resid   53 and name HG1* ) (resid   55 and name HA   )   4.32   4.32   0.00
assign (resid   53 and name HG2* ) (resid   55 and name HA   )   4.77   4.77   0.00
assign (resid    2 and name HA   ) (resid   53 and name HG1* )   4.33   4.33   0.00
assign (resid    2 and name HA   ) (resid   53 and name HG2* )   4.70   4.70   0.00
assign (resid   14 and name HA   ) (resid   14 and name HG1* )   3.44   3.44   0.00
assign (resid   14 and name HG1* ) (resid   15 and name HA   )   4.21   4.21   0.00
assign (resid   14 and name HG1* ) (resid   18 and name HB*  )   4.08   4.08   0.00
assign (resid   62 and name HA   ) (resid   62 and name HG1* )   3.84   3.84   0.00
assign (resid   37 and name HG2* ) (resid   57 and name HG1  )   4.62   4.62   0.00
assign (resid   37 and name HG2* ) (resid   57 and name HG2  )   4.62   4.62   0.00
assign (resid   37 and name HG2* ) (resid   39 and name HA   )   4.61   4.61   0.00
assign (resid    7 and name HB*  ) (resid   11 and name HD2* )   3.83   3.83   0.00
assign (resid   11 and name HA   ) (resid   11 and name HD2* )   3.29   3.29   0.00
assign (resid   11 and name HD2* ) (resid   17 and name HA   )   4.87   4.87   0.00
assign (resid   11 and name HD2* ) (resid   48 and name HE*  )   4.08   4.08   0.00
assign (resid   11 and name HD2* ) (resid   48 and name HD*  )   4.18   4.18   0.00
assign (resid   11 and name HA   ) (resid   11 and name HD1* )   4.35   4.35   0.00
assign (resid   11 and name HD1* ) (resid   48 and name HE*  )   4.56   4.56   0.00
assign (resid   11 and name HD1* ) (resid   48 and name HD*  )   4.74   4.74   0.00
assign (resid   45 and name HG2* ) (resid   49 and name HG2* )   3.27   3.27   0.00
assign (resid    7 and name HB*  ) (resid   49 and name HG2* )   3.55   3.55   0.00
assign (resid    6 and name HB   ) (resid   49 and name HG2* )   3.72   3.72   0.00
assign (resid    6 and name HG2* ) (resid   49 and name HG2* )   3.59   3.59   0.00
assign (resid    3 and name HA   ) (resid   49 and name HG2* )   4.09   4.09   0.00
assign (resid   14 and name HG2* ) (resid   17 and name HG   )   4.74   4.74   0.00
assign (resid   14 and name HG2* ) (resid   28 and name HG2* )   3.00   3.00   0.00
assign (resid   14 and name HA   ) (resid   14 and name HG2* )   3.49   3.49   0.00
assign (resid   21 and name HD2* ) (resid   44 and name HB*  )   3.53   3.53   0.00
assign (resid   21 and name HD2* ) (resid   45 and name HA   )   4.80   4.80   0.00
assign (resid   21 and name HA   ) (resid   21 and name HD2* )   3.44   3.44   0.00
assign (resid   21 and name HD2* ) (resid   31 and name HH2  )   4.47   4.47   0.00
assign (resid   21 and name HD2* ) (resid   48 and name HD*  )   4.69   4.69   0.00
assign (resid   21 and name HD1* ) (resid   28 and name HD1* )   3.95   3.95   0.00
assign (resid   21 and name HD1* ) (resid   45 and name HG2* )   3.86   3.86   0.00
assign (resid   17 and name HG   ) (resid   21 and name HD1* )   3.73   3.73   0.00
assign (resid   21 and name HB2  ) (resid   21 and name HD1* )   3.72   3.72   0.00
assign (resid   21 and name HD1* ) (resid   44 and name HB*  )   4.60   4.60   0.00
assign (resid   21 and name HA   ) (resid   21 and name HD1* )   4.65   4.65   0.00
assign (resid   21 and name HD1* ) (resid   31 and name HH2  )   4.36   4.36   0.00
assign (resid   17 and name HD2* ) (resid   28 and name HD1* )   3.96   3.96   0.00
assign (resid    8 and name HG11 ) (resid   17 and name HD2* )   4.13   4.13   0.00
assign (resid   17 and name HB1  ) (resid   17 and name HD2* )   3.63   3.63   0.00
assign (resid   17 and name HB2  ) (resid   17 and name HD2* )   3.63   3.63   0.00
assign (resid    8 and name HG12 ) (resid   17 and name HD2* )   4.13   4.13   0.00
assign (resid    8 and name HA   ) (resid   17 and name HD2* )   4.46   4.46   0.00
assign (resid   17 and name HA   ) (resid   17 and name HD2* )   4.97   4.97   0.00
assign (resid   58 and name HA   ) (resid   58 and name HD2* )   3.36   3.36   0.00
assign (resid   36 and name HG*  ) (resid   58 and name HD2* )   3.30   3.30   0.00
assign (resid   37 and name HG1* ) (resid   45 and name HD1* )   3.23   3.23   0.00
assign (resid   37 and name HA   ) (resid   37 and name HG1* )   3.61   3.61   0.00
assign (resid   36 and name HA   ) (resid   37 and name HG1* )   4.80   4.80   0.00
assign (resid   31 and name HE3  ) (resid   37 and name HG1* )   3.94   3.94   0.00
assign (resid   17 and name HD1* ) (resid   48 and name HD*  )   4.30   4.30   0.00
assign (resid   17 and name HD1* ) (resid   48 and name HE*  )   4.83   4.83   0.00
assign (resid   17 and name HA   ) (resid   17 and name HD1* )   3.44   3.44   0.00
assign (resid   17 and name HD1* ) (resid   21 and name HG   )   4.22   4.22   0.00
assign (resid   11 and name HD1* ) (resid   17 and name HD1* )   3.63   3.63   0.00
assign (resid   36 and name HG*  ) (resid   58 and name HD1* )   3.32   3.32   0.00
assign (resid   58 and name HA   ) (resid   58 and name HD1* )   4.55   4.55   0.00
assign (resid   23 and name HG2* ) (resid   27 and name HB*  )   3.87   3.87   0.00
assign (resid   23 and name HB   ) (resid   27 and name HB*  )   3.74   3.74   0.00
assign (resid   39 and name HB*  ) (resid   59 and name HA   )   4.94   4.94   0.00
assign (resid   17 and name HD2* ) (resid   18 and name HB*  )   4.32   4.32   0.00
assign (resid   18 and name HB*  ) (resid   23 and name HG2* )   4.04   4.04   0.00
assign (resid   18 and name HB*  ) (resid   28 and name HD1* )   4.41   4.41   0.00
assign (resid   18 and name HB*  ) (resid   25 and name HG1  )   4.57   4.57   0.00
assign (resid   18 and name HB*  ) (resid   25 and name HG2  )   4.57   4.57   0.00
assign (resid   18 and name HB*  ) (resid   19 and name HA   )   4.75   4.75   0.00
assign (resid    3 and name HB*  ) (resid   55 and name HA   )   3.53   3.53   0.00
assign (resid   30 and name HB*  ) (resid   33 and name HB*  )   4.85   4.85   0.00
assign (resid    7 and name HB*  ) (resid   17 and name HD2* )   3.26   3.26   0.00
assign (resid    7 and name HB*  ) (resid   17 and name HD1* )   3.78   3.78   0.00
assign (resid    7 and name HB*  ) (resid   48 and name HB1  )   4.27   4.27   0.00
assign (resid    7 and name HB*  ) (resid   48 and name HB2  )   4.27   4.27   0.00
assign (resid    7 and name HB*  ) (resid   48 and name HD*  )   4.19   4.19   0.00
assign (resid   39 and name HB*  ) (resid   57 and name HB*  )   4.42   4.42   0.00
assign (resid   36 and name HD1  ) (resid   58 and name HD2* )   4.28   4.28   0.00
assign (resid   36 and name HD2  ) (resid   58 and name HD2* )   4.28   4.28   0.00
assign (resid   31 and name HB1  ) (resid   37 and name HG1* )   4.09   4.09   0.00
assign (resid   31 and name HB2  ) (resid   37 and name HG1* )   4.09   4.09   0.00
assign (resid   31 and name HZ3  ) (resid   37 and name HG1* )   5.33   5.33   0.00
assign (resid   21 and name HB1  ) (resid   21 and name HD1* )   3.72   3.72   0.00
assign (resid   21 and name HD1* ) (resid   31 and name HE3  )   5.14   5.14   0.00
assign (resid   21 and name HD1* ) (resid   48 and name HD*  )   5.23   5.23   0.00
assign (resid   21 and name HD2* ) (resid   31 and name HZ3  )   3.69   3.69   0.00
assign (resid   21 and name HD2* ) (resid   48 and name HE*  )   3.78   3.78   0.00
assign (resid   21 and name HD1* ) (resid   31 and name HZ3  )   3.62   3.62   0.00
assign (resid   21 and name HD1* ) (resid   48 and name HE*  )   3.63   3.63   0.00
assign (resid    4 and name HD1* ) (resid   36 and name HA   )   5.09   5.09   0.00
assign (resid    4 and name HD1* ) (resid   31 and name HE3  )   5.09   5.09   0.00
assign (resid   45 and name HG2* ) (resid   48 and name HD*  )   5.30   5.30   0.00
assign (resid   23 and name HG2* ) (resid   31 and name HZ3  )   5.18   5.18   0.00
assign (resid    4 and name HG2* ) (resid   31 and name HB2  )   4.61   4.61   0.00
assign (resid    7 and name HA   ) (resid   49 and name HG2* )   4.58   4.58   0.00
assign (resid    1 and name HA   ) (resid    1 and name HG*  )   3.98   3.98   0.00
assign (resid    2 and name HA   ) (resid    4 and name HD1* )   4.20   4.20   0.00
assign (resid    3 and name HA   ) (resid    6 and name HB   )   3.80   3.80   0.00
assign (resid    3 and name HB*  ) (resid   56 and name HD*  )   4.87   4.87   0.00
assign (resid    4 and name HA   ) (resid    7 and name HB*  )   4.09   4.09   0.00
assign (resid    4 and name HA   ) (resid   45 and name HD1* )   3.90   3.90   0.00
assign (resid    4 and name HB   ) (resid   32 and name HA   )   3.65   3.65   0.00
assign (resid    4 and name HB   ) (resid   45 and name HD1* )   3.79   3.79   0.00
assign (resid    5 and name HA   ) (resid    8 and name HB   )   4.29   4.29   0.00
assign (resid    5 and name HA   ) (resid    8 and name HD1* )   4.04   4.04   0.00
assign (resid    6 and name HA   ) (resid    9 and name HB*  )   4.24   4.24   0.00
assign (resid    6 and name HA   ) (resid    6 and name HD1* )   4.20   4.20   0.00
assign (resid    6 and name HB   ) (resid    6 and name HD1* )   3.74   3.74   0.00
assign (resid    8 and name HA   ) (resid    8 and name HD1* )   4.42   4.42   0.00
assign (resid   15 and name HA   ) (resid   25 and name HB*  )   4.63   4.63   0.00
assign (resid   15 and name HA   ) (resid   18 and name HB*  )   3.60   3.60   0.00
assign (resid   15 and name HB*  ) (resid   25 and name HB*  )   4.50   4.50   0.00
assign (resid   15 and name HB*  ) (resid   18 and name HB*  )   4.72   4.72   0.00
assign (resid   14 and name HG1* ) (resid   15 and name HB*  )   4.79   4.79   0.00
assign (resid   11 and name HD1* ) (resid   17 and name HA   )   3.47   3.47   0.00
assign (resid   18 and name HA   ) (resid   23 and name HG2* )   3.57   3.57   0.00
assign (resid   18 and name HA   ) (resid   28 and name HG11 )   4.77   4.77   0.00
assign (resid   18 and name HA   ) (resid   28 and name HG12 )   4.77   4.77   0.00
assign (resid   21 and name HB2  ) (resid   21 and name HD2* )   3.79   3.79   0.00
assign (resid   21 and name HB1  ) (resid   21 and name HD2* )   3.79   3.79   0.00
assign (resid   21 and name HB2  ) (resid   23 and name HG2* )   3.98   3.98   0.00
assign (resid   23 and name HA   ) (resid   23 and name HG1* )   3.41   3.41   0.00
assign (resid   18 and name HB*  ) (resid   24 and name HA   )   4.34   4.34   0.00
assign (resid   14 and name HG1* ) (resid   25 and name HA   )   4.30   4.30   0.00
assign (resid   18 and name HB*  ) (resid   25 and name HA   )   3.74   3.74   0.00
assign (resid   27 and name HA   ) (resid   30 and name HB*  )   3.90   3.90   0.00
assign (resid   28 and name HA   ) (resid   31 and name HE3  )   5.23   5.23   0.00
assign (resid   28 and name HA   ) (resid   31 and name HB2  )   5.01   5.01   0.00
assign (resid   28 and name HA   ) (resid   31 and name HB1  )   5.01   5.01   0.00
assign (resid   30 and name HA   ) (resid   33 and name HB*  )   4.03   4.03   0.00
assign (resid   30 and name HB*  ) (resid   31 and name HD1  )   3.77   3.77   0.00
assign (resid   10 and name HA   ) (resid   10 and name HD2  )   5.21   5.21   0.00
assign (resid   10 and name HA   ) (resid   10 and name HD1  )   5.21   5.21   0.00
assign (resid   34 and name HA   ) (resid   34 and name HD2  )   4.02   4.02   0.00
assign (resid   34 and name HA   ) (resid   34 and name HD1  )   4.02   4.02   0.00
assign (resid   36 and name HB2  ) (resid   58 and name HD1* )   5.02   5.02   0.00
assign (resid   36 and name HB2  ) (resid   58 and name HD2* )   4.89   4.89   0.00
assign (resid   36 and name HB1  ) (resid   58 and name HD2* )   4.89   4.89   0.00
assign (resid   36 and name HB1  ) (resid   58 and name HD1* )   5.02   5.02   0.00
assign (resid   38 and name HA   ) (resid   58 and name HD1* )   4.42   4.42   0.00
assign (resid   37 and name HB   ) (resid   38 and name HD1  )   4.42   4.42   0.00
assign (resid   37 and name HB   ) (resid   38 and name HD2  )   4.42   4.42   0.00
assign (resid   37 and name HG1* ) (resid   38 and name HD1  )   5.34   5.34   0.00
assign (resid   37 and name HG1* ) (resid   38 and name HD2  )   5.34   5.34   0.00
assign (resid   39 and name HA   ) (resid   57 and name HB*  )   3.65   3.65   0.00
assign (resid   39 and name HA   ) (resid   57 and name HG1  )   5.30   5.30   0.00
assign (resid   39 and name HA   ) (resid   57 and name HG2  )   5.30   5.30   0.00
assign (resid   39 and name HA   ) (resid   58 and name HA   )   4.85   4.85   0.00
assign (resid   41 and name HA   ) (resid   41 and name HD1  )   4.17   4.17   0.00
assign (resid   41 and name HA   ) (resid   41 and name HD2  )   4.17   4.17   0.00
assign (resid   41 and name HA   ) (resid   43 and name HG2* )   5.32   5.32   0.00
assign (resid   42 and name HA   ) (resid   45 and name HB   )   3.69   3.69   0.00
assign (resid   37 and name HG2* ) (resid   42 and name HA   )   4.49   4.49   0.00
assign (resid   43 and name HA   ) (resid   46 and name HB*  )   4.13   4.13   0.00
assign (resid   45 and name HA   ) (resid   48 and name HD*  )   4.09   4.09   0.00
assign (resid   45 and name HA   ) (resid   48 and name HE*  )   5.13   5.13   0.00
assign (resid   46 and name HA   ) (resid   49 and name HG2* )   4.20   4.20   0.00
assign (resid   47 and name HA   ) (resid   48 and name HD*  )   5.33   5.33   0.00
assign (resid    6 and name HG2* ) (resid   49 and name HB   )   3.62   3.62   0.00
assign (resid   37 and name HG2* ) (resid   57 and name HA   )   4.08   4.08   0.00
assign (resid   58 and name HB2  ) (resid   58 and name HD2* )   4.03   4.03   0.00
assign (resid   58 and name HB1  ) (resid   58 and name HD2* )   4.03   4.03   0.00
assign (resid   60 and name HA   ) (resid   63 and name HD*  )   5.40   5.40   0.00
assign (resid   39 and name HB*  ) (resid   60 and name HA   )   4.28   4.28   0.00
assign (resid   46 and name HA   ) (resid   49 and name HN   )   3.90   3.90   0.00
assign (resid   49 and name HN   ) (resid   49 and name HG2* )   3.76   3.76   0.00
assign (resid   51 and name HN   ) (resid   52 and name HN   )   3.94   3.94   0.00
assign (resid   51 and name HN   ) (resid   53 and name HN   )   5.12   5.12   0.00
assign (resid   35 and name HN   ) (resid   36 and name HN   )   3.58   3.58   0.00
assign (resid   32 and name HA   ) (resid   35 and name HN   )   4.70   4.70   0.00
assign (resid    4 and name HD1* ) (resid   35 and name HN   )   4.72   4.72   0.00
assign (resid   11 and name HN   ) (resid   12 and name HN   )   3.48   3.48   0.00
assign (resid    9 and name HA   ) (resid   12 and name HN   )   3.96   3.96   0.00
assign (resid    8 and name HA   ) (resid   12 and name HN   )   5.15   5.15   0.00
assign (resid   11 and name HB2  ) (resid   12 and name HN   )   4.70   4.70   0.00
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assign (resid    2 and name HB1  ) (resid    2 and name HD21 )   3.54   3.54   0.00
assign (resid    2 and name HD21 ) (resid   35 and name HA1  )   4.09   4.09   0.00
assign (resid    2 and name HD21 ) (resid   35 and name HA2  )   4.09   4.09   0.00
assign (resid    2 and name HD22 ) (resid   33 and name HA   )   4.23   4.23   0.00
assign (resid    2 and name HD22 ) (resid   32 and name HA   )   4.05   4.05   0.00
assign (resid    2 and name HB1  ) (resid    2 and name HD22 )   3.87   3.87   0.00
assign (resid    6 and name HA   ) (resid    9 and name HD21 )   5.00   5.00   0.00
assign (resid   16 and name HN   ) (resid   18 and name HN   )   5.38   5.38   0.00
assign (resid   40 and name HN   ) (resid   42 and name HN   )   4.91   4.91   0.00
assign (resid   29 and name HN   ) (resid   29 and name HB*  )   3.61   3.61   0.00
assign (resid   29 and name HN   ) (resid   30 and name HB*  )   5.53   5.53   0.00
assign (resid   37 and name HN   ) (resid   37 and name HG2* )   3.30   3.30   0.00
assign (resid   32 and name HG1  ) (resid   32 and name HE   )   3.74   3.74   0.00
assign (resid   64 and name HN   ) (resid   65 and name HN   )   4.39   4.39   0.00
assign (resid   59 and name HN   ) (resid   59 and name HD*  )   5.75   5.75   0.00
assign (resid   50 and name HB1  ) (resid   51 and name HN   )   5.64   5.64   0.00
assign (resid    5 and name HN   ) (resid    5 and name HB2  )   4.02   4.02   0.00
assign (resid    5 and name HN   ) (resid    5 and name HB1  )   4.02   4.02   0.00
assign (resid   62 and name HN   ) (resid   62 and name HG2* )   4.13   4.13   0.00
assign (resid   10 and name HA   ) (resid   12 and name HN   )   5.43   5.43   0.00
assign (resid   11 and name HB1  ) (resid   12 and name HN   )   4.70   4.70   0.00
assign (resid   21 and name HB2  ) (resid   22 and name HN   )   4.55   4.55   0.00
assign (resid   21 and name HB1  ) (resid   22 and name HN   )   4.55   4.55   0.00
assign (resid   21 and name HN   ) (resid   22 and name HN   )   3.46   3.46   0.00
assign (resid   20 and name HN   ) (resid   22 and name HN   )   4.90   4.90   0.00
assign (resid   34 and name HN   ) (resid   36 and name HN   )   4.70   4.70   0.00
assign (resid   50 and name HB2  ) (resid   51 and name HN   )   5.64   5.64   0.00
assign (resid   24 and name HB2  ) (resid   27 and name HN   )   5.05   5.05   0.00
assign (resid   57 and name HG1  ) (resid   58 and name HN   )   6.00   6.00   0.00
assign (resid   57 and name HG2  ) (resid   58 and name HN   )   6.00   6.00   0.00
assign (resid   42 and name HN   ) (resid   42 and name HB2  )   3.58   3.58   0.00
assign (resid   42 and name HN   ) (resid   42 and name HB1  )   3.58   3.58   0.00
assign (resid   17 and name HN   ) (resid   17 and name HG   )   4.59   4.59   0.00
assign (resid   15 and name HA   ) (resid   17 and name HN   )   5.22   5.22   0.00
assign (resid   13 and name HN   ) (resid   17 and name HN   )   5.23   5.23   0.00
assign (resid   19 and name HN   ) (resid   20 and name HN   )   3.39   3.39   0.00
assign (resid    7 and name HN   ) (resid    8 and name HN   )   3.63   3.63   0.00
assign (resid    8 and name HN   ) (resid    9 and name HN   )   3.56   3.56   0.00
assign (resid    6 and name HN   ) (resid    8 and name HN   )   4.98   4.98   0.00
assign (resid   28 and name HG2* ) (resid   29 and name HN   )   4.40   4.40   0.00
assign (resid   28 and name HG11 ) (resid   29 and name HN   )   4.91   4.91   0.00
assign (resid   14 and name HG1* ) (resid   29 and name HN   )   4.46   4.46   0.00
assign (resid   48 and name HN   ) (resid   49 and name HG2* )   4.60   4.60   0.00
assign (resid   47 and name HB2  ) (resid   48 and name HN   )   4.72   4.72   0.00
assign (resid   10 and name HB1  ) (resid   11 and name HN   )   4.07   4.07   0.00
assign (resid    8 and name HN   ) (resid    8 and name HB   )   3.18   3.18   0.00
assign (resid    8 and name HN   ) (resid   10 and name HN   )   4.61   4.61   0.00
assign (resid   42 and name HB1  ) (resid   43 and name HN   )   4.61   4.61   0.00
assign (resid   45 and name HN   ) (resid   45 and name HG2* )   3.89   3.89   0.00
assign (resid   29 and name HB*  ) (resid   30 and name HN   )   4.15   4.15   0.00
assign (resid   30 and name HN   ) (resid   32 and name HN   )   5.33   5.33   0.00
assign (resid   28 and name HN   ) (resid   30 and name HN   )   5.77   5.77   0.00
assign (resid   30 and name HN   ) (resid   31 and name HD1  )   5.87   5.87   0.00
assign (resid   27 and name HN   ) (resid   30 and name HN   )   5.81   5.81   0.00
assign (resid   31 and name HB1  ) (resid   32 and name HN   )   3.97   3.97   0.00
assign (resid   10 and name HN   ) (resid   10 and name HB1  )   3.51   3.51   0.00
assign (resid   10 and name HN   ) (resid   10 and name HB2  )   3.51   3.51   0.00
assign (resid   21 and name HB2  ) (resid   23 and name HN   )   5.08   5.08   0.00
assign (resid   21 and name HB1  ) (resid   23 and name HN   )   5.08   5.08   0.00
assign (resid   34 and name HN   ) (resid   34 and name HB1  )   3.47   3.47   0.00
assign (resid   34 and name HN   ) (resid   34 and name HB2  )   3.47   3.47   0.00
assign (resid   34 and name HG1  ) (resid   35 and name HN   )   4.55   4.55   0.00
assign (resid   34 and name HG2  ) (resid   35 and name HN   )   4.55   4.55   0.00
assign (resid   34 and name HB1  ) (resid   35 and name HN   )   4.11   4.11   0.00
assign (resid   34 and name HB2  ) (resid   35 and name HN   )   4.11   4.11   0.00
assign (resid   34 and name HG2  ) (resid   36 and name HN   )   4.00   4.00   0.00
assign (resid   34 and name HG1  ) (resid   36 and name HN   )   4.00   4.00   0.00
assign (resid   34 and name HB1  ) (resid   36 and name HN   )   4.16   4.16   0.00
assign (resid   34 and name HB2  ) (resid   36 and name HN   )   4.16   4.16   0.00
assign (resid   21 and name HN   ) (resid   21 and name HD2* )   4.11   4.11   0.00
assign (resid   21 and name HN   ) (resid   21 and name HD1* )   4.11   4.11   0.00
assign (resid    2 and name HB2  ) (resid    2 and name HD21 )   3.54   3.54   0.00
assign (resid    2 and name HB2  ) (resid    2 and name HD22 )   3.87   3.87   0.00
assign (resid    2 and name HB1  ) (resid    3 and name HN   )   3.62   3.62   0.00
assign (resid    2 and name HB2  ) (resid    4 and name HN   )   4.73   4.73   0.00
assign (resid    2 and name HB1  ) (resid    4 and name HN   )   4.73   4.73   0.00
assign (resid    4 and name HN   ) (resid    4 and name HG2* )   4.08   4.08   0.00
assign (resid    6 and name HG2* ) (resid   10 and name HN   )   5.78   5.78   0.00
assign (resid   23 and name HN   ) (resid   24 and name HN   )   4.92   4.92   0.00
assign (resid   24 and name HN   ) (resid   24 and name HB1  )   3.96   3.96   0.00
assign (resid   24 and name HB1  ) (resid   25 and name HN   )   3.59   3.59   0.00
assign (resid   33 and name HN   ) (resid   35 and name HN   )   5.23   5.23   0.00
assign (resid   37 and name HG2* ) (resid   58 and name HN   )   5.90   5.90   0.00
assign (resid   60 and name HG1  ) (resid   61 and name HN   )   5.25   5.25   0.00
assign (resid   60 and name HG2  ) (resid   61 and name HN   )   5.25   5.25   0.00
assign (resid    3 and name HN   ) (resid   55 and name HA   )   5.26   5.26   0.00
assign (resid    3 and name HN   ) (resid    5 and name HN   )   5.65   5.65   0.00
assign (resid    3 and name HN   ) (resid    6 and name HB   )   5.08   5.08   0.00
assign (resid    3 and name HN   ) (resid   53 and name HB   )   5.24   5.24   0.00
assign (resid    2 and name HA   ) (resid    4 and name HN   )   5.56   5.56   0.00
assign (resid    4 and name HN   ) (resid   32 and name HA   )   5.40   5.40   0.00
assign (resid    4 and name HN   ) (resid    5 and name HA   )   5.97   5.97   0.00
assign (resid    7 and name HN   ) (resid   49 and name HB   )   6.00   6.00   0.00
assign (resid    7 and name HN   ) (resid   49 and name HA   )   6.00   6.00   0.00
assign (resid    4 and name HA   ) (resid    7 and name HN   )   4.35   4.35   0.00
assign (resid   25 and name HN   ) (resid   26 and name HN   )   3.86   3.86   0.00
assign (resid   24 and name HN   ) (resid   25 and name HN   )   4.76   4.76   0.00
assign (resid   24 and name HN   ) (resid   25 and name HE22 )   6.00   6.00   0.00
assign (resid   11 and name HN   ) (resid   13 and name HN   )   5.18   5.18   0.00
assign (resid   24 and name HN   ) (resid   27 and name HN   )   5.58   5.58   0.00
assign (resid   27 and name HN   ) (resid   29 and name HN   )   5.38   5.38   0.00
assign (resid   31 and name HN   ) (resid   31 and name HE1  )   5.89   5.89   0.00
assign (resid   31 and name HE3  ) (resid   32 and name HN   )   5.67   5.67   0.00
assign (resid   31 and name HD1  ) (resid   32 and name HN   )   5.68   5.68   0.00
assign (resid   32 and name HN   ) (resid   34 and name HN   )   5.18   5.18   0.00
assign (resid   32 and name HN   ) (resid   35 and name HN   )   5.75   5.75   0.00
assign (resid    2 and name HD22 ) (resid   35 and name HN   )   4.96   4.96   0.00
assign (resid   37 and name HN   ) (resid   56 and name HN   )   5.58   5.58   0.00
assign (resid   45 and name HN   ) (resid   47 and name HN   )   5.51   5.51   0.00
assign (resid   56 and name HN   ) (resid   57 and name HN   )   5.33   5.33   0.00
assign (resid   57 and name HN   ) (resid   58 and name HN   )   4.95   4.95   0.00
assign (resid   63 and name HA   ) (resid   63 and name HD*  )   4.42   4.42   0.00
assign (resid   48 and name HA   ) (resid   48 and name HD*  )   3.61   3.61   0.00
assign (resid   47 and name HD2* ) (resid   48 and name HE*  )   4.16   4.16   0.00
assign (resid   48 and name HA   ) (resid   48 and name HE*  )   4.74   4.74   0.00
assign (resid   31 and name HA   ) (resid   31 and name HD1  )   3.51   3.51   0.00
assign (resid   27 and name HB*  ) (resid   31 and name HZ2  )   4.17   4.17   0.00
assign (resid    1 and name HA   ) (resid    2 and name HB*  )   4.83   4.83   0.00
assign (resid    2 and name HB*  ) (resid    2 and name HD21 )   3.00   3.00   0.00
assign (resid    2 and name HB*  ) (resid    2 and name HD22 )   3.33   3.33   0.00
assign (resid    2 and name HB*  ) (resid    3 and name HN   )   3.06   3.06   0.00
assign (resid    2 and name HD21 ) (resid   35 and name HA*  )   3.57   3.57   0.00
assign (resid    2 and name HD22 ) (resid   35 and name HA*  )   3.99   3.99   0.00
assign (resid    3 and name HB*  ) (resid   55 and name HB*  )   4.26   4.26   0.00
assign (resid    4 and name HG2* ) (resid   45 and name HG1* )   4.03   4.03   0.00
assign (resid    4 and name HG1* ) (resid   37 and name HG1* )   3.45   3.45   0.00
assign (resid    4 and name HD1* ) (resid   31 and name HB*  )   4.47   4.47   0.00
assign (resid    4 and name HD1* ) (resid   35 and name HA*  )   4.99   4.99   0.00
assign (resid    5 and name HN   ) (resid    5 and name HB*  )   3.49   3.49   0.00
assign (resid    5 and name HB*  ) (resid    6 and name HN   )   3.45   3.45   0.00
assign (resid    6 and name HN   ) (resid    6 and name HG1* )   3.30   3.30   0.00
assign (resid    7 and name HA   ) (resid   48 and name HB*  )   4.88   4.88   0.00
assign (resid    7 and name HB*  ) (resid   48 and name HB*  )   3.68   3.68   0.00
assign (resid    8 and name HN   ) (resid    8 and name HG1* )   3.31   3.31   0.00
assign (resid    8 and name HG1* ) (resid   14 and name HA   )   4.68   4.68   0.00
assign (resid    8 and name HG1* ) (resid   17 and name HD2* )   3.44   3.44   0.00
assign (resid    8 and name HD1* ) (resid   32 and name HG*  )   4.52   4.52   0.00
assign (resid    8 and name HD1* ) (resid   32 and name HD*  )   3.79   3.79   0.00
assign (resid   10 and name HN   ) (resid   10 and name HB*  )   3.06   3.06   0.00
assign (resid   10 and name HA   ) (resid   10 and name HD*  )   4.46   4.46   0.00
assign (resid   10 and name HB*  ) (resid   11 and name HN   )   3.49   3.49   0.00
assign (resid   10 and name HB*  ) (resid   48 and name HB*  )   2.06   2.06   0.00
assign (resid   10 and name HD*  ) (resid   11 and name HN   )   4.86   4.86   0.00
assign (resid   10 and name HD*  ) (resid   11 and name HD2* )   4.53   4.53   0.00
assign (resid   10 and name HD*  ) (resid   48 and name HA   )   5.22   5.22   0.00
assign (resid   10 and name HD*  ) (resid   48 and name HB*  )   2.07   2.07   0.00
assign (resid   10 and name HD*  ) (resid   48 and name HD*  )   4.69   4.69   0.00
assign (resid   11 and name HN   ) (resid   11 and name HB*  )   3.27   3.27   0.00
assign (resid   11 and name HB*  ) (resid   12 and name HN   )   4.00   4.00   0.00
assign (resid   11 and name HB*  ) (resid   13 and name HN   )   4.81   4.81   0.00
assign (resid   11 and name HD1* ) (resid   17 and name HB*  )   4.26   4.26   0.00
assign (resid   13 and name HB*  ) (resid   14 and name HN   )   3.15   3.15   0.00
assign (resid   13 and name HB*  ) (resid   15 and name HN   )   3.61   3.61   0.00
assign (resid   14 and name HG2* ) (resid   17 and name HB*  )   3.34   3.34   0.00
assign (resid   15 and name HA   ) (resid   25 and name HG*  )   4.45   4.45   0.00
assign (resid   15 and name HB*  ) (resid   25 and name HG*  )   4.55   4.55   0.00
assign (resid   16 and name HN   ) (resid   17 and name HB*  )   5.81   5.81   0.00
assign (resid   17 and name HB*  ) (resid   18 and name HN   )   3.88   3.88   0.00
assign (resid   17 and name HB*  ) (resid   21 and name HD1* )   3.56   3.56   0.00
assign (resid   17 and name HD1* ) (resid   45 and name HG1* )   3.26   3.26   0.00
assign (resid   17 and name HD2* ) (resid   45 and name HG1* )   3.35   3.35   0.00
assign (resid   17 and name HD2* ) (resid   48 and name HB*  )   4.83   4.83   0.00
assign (resid   18 and name HN   ) (resid   28 and name HG1* )   4.14   4.14   0.00
assign (resid   18 and name HB*  ) (resid   25 and name HG*  )   3.93   3.93   0.00
assign (resid   20 and name HN   ) (resid   21 and name HB*  )   5.54   5.54   0.00
assign (resid   21 and name HN   ) (resid   21 and name HB*  )   3.25   3.25   0.00
assign (resid   21 and name HB*  ) (resid   23 and name HN   )   4.43   4.43   0.00
assign (resid   21 and name HD1* ) (resid   41 and name HG*  )   4.15   4.15   0.00
assign (resid   21 and name HD2* ) (resid   45 and name HG1* )   4.02   4.02   0.00
assign (resid   23 and name HG2* ) (resid   41 and name HG*  )   4.22   4.22   0.00
assign (resid   24 and name HN   ) (resid   24 and name HB*  )   3.45   3.45   0.00
assign (resid   24 and name HB*  ) (resid   25 and name HN   )   3.08   3.08   0.00
assign (resid   24 and name HB*  ) (resid   26 and name HN   )   3.62   3.62   0.00
assign (resid   24 and name HB*  ) (resid   27 and name HN   )   4.38   4.38   0.00
assign (resid   25 and name HN   ) (resid   25 and name HG*  )   3.33   3.33   0.00
assign (resid   28 and name HN   ) (resid   28 and name HG1* )   3.73   3.73   0.00
assign (resid   28 and name HA   ) (resid   31 and name HB*  )   4.29   4.29   0.00
assign (resid   30 and name HN   ) (resid   30 and name HG*  )   4.12   4.12   0.00
assign (resid   31 and name HN   ) (resid   31 and name HB*  )   3.37   3.37   0.00
assign (resid   31 and name HB*  ) (resid   32 and name HN   )   3.38   3.38   0.00
assign (resid   31 and name HB*  ) (resid   37 and name HG1* )   3.54   3.54   0.00
assign (resid   31 and name HE1  ) (resid   38 and name HB*  )   4.38   4.38   0.00
assign (resid   31 and name HZ2  ) (resid   38 and name HG*  )   4.04   4.04   0.00
assign (resid   32 and name HN   ) (resid   32 and name HG*  )   4.35   4.35   0.00
assign (resid   32 and name HG*  ) (resid   33 and name HN   )   4.86   4.86   0.00
assign (resid   32 and name HG*  ) (resid   35 and name HN   )   5.02   5.02   0.00
assign (resid   32 and name HD*  ) (resid   33 and name HN   )   5.81   5.81   0.00
assign (resid   33 and name HN   ) (resid   34 and name HB*  )   5.34   5.34   0.00
assign (resid   34 and name HN   ) (resid   34 and name HG*  )   3.81   3.81   0.00
assign (resid   34 and name HN   ) (resid   34 and name HD*  )   4.91   4.91   0.00
assign (resid   34 and name HN   ) (resid   35 and name HA*  )   5.44   5.44   0.00
assign (resid   34 and name HA   ) (resid   34 and name HG*  )   3.67   3.67   0.00
assign (resid   34 and name HG*  ) (resid   34 and name HE   )   2.69   2.69   0.00
assign (resid   34 and name HG*  ) (resid   58 and name HD1* )   4.33   4.33   0.00
assign (resid   36 and name HB*  ) (resid   37 and name HN   )   3.66   3.66   0.00
assign (resid   36 and name HB*  ) (resid   58 and name HD2* )   4.30   4.30   0.00
assign (resid   37 and name HB   ) (resid   38 and name HD*  )   3.83   3.83   0.00
assign (resid   37 and name HG1* ) (resid   38 and name HD*  )   4.62   4.62   0.00
assign (resid   37 and name HG1* ) (resid   41 and name HB*  )   4.13   4.13   0.00
assign (resid   37 and name HG2* ) (resid   41 and name HG*  )   4.35   4.35   0.00
assign (resid   37 and name HG2* ) (resid   57 and name HG*  )   3.76   3.76   0.00
assign (resid   38 and name HA   ) (resid   58 and name HB*  )   4.68   4.68   0.00
assign (resid   38 and name HB*  ) (resid   39 and name HN   )   3.87   3.87   0.00
assign (resid   38 and name HG*  ) (resid   39 and name HN   )   5.06   5.06   0.00
assign (resid   39 and name HA   ) (resid   57 and name HG*  )   4.46   4.46   0.00
assign (resid   39 and name HB*  ) (resid   60 and name HG*  )   4.51   4.51   0.00
assign (resid   39 and name HB*  ) (resid   60 and name HD*  )   4.86   4.86   0.00
assign (resid   41 and name HN   ) (resid   41 and name HD*  )   5.07   5.07   0.00
assign (resid   41 and name HA   ) (resid   41 and name HD*  )   3.61   3.61   0.00
assign (resid   41 and name HB*  ) (resid   41 and name HE   )   3.85   3.85   0.00
assign (resid   41 and name HG*  ) (resid   41 and name HE   )   3.32   3.32   0.00
assign (resid   42 and name HN   ) (resid   42 and name HB*  )   3.10   3.10   0.00
assign (resid   42 and name HB*  ) (resid   43 and name HN   )   4.03   4.03   0.00
assign (resid   43 and name HN   ) (resid   43 and name HG1* )   3.89   3.89   0.00
assign (resid   43 and name HG2* ) (resid   43 and name HG1* )   3.23   3.23   0.00
assign (resid   45 and name HN   ) (resid   45 and name HG1* )   3.33   3.33   0.00
assign (resid   45 and name HG2* ) (resid   55 and name HB*  )   4.62   4.62   0.00
assign (resid   46 and name HA   ) (resid   46 and name HG*  )   3.66   3.66   0.00
assign (resid   46 and name HG*  ) (resid   49 and name HG2* )   5.01   5.01   0.00
assign (resid   47 and name HN   ) (resid   47 and name HB*  )   3.22   3.22   0.00
assign (resid   47 and name HB*  ) (resid   48 and name HN   )   4.05   4.05   0.00
assign (resid   47 and name HB*  ) (resid   48 and name HE*  )   4.65   4.65   0.00
assign (resid   48 and name HN   ) (resid   48 and name HB*  )   3.55   3.55   0.00
assign (resid   50 and name HB*  ) (resid   52 and name HN   )   5.28   5.28   0.00
assign (resid   55 and name HN   ) (resid   55 and name HB*  )   3.28   3.28   0.00
assign (resid   56 and name HN   ) (resid   56 and name HB*  )   3.49   3.49   0.00
assign (resid   56 and name HN   ) (resid   56 and name HG*  )   4.07   4.07   0.00
assign (resid   57 and name HN   ) (resid   57 and name HG*  )   3.78   3.78   0.00
assign (resid   57 and name HG*  ) (resid   58 and name HN   )   5.23   5.23   0.00
assign (resid   58 and name HN   ) (resid   58 and name HB*  )   3.67   3.67   0.00
assign (resid   58 and name HB*  ) (resid   59 and name HN   )   3.96   3.96   0.00
assign (resid   59 and name HN   ) (resid   59 and name HB*  )   3.31   3.31   0.00
assign (resid   59 and name HN   ) (resid   60 and name HD*  )   5.69   5.69   0.00
assign (resid   59 and name HB*  ) (resid   60 and name HD*  )   1.56   1.56   0.00
assign (resid   59 and name HB*  ) (resid   61 and name HN   )   5.60   5.60   0.00
assign (resid   60 and name HB*  ) (resid   61 and name HN   )   4.08   4.08   0.00
assign (resid   60 and name HG*  ) (resid   61 and name HN   )   4.59   4.59   0.00
# Restraints file 4: xph1-hbond.upl
  2 ASN  O       6 ILE  H       2.50
  2 ASN  O       6 ILE  N       3.50
  3 ALA  O       7 ALA  H       2.50
  3 ALA  O       7 ALA  N       3.50
  4 ILE  O       8 ILE  H       2.50
  4 ILE  O       8 ILE  N       3.50
  5 ASP  O       9 ASN  H       2.50
  5 ASP  O       9 ASN  N       3.50
  6 ILE  O      10 LYS  H       2.50
  6 ILE  O      10 LYS  N       3.50
  7 ALA  O      11 LEU  H       2.50
  7 ALA  O      11 LEU  N       3.50

 14 VAL  O      18 ALA  H       2.50
 14 VAL  O      18 ALA  N       3.50
 15 SER  O      19 ALA  H       2.50
 15 SER  O      19 ALA  N       3.50
 16 ALA  O      20 ALA  H       2.50
 16 ALA  O      20 ALA  N       3.50
 17 LEU  O      21 LEU  H       2.50
 17 LEU  O      21 LEU  N       3.50

 25 GLN  O      29 SER  H       2.50
 25 GLN  O      29 SER  N       3.50
 26 SER  O      30 GLN  H       2.50
 26 SER  O      30 GLN  N       3.50
 27 ALA  O      31 TRP  H       2.50
 27 ALA  O      31 TRP  N       3.50
 28 ILE  O      32 ARG  H       2.50
 28 ILE  O      32 ARG  N       3.50
 29 SER  O      33 ALA  H       2.50
 29 SER  O      33 ALA  N       3.50
 30 GLN  O      34 ARG  H       2.50
 30 GLN  O      34 ARG  N       3.50

 41 ARG  O      45 ILE  H       2.50
 41 ARG  O      45 ILE  N       3.50
 42 CYSS O      46 GLU  H       2.50
 42 CYSS O      46 GLU  N       3.50
 43 ILE  O      47 LEU  H       2.50
 43 ILE  O      47 LEU  N       3.50
 44 ASP  O      48 TYR  H       2.50
 44 ASP  O      48 TYR  N       3.50
 45 ILE  O      49 THR  H       2.50
 45 ILE  O      49 THR  N       3.50


# Restraints file 5: xph1.aco

#    2 N -110.377  162.945   25.373    9.812    0.338 0.829 25 13 Strong
   2   ASN  PHI    -161.1   -59.6
   2   ASN  PSI     142.9   182.9

#    3 A  -59.684  -36.154    3.806    2.856    0.172 0.883 25 18 Strong
   3   ALA  PHI     -79.7   -39.7
   3   ALA  PSI     -56.2   -16.2

#    4 I  -64.232  -43.663    3.779    4.176    0.108 0.918 25 18 Strong
   4   ILE  PHI     -84.2   -44.2
   4   ILE  PSI     -63.7   -23.7

#    5 D  -62.623  -42.190    3.895    3.802    0.081 0.928 25 18 Strong
   5   ASP  PHI     -82.6   -42.6
   5   ASP  PSI     -62.2   -22.2

#    6 I  -66.669  -39.553    3.600    4.155    0.056 0.918 25 18 Strong
   6   ILE  PHI     -86.7   -46.7
   6   ILE  PSI     -59.6   -19.6

#    7 A  -65.126  -41.885    2.786    4.061    0.050 0.910 25 18 Strong
   7   ALA  PHI     -85.1   -45.1
   7   ALA  PSI     -61.9   -21.9

#    8 I  -62.825  -43.089    3.398    3.027    0.062 0.905 25 18 Strong
   8   ILE  PHI     -82.8   -42.8
   8   ILE  PSI     -63.1   -23.1

#    9 N  -65.428  -40.651    3.187    4.499    0.060 0.885 25 18 Strong
   9   ASN  PHI     -85.4   -45.4
   9   ASN  PSI     -60.7   -20.7

#   10 K  -67.869  -29.417    4.368    7.701    0.076 0.807 25 18 Strong
  10   LYS  PHI     -87.9   -47.9
  10   LYS  PSI     -49.4    -9.4

#   11 L  -81.566  -14.709    9.374   11.075    0.139 0.731 25 17 Strong
  11   LEU  PHI    -101.6   -61.6
  11   LEU  PSI     -36.9     7.4

#   12 G   86.530    1.432   13.201   19.724    0.151 0.722 25 17 Strong
  12   GLY  PHI      60.1   112.9
  12   GLY  PSI     -38.0    40.9

#   13 S -147.618  156.077   30.412   10.510    0.148 0.782 25 17 Strong
  13   SER  PHI    -208.4   -86.8
  13   SER  PSI     135.1   177.1

#   14 V  -62.428  -39.786    6.101    5.950    0.142 0.872 25 18 Strong
  14   VAL  PHI     -82.4   -42.4
  14   VAL  PSI     -59.8   -19.8

#   15 S  -59.863  -41.006    3.709    5.284    0.085 0.897 25 18 Strong
  15   SER  PHI     -79.9   -39.9
  15   SER  PSI     -61.0   -21.0

#   16 A  -66.759  -36.752    3.907    5.139    0.079 0.889 25 18 Strong
  16   ALA  PHI     -86.8   -46.8
  16   ALA  PSI     -56.8   -16.8

#   17 L  -65.136  -43.937    2.994    5.088    0.067 0.880 25 18 Strong
  17   LEU  PHI     -85.1   -45.1
  17   LEU  PSI     -63.9   -23.9

#   18 A  -61.149  -42.518    4.048    5.360    0.065 0.885 25 18 Strong
  18   ALA  PHI     -81.1   -41.1
  18   ALA  PSI     -62.5   -22.5

#   19 A  -65.339  -39.128    4.256    5.898    0.057 0.877 25 18 Strong
  19   ALA  PHI     -85.3   -45.3
  19   ALA  PSI     -59.1   -19.1

#   20 A  -64.072  -34.767    3.758    6.462    0.068 0.846 25 18 Strong
  20   ALA  PHI     -84.1   -44.1
  20   ALA  PSI     -54.8   -14.8

#   21 L  -88.602  -12.630    6.002    4.364    0.071 0.838 25 17 Strong
  21   LEU  PHI    -108.6   -68.6
  21   LEU  PSI     -32.6     7.4

#   22 G   71.066   36.679    6.025    4.988    0.075 0.846 25 17 Strong
  22   GLY  PHI      51.1    91.1
  22   GLY  PSI      16.7    56.7

#   23 V -126.118  164.940    5.944    7.303    0.083 0.886 25 17 Strong
  23   VAL  PHI    -146.1  -106.1
  23   VAL  PSI     144.9   184.9

#   24 N  -73.340  154.379    9.124    5.887    0.105 0.891 25 18 Strong
  24   ASN  PHI     -93.3   -53.3
  24   ASN  PSI     134.4   174.4

#   25 Q  -59.250  -37.540    3.678    5.718    0.188 0.896 25 18 Strong
  25   GLN  PHI     -79.2   -39.2
  25   GLN  PSI     -57.5   -17.5

#   26 S  -64.183  -34.185    3.905    5.431    0.181 0.892 25 18 Strong
  26   SER  PHI     -84.2   -44.2
  26   SER  PSI     -54.2   -14.2

#   27 A  -68.357  -40.477    5.197    5.280    0.225 0.901 25 18 Strong
  27   ALA  PHI     -88.4   -48.4
  27   ALA  PSI     -60.5   -20.5

#   28 I  -65.463  -38.908    4.344    5.858    0.270 0.911 25 17 Strong
  28   ILE  PHI     -85.5   -45.5
  28   ILE  PSI     -58.9   -18.9

#   29 S  -64.450  -40.180    3.520    4.156    0.204 0.910 25 17 Strong
  29   SER  PHI     -84.5   -44.5
  29   SER  PSI     -60.2   -20.2

#   30 Q  -64.947  -41.531    2.618    4.678    0.179 0.898 25 17 Strong
  30   GLN  PHI     -84.9   -44.9
  30   GLN  PSI     -61.5   -21.5

#   31 W  -61.102  -40.941    3.455    4.030    0.181 0.882 25 18 Strong
  31   TRP  PHI     -81.1   -41.1
  31   TRP  PSI     -60.9   -20.9

#   32 R  -64.090  -40.735    3.620    5.347    0.100 0.869 25 18 Strong
  32   ARG  PHI     -84.1   -44.1
  32   ARG  PSI     -60.7   -20.7

#   33 A  -68.791  -30.686    4.808    7.893    0.117 0.807 25 18 Strong
  33   ALA  PHI     -88.8   -48.8
  33   ALA  PSI     -50.7   -10.7

#   34 R  -92.460   -3.219   10.174   12.822    0.168 0.777 25 17 Strong
  34   ARG  PHI    -112.8   -72.1
  34   ARG  PSI     -28.9    22.4

#   35 G   73.798   23.335   10.402   14.801    0.149 0.775 25 17 Strong
  35   GLY  PHI      53.0    94.6
  35   GLY  PSI      -6.3    52.9

#   36 R -132.626  156.828   16.530    6.955    0.298 0.835 25 16 Strong
  36   ARG  PHI    -165.7   -99.6
  36   ARG  PSI     136.8   176.8

#   37 V  -86.417  125.393   18.115   17.033    0.518 0.864 25 15 Strong
  37   VAL  PHI    -122.6   -50.2
  37   VAL  PSI      91.3   159.5

#   38 P  -66.823  148.038    6.136    9.090    0.565 0.840 25 15 Strong
  38   PRO  PSI     128.0   168.0

#   39 A  -59.334  138.157    6.947    8.710    0.596 0.808 25 15 Strong
  39   ALA  PHI     -79.3   -39.3
  39   ALA  PSI     118.2   158.2

#   42 c  -60.809  -38.440    6.162    5.632    0.559 0.861 25 17 Strong
  42   CYSS  PHI     -80.8   -40.8
  42   CYSS  PSI     -58.4   -18.4

#   43 I  -66.335  -37.127    4.187    6.190    0.419 0.872 25 18 Strong
  43   ILE  PHI     -86.3   -46.3
  43   ILE  PSI     -57.1   -17.1

#   44 D  -67.745  -37.115    3.048    5.233    0.283 0.875 25 18 Strong
  44   ASP  PHI     -87.7   -47.7
  44   ASP  PSI     -57.1   -17.1

#   45 I  -68.559  -36.254    5.281    8.432    0.214 0.868 25 18 Strong
  45   ILE  PHI     -88.6   -48.6
  45   ILE  PSI     -56.3   -16.3

#   46 E  -64.343  -29.926    5.102    6.527    0.199 0.867 25 18 Strong
  46   GLU  PHI     -84.3   -44.3
  46   GLU  PSI     -49.9    -9.9

#   47 L  -69.961  -25.743    5.712    5.111    0.228 0.856 25 18 Strong
  47   LEU  PHI     -90.0   -50.0
  47   LEU  PSI     -45.7    -5.7

#   48 Y -106.611    1.006    7.189   13.422    0.286 0.845 25 18 Strong
  48   TYR  PHI    -126.6   -86.6
  48   TYR  PSI     -25.8    27.9

#   50 D  -86.288  -13.859   18.313   18.646    0.667 0.803 10 17 Generous
  50   ASP  PHI    -141.2   -31.3
  50   ASP  PSI     -69.8    42.1

#   52 R  -70.342  -31.289    7.539    8.235    0.453 0.817 25 17 Strong
  52   ARG  PHI     -90.3   -50.3
  52   ARG  PSI     -51.3   -11.3

#   53 V -129.692  142.347   10.743   14.718    0.417 0.849 25 18 Strong
  53   VAL  PHI    -151.2  -108.2
  53   VAL  PSI     112.9   171.8

#   54 E  -82.903  121.271    7.632   14.543    0.478 0.861 25 18 Strong
  54   GLU  PHI    -102.9   -62.9
  54   GLU  PSI      92.2   150.4

#   55 c  -74.248  125.940   11.011    9.343    0.463 0.884 25 18 Strong
  55   CYSS  PHI     -96.3   -52.2
  55   CYSS  PSI     105.9   145.9

#   56 R -119.872  144.305   13.354   14.444    0.442 0.881 25 18 Strong
  56   ARG  PHI    -146.6   -93.2
  56   ARG  PSI     115.4   173.2

#   57 E -116.223  139.363   12.488   11.441    0.401 0.860 25 18 Strong
  57   GLU  PHI    -141.2   -91.2
  57   GLU  PSI     116.5   162.2

#   58 L  -76.411  136.824   10.748   11.575    0.419 0.726 25 17 Strong
  58   LEU  PHI     -97.9   -54.9
  58   LEU  PSI     113.7   160.0

#   59 R  -67.464  140.879    7.492   11.646    0.520 0.665 25 15 Strong
  59   ARG  PHI     -87.5   -47.5
  59   ARG  PSI     117.6   164.2

# Chi1 angles

#   4 I 18 0.843 0.061 0.096 g-
   4   ILE  CHI1      -100     -20

#   6 I 18 0.886 0.050 0.064 g-
  6   ILE  CHI1      -100     -20

#   8 I 18 0.886 0.050 0.064 g-
  8   ILE  CHI1      -100     -20

#  11 L 17 0.892 0.054 0.054 g-
  11   LEU  CHI1      -100     -20

#  13 S 17 0.084 0.749 0.167 g+
  13   SER  CHI1        20     100

#  14 V 18 0.055 0.118 0.827 t
  14   VAL  CHI1     -220    -140

#  21 L 17 0.825 0.050 0.125 g-
  21   LEU  CHI1      -100     -20

#  23 V 17 0.820 0.069 0.111 g-
  23   VAL  CHI1      -100     -20

#  28 I 17 0.898 0.051 0.051 g-
  28   ILE  CHI1      -100     -20

#  43 I 18 0.834 0.055 0.111 g-
  43   ILE  CHI1      -100     -20

#  45 I 18 0.843 0.096 0.061 g-
  45   ILE  CHI1      -100     -20

#  48 Y 18 0.859 0.036 0.104 g-
  48   TYR  CHI1      -100     -20

#  49 T 18 0.100 0.738 0.163 g+
  49   THR  CHI1        20     100

# Restraints file 6: xph1.upl
 28 ILE  HA     28 ILE  QD1     3.91            #peak   427
 18 ALA  HA     28 ILE  QD1     4.28            #peak   398
 28 ILE  QD1    31 TRP  HZ3     4.85            #peak     5
 28 ILE  QD1    31 TRP  HE3     4.76            #peak     6
 17 LEU  HG     28 ILE  QD1     4.74            #peak     7
 28 ILE  QG2    28 ILE  QD1     3.71            #peak    86
 45 ILE  HA     45 ILE  QD1     4.03            #peak    16
 31 TRP  HZ3    45 ILE  QD1     4.57            #peak    17
  1 MET  QB      6 ILE  QD1     4.61            #peak    22
 43 ILE  HB     43 ILE  QD1     3.92            #peak    27
 43 ILE  HA     43 ILE  QD1     4.73            #peak    28
  8 ILE  QD1    32 ARG  HD2     4.38            #peak    33
  8 ILE  QD1    14 VAL  HA      4.79            #peak    35
  8 ILE  QD1    32 ARG  HD3     4.38            #peak    38
  4 ILE  HB      4 ILE  QD1     3.66            #peak    40
  4 ILE  QD1    32 ARG  HA      4.15            #peak    41
  4 ILE  HA      4 ILE  QD1     4.13            #peak    43
  8 ILE  QG2    14 VAL  QG2     3.54            #peak    45
  8 ILE  HA      8 ILE  QG2     3.72            #peak    47
  8 ILE  QG2    14 VAL  HA      4.30            #peak    48
  8 ILE  QG2    13 SER  HA      4.16            #peak    50
 43 ILE  QG2    43 ILE  HG13    3.84            #peak    52
 43 ILE  QG2    43 ILE  HG12    3.84            #peak    53
 43 ILE  HA     43 ILE  QG2     3.85            #peak    55
  6 ILE  HA      6 ILE  QG2     3.77            #peak    61
  6 ILE  QG2     6 ILE  QD1     3.72            #peak    63
  4 ILE  HA     45 ILE  QG2     4.74            #peak    69
 45 ILE  HA     45 ILE  QG2     3.97            #peak    70
 42 CYSS HA     45 ILE  QG2     4.14            #peak    71
 23 VAL  QG2    28 ILE  QD1     3.64            #peak    72
 21 LEU  HB3    23 VAL  QG2     3.98            #peak    79
 23 VAL  HA     23 VAL  QG2     4.21            #peak    83
 23 VAL  QG2    31 TRP  HH2     4.42            #peak    84
 23 VAL  QG2    31 TRP  HZ2     4.91            #peak    85
 23 VAL  QG2    28 ILE  QG2     4.02            #peak    87
 28 ILE  HA     28 ILE  QG2     3.81            #peak    92
 14 VAL  HA     28 ILE  QG2     4.35            #peak    93
 23 VAL  QG1    31 TRP  HH2     4.00            #peak    96
 23 VAL  QG1    31 TRP  HZ2     4.14            #peak    47
  3 ALA  QB     53 VAL  QG2     3.65            #peak   102
  3 ALA  QB     53 VAL  QG1     3.63            #peak   103
  4 ILE  HA      4 ILE  QG2     3.66            #peak   112
  4 ILE  QG2    31 TRP  HB3     4.61            #peak   113
 23 VAL  QG1    31 TRP  HE3     4.91            #peak   114
  3 ALA  HA     53 VAL  QG2     4.18            #peak   115
  3 ALA  HA     53 VAL  QG1     4.00            #peak   116
 53 VAL  HA     53 VAL  QG2     3.65            #peak   572
 53 VAL  HA     53 VAL  QG1     3.97            #peak   118
 53 VAL  QG1    55 CYSS HA      4.32            #peak   119
 53 VAL  QG2    55 CYSS HA      4.77            #peak   120
  2 ASN  HA     53 VAL  QG1     4.33            #peak   121
  2 ASN  HA     53 VAL  QG2     4.70            #peak   122
 14 VAL  HA     14 VAL  QG1     3.44            #peak   123
 14 VAL  QG1    15 SER  HA      4.21            #peak   124
 14 VAL  QG1    18 ALA  QB      4.08            #peak   126
 62 VAL  HA     62 VAL  QG1     3.84            #peak   129
 37 VAL  QG2    57 GLU  HG3     4.62            #peak   134
 37 VAL  QG2    57 GLU  HG2     4.62            #peak   135
 37 VAL  QG2    39 ALA  HA      4.61            #peak   136
  7 ALA  QB     11 LEU  QD2     3.83            #peak   143
 11 LEU  HA     11 LEU  QD2     3.29            #peak   145
 11 LEU  QD2    17 LEU  HA      4.87            #peak   146
 11 LEU  QD2    48 TYR  QE      4.08            #peak   147
 11 LEU  QD2    48 TYR  QD      4.18            #peak   148
 11 LEU  HA     11 LEU  QD1     4.35            #peak   156
 11 LEU  QD1    48 TYR  QE      4.56            #peak   157
 11 LEU  QD1    48 TYR  QD      4.74            #peak   158
 45 ILE  QG2    49 THR  QG2     3.27            #peak   165
  7 ALA  QB     49 THR  QG2     3.55            #peak   166
  6 ILE  HB     49 THR  QG2     3.72            #peak   167
  6 ILE  QG2    49 THR  QG2     3.59            #peak   168
  3 ALA  HA     49 THR  QG2     4.09            #peak   169
 14 VAL  QG2    17 LEU  HG      4.74            #peak   173
 14 VAL  QG2    28 ILE  QG2     3.00            #peak   179
 14 VAL  HA     14 VAL  QG2     3.49            #peak   180
 21 LEU  QD2    44 ASP  QB      3.53            #peak   188
 21 LEU  QD2    45 ILE  HA      4.80            #peak   189
 21 LEU  HA     21 LEU  QD2     3.44            #peak   190
 21 LEU  QD2    31 TRP  HH2     4.47            #peak   191
 21 LEU  QD2    48 TYR  QD      4.69            #peak   192
 21 LEU  QD1    28 ILE  QD1     3.95            #peak   193
 21 LEU  QD1    45 ILE  QG2     3.86            #peak   195
 17 LEU  HG     21 LEU  QD1     3.73            #peak   199
 21 LEU  HB2    21 LEU  QD1     3.72            #peak   200
 21 LEU  QD1    44 ASP  QB      4.60            #peak   202
 21 LEU  HA     21 LEU  QD1     4.65            #peak   203
 21 LEU  QD1    31 TRP  HH2     4.36            #peak   204
 17 LEU  QD2    28 ILE  QD1     3.96            #peak   205
  8 ILE  HG13   17 LEU  QD2     4.13            #peak   206
 17 LEU  HB3    17 LEU  QD2     3.63            #peak   209
 17 LEU  HB2    17 LEU  QD2     3.63            #peak   211
  8 ILE  HG12   17 LEU  QD2     4.13            #peak   212
  8 ILE  HA     17 LEU  QD2     4.46            #peak   213
 17 LEU  HA     17 LEU  QD2     4.97            #peak   215
 58 LEU  HA     58 LEU  QD2     3.36            #peak   227
 36 ARG  QG     58 LEU  QD2     3.30            #peak   229
 37 VAL  QG1    45 ILE  QD1     3.23            #peak   232
 37 VAL  HA     37 VAL  QG1     3.61            #peak   234
 36 ARG  HA     37 VAL  QG1     4.80            #peak   235
 31 TRP  HE3    37 VAL  QG1     3.94            #peak   236
 17 LEU  QD1    48 TYR  QD      4.30            #peak    22
 17 LEU  QD1    48 TYR  QE      4.83            #peak   238
 17 LEU  HA     17 LEU  QD1     3.44            #peak   239
 17 LEU  QD1    21 LEU  HG      4.22            #peak   241
 11 LEU  QD1    17 LEU  QD1     3.63            #peak   243
 36 ARG  QG     58 LEU  QD1     3.32            #peak   247
 58 LEU  HA     58 LEU  QD1     4.55            #peak   250
 23 VAL  QG2    27 ALA  QB      3.87            #peak   251
 23 VAL  HB     27 ALA  QB      3.74            #peak   253
 39 ALA  QB     59 ARG  HA      4.94            #peak   261
 17 LEU  QD2    18 ALA  QB      4.32            #peak   264
 18 ALA  QB     23 VAL  QG2     4.04            #peak   265
 18 ALA  QB     28 ILE  QD1     4.41            #peak   266
 18 ALA  QB     25 GLN  HG3     4.57            #peak   268
 18 ALA  QB     25 GLN  HG2     4.57            #peak   269
 18 ALA  QB     19 ALA  HA      4.75            #peak   272
  3 ALA  QB     55 CYSS HA      3.53            #peak   275
 30 GLN  QB     33 ALA  QB      4.85            #peak   285
  7 ALA  QB     17 LEU  QD2     3.26            #peak   289
  7 ALA  QB     17 LEU  QD1     3.78            #peak   290
  7 ALA  QB     48 TYR  HB3     4.27            #peak   291
  7 ALA  QB     48 TYR  HB2     4.27            #peak   292
  7 ALA  QB     48 TYR  QD      4.19            #peak    19
 39 ALA  QB     57 GLU  QB      4.42            #peak   296
 36 ARG  HD3    58 LEU  QD2     4.28            #peak   297
 36 ARG  HD2    58 LEU  QD2     4.28            #peak   298
 31 TRP  HB3    37 VAL  QG1     4.09            #peak   300
 31 TRP  HB2    37 VAL  QG1     4.09            #peak   301
 31 TRP  HZ3    37 VAL  QG1     5.33            #peak   302
 21 LEU  HB3    21 LEU  QD1     3.72            #peak   305
 21 LEU  QD1    31 TRP  HE3     5.14            #peak   307
 21 LEU  QD1    48 TYR  QD      5.23            #peak   308
 21 LEU  QD2    31 TRP  HZ3     3.69            #peak   310
 21 LEU  QD2    48 TYR  QE      3.78            #peak    24
 21 LEU  QD1    31 TRP  HZ3     3.62            #peak   312
 21 LEU  QD1    48 TYR  QE      3.63            #peak   313
  4 ILE  QD1    36 ARG  HA      5.09            #peak   319
  4 ILE  QD1    31 TRP  HE3     5.09            #peak   320
 45 ILE  QG2    48 TYR  QD      5.30            #peak   322
 23 VAL  QG2    31 TRP  HZ3     5.18            #peak   323
  4 ILE  QG2    31 TRP  HB2     4.61            #peak   325
  7 ALA  HA     49 THR  QG2     4.58            #peak   328
  1 MET  HA      1 MET  QG      3.98            #peak   333
  2 ASN  HA      4 ILE  QD1     4.20            #peak   337
  3 ALA  HA      6 ILE  HB      3.80            #peak   340
  3 ALA  QB     56 ARG  QD      4.87            #peak   342
  4 ILE  HA      7 ALA  QB      4.09            #peak   293
  4 ILE  HA     45 ILE  QD1     3.90            #peak   346
  4 ILE  HB     32 ARG  HA      3.65            #peak   455
  4 ILE  HB     45 ILE  QD1     3.79            #peak   352
  5 ASP  HA      8 ILE  HB      4.29            #peak   355
  5 ASP  HA      8 ILE  QD1     4.04            #peak    36
  6 ILE  HA      9 ASN  QB      4.24            #peak   357
  6 ILE  HA      6 ILE  QD1     4.20            #peak    23
  6 ILE  HB      6 ILE  QD1     3.74            #peak    21
  8 ILE  HA      8 ILE  QD1     4.42            #peak   371
 15 SER  HA     25 GLN  QB      4.63            #peak   381
 15 SER  HA     18 ALA  QB      3.60            #peak   271
 15 SER  QB     25 GLN  QB      4.50            #peak   386
 15 SER  QB     18 ALA  QB      4.72            #peak   387
 14 VAL  QG1    15 SER  QB      4.79            #peak   388
 11 LEU  QD1    17 LEU  HA      3.47            #peak   155
 18 ALA  HA     23 VAL  QG2     3.57            #peak    82
 18 ALA  HA     28 ILE  HG13    4.77            #peak   400
 18 ALA  HA     28 ILE  HG12    4.77            #peak   401
 21 LEU  HB2    21 LEU  QD2     3.79            #peak   309
 21 LEU  HB3    21 LEU  QD2     3.79            #peak   186
 21 LEU  HB2    23 VAL  QG2     3.98            #peak    80
 23 VAL  HA     23 VAL  QG1     3.41            #peak   108
 18 ALA  QB     24 ASN  HA      4.34            #peak   273
 14 VAL  QG1    25 GLN  HA      4.30            #peak   418
 18 ALA  QB     25 GLN  HA      3.74            #peak   420
 27 ALA  HA     30 GLN  QB      3.90            #peak   424
 28 ILE  HA     31 TRP  HE3     5.23            #peak   426
 28 ILE  HA     31 TRP  HB2     5.01            #peak   432
 28 ILE  HA     31 TRP  HB3     5.01            #peak   433
 30 GLN  HA     33 ALA  QB      4.03            #peak   435
 30 GLN  QB     31 TRP  HD1     3.77            #peak    38
 10 LYS  HA     10 LYS  HD2     5.21            #peak   458
 10 LYS  HA     10 LYS  HD3     5.21            #peak   462
 34 ARG  HA     34 ARG  HD2     4.02            #peak   469
 34 ARG  HA     34 ARG  HD3     4.02            #peak   470
 36 ARG  HB2    58 LEU  QD1     5.02            #peak   476
 36 ARG  HB2    58 LEU  QD2     4.89            #peak   477
 36 ARG  HB3    58 LEU  QD2     4.89            #peak   478
 36 ARG  HB3    58 LEU  QD1     5.02            #peak   479
 38 PRO  HA     58 LEU  QD1     4.42            #peak   483
 37 VAL  HB     38 PRO  HD3     4.42            #peak   492
 37 VAL  HB     38 PRO  HD2     4.42            #peak   493
 37 VAL  QG1    38 PRO  HD3     5.34            #peak   494
 37 VAL  QG1    38 PRO  HD2     5.34            #peak   495
 39 ALA  HA     57 GLU  QB      3.65            #peak   503
 39 ALA  HA     57 GLU  HG3     5.30            #peak   504
 39 ALA  HA     57 GLU  HG2     5.30            #peak   505
 39 ALA  HA     58 LEU  HA      4.85            #peak   506
 41 ARG  HA     41 ARG  HD3     4.17            #peak   507
 41 ARG  HA     41 ARG  HD2     4.17            #peak   508
 41 ARG  HA     43 ILE  QG2     5.32            #peak   512
 42 CYSS HA     45 ILE  HB      3.69            #peak   516
 37 VAL  QG2    42 CYSS HA      4.49            #peak   137
 43 ILE  HA     46 GLU  QB      4.13            #peak   527
 45 ILE  HA     48 TYR  QD      4.09            #peak   533
 45 ILE  HA     48 TYR  QE      5.13            #peak   534
 46 GLU  HA     49 THR  QG2     4.20            #peak   543
 47 LEU  HA     48 TYR  QD      5.33            #peak   548
  6 ILE  QG2    49 THR  HB      3.62            #peak   563
 37 VAL  QG2    57 GLU  HA      4.08            #peak   138
 58 LEU  HB2    58 LEU  QD2     4.03            #peak   582
 58 LEU  HB3    58 LEU  QD2     4.03            #peak   583
 60 PRO  HA     63 PHE  QD      5.40            #peak   595
 39 ALA  QB     60 PRO  HA      4.28            #peak   596
 46 GLU  HA     49 THR  H       3.90            #peak  1005
 49 THR  H      49 THR  QG2     3.76            #peak  1006
 51 GLY  H      52 ARG  H       3.94            #peak  1265
 51 GLY  H      53 VAL  H       5.12            #peak  1012
 35 GLY  H      36 ARG  H       3.58            #peak  1018
 32 ARG  HA     35 GLY  H       4.70            #peak  1022
  4 ILE  QD1    35 GLY  H       4.72            #peak  1023
 11 LEU  H      12 GLY  H       3.48            #peak  1190
  9 ASN  HA     12 GLY  H       3.96            #peak  1028
  8 ILE  HA     12 GLY  H       5.15            #peak  1030
 11 LEU  HB2    12 GLY  H       4.70            #peak  1031
  8 ILE  QG2    13 SER  H       4.59            #peak  1034
 13 SER  H      16 ALA  QB      3.97            #peak  1035
  8 ILE  HA     13 SER  H       5.18            #peak  1041
 13 SER  H      14 VAL  H       5.08            #peak  1622
 20 ALA  HA     22 GLY  H       4.05            #peak  1046
 19 ALA  QB     22 GLY  H       4.97            #peak  1048
 21 LEU  QD1    22 GLY  H       5.06            #peak  1049
 22 GLY  H      23 VAL  QG2     5.30            #peak  1050
 63 PHE  HB2    64 GLY  H       5.33            #peak  1054
 63 PHE  HB3    64 GLY  H       5.33            #peak  1055
 39 ALA  HA     40 GLY  H       2.92            #peak  1059
 40 GLY  H      57 GLU  QB      4.41            #peak  1061
 39 ALA  QB     40 GLY  H       3.71            #peak  1062
 18 ALA  HA     23 VAL  H       4.70            #peak  1067
 23 VAL  H      23 VAL  QG2     3.61            #peak  1069
 23 VAL  H      23 VAL  QG1     4.15            #peak  1070
 18 ALA  QB     23 VAL  H       5.13            #peak  1071
 27 ALA  H      28 ILE  H       3.58            #peak  1073
 28 ILE  H      29 SER  H       3.72            #peak  1074
 25 GLN  HA     28 ILE  H       4.23            #peak  1076
 28 ILE  H      28 ILE  HB      3.29            #peak  1078
 28 ILE  H      28 ILE  QG2     4.26            #peak  1081
 23 VAL  QG2    28 ILE  H       4.68            #peak  1082
 28 ILE  H      28 ILE  QD1     4.43            #peak  1083
 28 ILE  HG12   29 SER  H       4.91            #peak  1085
 28 ILE  HB     29 SER  H       3.59            #peak  1086
 25 GLN  HA     29 SER  H       5.37            #peak  1088
 37 VAL  H      57 GLU  HA      3.42            #peak  1093
 36 ARG  HA     37 VAL  H       3.22            #peak  1094
 52 ARG  H      53 VAL  H       3.79            #peak  1266
 13 SER  HB2    15 SER  H       4.40            #peak  1105
 13 SER  HB3    15 SER  H       4.40            #peak  1106
 14 VAL  HB     15 SER  H       3.64            #peak  1109
 14 VAL  QG2    15 SER  H       4.78            #peak  1111
 14 VAL  QG1    15 SER  H       4.32            #peak  1112
 24 ASN  HD21   26 SER  H       3.61            #peak  1114
 26 SER  H      26 SER  QB      2.88            #peak  1117
 25 GLN  QB     26 SER  H       3.31            #peak  1119
 40 GLY  H      41 ARG  H       3.71            #peak  1057
 41 ARG  H      42 CYSS H       3.27            #peak  1398
 37 VAL  QG2    41 ARG  H       4.49            #peak  1127
  3 ALA  H       4 ILE  H       3.93            #peak  1283
  4 ILE  H       5 ASP  H       3.35            #peak  1132
  4 ILE  H       4 ILE  HB      3.50            #peak  1135
  3 ALA  QB      4 ILE  H       3.47            #peak  1136
 48 TYR  H      49 THR  H       3.49            #peak  1138
 47 LEU  H      48 TYR  H       3.45            #peak  1139
 45 ILE  HA     48 TYR  H       4.35            #peak  1143
 47 LEU  HB3    48 TYR  H       4.72            #peak  1145
 34 ARG  H      35 GLY  H       3.49            #peak  1017
 33 ALA  H      34 ARG  H       3.72            #peak  1316
 33 ALA  QB     34 ARG  H       3.73            #peak  1153
 21 LEU  H      22 GLY  QA      4.63            #peak  1157
 18 ALA  HA     21 LEU  H       4.77            #peak  1158
 21 LEU  H      21 LEU  HG      3.82            #peak  1159
 20 ALA  QB     21 LEU  H       3.61            #peak  1161
 21 LEU  H      23 VAL  QG2     5.18            #peak  1162
 17 LEU  QD1    21 LEU  H       5.37            #peak  1163
 44 ASP  H      46 GLU  H       5.02            #peak  1180
 24 ASN  H      24 ASN  HB2     3.96            #peak  1183
 23 VAL  HB     24 ASN  H       3.21            #peak  1184
 24 ASN  H      27 ALA  QB      4.12            #peak  1185
 23 VAL  QG1    24 ASN  H       4.33            #peak  1186
 23 VAL  QG2    24 ASN  H       4.19            #peak  1187
  8 ILE  HA     11 LEU  H       4.98            #peak  1192
 10 LYS  HB2    11 LEU  H       4.07            #peak  1193
 11 LEU  H      11 LEU  HG      3.55            #peak  1196
 11 LEU  H      11 LEU  QD2     4.37            #peak  1197
 11 LEU  H      11 LEU  QD1     5.01            #peak  1198
  9 ASN  H      10 LYS  H       3.78            #peak  1200
  6 ILE  HA      9 ASN  H       4.43            #peak  1203
  9 ASN  H       9 ASN  QB      3.30            #peak  1205
  5 ASP  HA      9 ASN  H       4.75            #peak  1206
 32 ARG  H      33 ALA  H       3.70            #peak  1209
 32 ARG  H      33 ALA  HA      5.05            #peak  1211
 31 TRP  HB2    32 ARG  H       3.97            #peak  1213
 32 ARG  H      32 ARG  QB      3.08            #peak  1214
  4 ILE  QG2    32 ARG  H       4.20            #peak  1216
 28 ILE  QG2    32 ARG  H       4.73            #peak  1217
  4 ILE  HA      8 ILE  H       4.94            #peak  1220
  7 ALA  QB      8 ILE  H       3.77            #peak  1222
 42 CYSS H      43 ILE  H       4.05            #peak  1227
 43 ILE  H      44 ASP  H       3.84            #peak  1299
 42 CYSS HB2    43 ILE  H       4.61            #peak  1231
 43 ILE  H      43 ILE  HB      3.45            #peak  1232
 43 ILE  H      43 ILE  HG13    4.72            #peak  1233
 43 ILE  H      43 ILE  QG2     3.89            #peak  1234
 43 ILE  H      43 ILE  HG12    4.72            #peak  1235
 45 ILE  H      46 GLU  H       3.56            #peak  1237
 44 ASP  H      45 ILE  H       3.45            #peak  1238
 42 CYSS HA     45 ILE  H       3.77            #peak  1240
 44 ASP  QB     45 ILE  H       3.63            #peak  1242
 45 ILE  H      45 ILE  HB      3.34            #peak  1243
 45 ILE  H      45 ILE  HG12    3.99            #peak  1244
 45 ILE  H      45 ILE  HG13    3.99            #peak  1245
 17 LEU  H      19 ALA  H       5.34            #peak  1627
 15 SER  HA     19 ALA  H       4.99            #peak  1250
 18 ALA  QB     19 ALA  H       3.63            #peak  1252
 19 ALA  H      19 ALA  QB      3.29            #peak  1253
  5 ASP  HB2     6 ILE  H       4.08            #peak  1257
  5 ASP  HB3     6 ILE  H       4.08            #peak  1258
  6 ILE  H       6 ILE  HB      3.31            #peak  1259
  6 ILE  H       6 ILE  HG12    3.79            #peak  1260
  6 ILE  H       6 ILE  HG13    3.79            #peak  1261
  6 ILE  H       6 ILE  QG2     4.44            #peak  1262
  6 ILE  H       6 ILE  QD1     4.63            #peak  1263
 46 GLU  H      47 LEU  H       3.91            #peak  1173
 44 ASP  HA     47 LEU  H       5.03            #peak  1275
 46 GLU  QB     47 LEU  H       4.30            #peak  1278
 47 LEU  H      47 LEU  HG      3.60            #peak  1279
 47 LEU  H      47 LEU  HB2     3.78            #peak  1280
 47 LEU  H      47 LEU  HB3     3.78            #peak  1281
  2 ASN  HA      3 ALA  H       3.35            #peak  1284
  2 ASN  HB2     3 ALA  H       3.62            #peak  1286
  3 ALA  H       3 ALA  QB      3.26            #peak  1287
 48 TYR  H      50 ASP  H       4.77            #peak  1289
 49 THR  H      50 ASP  H       3.64            #peak  1003
 49 THR  QG2    50 ASP  H       4.93            #peak  1294
  6 ILE  QG2    50 ASP  H       4.90            #peak  1295
 44 ASP  H      44 ASP  QB      3.35            #peak  1302
 43 ILE  HB     44 ASP  H       4.26            #peak  1304
 56 ARG  HA     57 GLU  H       3.08            #peak  1309
 57 GLU  H      57 GLU  HG2     4.54            #peak  1311
 57 GLU  H      57 GLU  HG3     4.54            #peak  1312
 57 GLU  H      57 GLU  QB      3.32            #peak  1313
 32 ARG  QB     33 ALA  H       3.60            #peak  1320
 33 ALA  H      33 ALA  QB      3.28            #peak  1321
 16 ALA  H      17 LEU  H       3.75            #peak  1323
 14 VAL  HA     17 LEU  H       4.56            #peak  1327
 17 LEU  H      17 LEU  QD2     4.60            #peak  1328
 17 LEU  H      17 LEU  QD1     4.70            #peak  1329
 16 ALA  QB     17 LEU  H       3.61            #peak  1330
 17 LEU  H      17 LEU  HB3     3.58            #peak  1331
 17 LEU  H      17 LEU  HB2     3.58            #peak  1332
 61 ASP  H      62 VAL  H       4.54            #peak  1334
 60 PRO  HA     61 ASP  H       3.43            #peak  1336
 61 ASP  H      61 ASP  QB      3.79            #peak  1337
 10 LYS  H      11 LEU  H       3.73            #peak  1189
  6 ILE  HA     10 LYS  H       5.44            #peak  1346
  9 ASN  QB     10 LYS  H       3.89            #peak  1347
 17 LEU  HA     20 ALA  H       4.65            #peak  1356
 18 ALA  HA     20 ALA  H       5.94            #peak  1357
 20 ALA  H      20 ALA  QB      3.12            #peak  1359
 11 LEU  QD1    20 ALA  H       5.68            #peak  1360
 17 LEU  QD1    20 ALA  H       5.83            #peak  1361
 20 ALA  H      21 LEU  QD1     6.00            #peak  1362
 18 ALA  QB     20 ALA  H       5.23            #peak  1363
 24 ASN  HA     25 GLN  H       2.75            #peak  1370
 24 ASN  HB2    25 GLN  H       3.59            #peak  1372
 25 GLN  H      25 GLN  QB      3.01            #peak  1374
 18 ALA  QB     25 GLN  H       3.97            #peak  1375
 30 GLN  H      31 TRP  H       3.64            #peak  1377
 31 TRP  H      31 TRP  HD1     3.61            #peak  1378
 31 TRP  H      31 TRP  HB2     3.86            #peak  1379
 30 GLN  QB     31 TRP  H       3.53            #peak  1380
 28 ILE  HA     31 TRP  H       4.45            #peak  1381
 18 ALA  H      19 ALA  H       3.89            #peak  1383
 17 LEU  H      18 ALA  H       3.56            #peak  1324
 18 ALA  H      20 ALA  H       5.46            #peak  1385
 15 SER  HA     18 ALA  H       4.39            #peak  1387
 18 ALA  H      18 ALA  QB      3.28            #peak  1391
 18 ALA  H      28 ILE  QG2     4.87            #peak  1394
 18 ALA  H      23 VAL  QG2     5.61            #peak  1395
 18 ALA  H      28 ILE  QD1     4.87            #peak  1396
 14 VAL  H      15 SER  H       3.66            #peak  1401
 13 SER  HA     14 VAL  H       2.98            #peak  1402
 13 SER  HB2    14 VAL  H       3.74            #peak  1403
 13 SER  HB3    14 VAL  H       3.74            #peak  1404
 14 VAL  H      15 SER  HA      4.92            #peak  1405
 14 VAL  H      14 VAL  HB      3.17            #peak  1407
 14 VAL  H      14 VAL  QG2     3.29            #peak  1408
 14 VAL  H      14 VAL  QG1     4.06            #peak  1409
  8 ILE  QG2    14 VAL  H       4.09            #peak  1410
 38 PRO  HA     39 ALA  H       3.14            #peak  1412
 39 ALA  H      39 ALA  QB      3.25            #peak  1416
 39 ALA  H      58 LEU  QD1     5.05            #peak  1417
 39 ALA  H      40 GLY  H       4.97            #peak  1613
 58 LEU  HA     59 ARG  H       3.13            #peak  1421
 58 LEU  QD2    59 ARG  H       4.24            #peak  1422
 57 GLU  QB     58 LEU  H       4.26            #peak  1429
 39 ALA  QB     58 LEU  H       4.20            #peak  1431
 63 PHE  H      63 PHE  QD      5.29            #peak  1434
 62 VAL  HB     63 PHE  H       5.07            #peak  1439
 29 SER  HA     30 GLN  H       3.57            #peak  1443
 30 GLN  H      30 GLN  QB      3.21            #peak  1445
 30 GLN  H      32 ARG  QB      5.23            #peak  1446
 27 ALA  QB     30 GLN  H       5.65            #peak  1447
 65 ALA  H      65 ALA  QB      3.99            #peak  1452
  6 ILE  HB      7 ALA  H       3.74            #peak  1456
  7 ALA  H       7 ALA  QB      3.34            #peak  1457
  6 ILE  QG2     7 ALA  H       4.39            #peak  1458
 14 VAL  H      16 ALA  H       5.80            #peak  1461
 13 SER  H      16 ALA  H       5.39            #peak  1043
 13 SER  HA     16 ALA  H       5.76            #peak  1464
 14 VAL  HA     16 ALA  H       5.85            #peak  1466
 16 ALA  H      16 ALA  QB      3.33            #peak  1467
 26 SER  H      27 ALA  H       3.20            #peak  1115
 25 GLN  HA     27 ALA  H       5.37            #peak  1472
 24 ASN  HB3    27 ALA  H       5.05            #peak  1473
 27 ALA  H      27 ALA  QB      3.32            #peak  1474
 53 VAL  H      54 GLU  H       5.38            #peak  1480
 53 VAL  HA     54 GLU  H       3.08            #peak  1481
 54 GLU  H      54 GLU  QG      4.54            #peak  1483
 54 GLU  H      54 GLU  QB      3.24            #peak  1484
 53 VAL  QG2    54 GLU  H       3.90            #peak  1485
 54 GLU  HA     55 CYSS H       3.02            #peak  1488
 55 CYSS H      55 CYSS HB2     3.79            #peak  1489
 55 CYSS H      55 CYSS HB3     3.79            #peak  1490
 54 GLU  QG     55 CYSS H       4.60            #peak  1491
 54 GLU  QB     55 CYSS H       4.04            #peak  1492
  3 ALA  QB     55 CYSS H       4.93            #peak  1493
 27 ALA  HA     31 TRP  HE1     5.07            #peak  1497
 31 TRP  HE1    38 PRO  HG2     4.47            #peak  1498
 31 TRP  HE1    38 PRO  HG3     4.47            #peak  1499
 27 ALA  QB     31 TRP  HE1     4.13            #peak  1501
 55 CYSS HA     56 ARG  H       3.00            #peak  1503
  3 ALA  QB     56 ARG  H       4.38            #peak  1506
 56 ARG  H      56 ARG  QD      4.57            #peak  1507
  6 ILE  H       7 ALA  H       3.55            #peak  1509
 13 SER  HA     15 SER  H       4.65            #peak  1511
 15 SER  H      16 ALA  H       3.84            #peak  1512
 20 ALA  H      21 LEU  H       3.61            #peak  1515
 29 SER  H      30 GLN  H       3.65            #peak  1517
 54 GLU  H      55 CYSS H       4.93            #peak  1760
 37 VAL  H      58 LEU  H       4.83            #peak  1520
  4 ILE  H       4 ILE  QD1     3.38            #peak  1521
 62 VAL  H      63 PHE  H       4.54            #peak  1432
 41 ARG  HA     41 ARG  HE      3.53            #peak  1526
 41 ARG  HE     44 ASP  H       3.54            #peak  1529
 32 ARG  QB     32 ARG  HE      3.73            #peak  1534
 32 ARG  HG2    32 ARG  HE      3.74            #peak  1535
  8 ILE  QD1    32 ARG  HE      4.20            #peak  1536
 25 GLN  QB     25 GLN  HE21    5.63            #peak  1538
 15 SER  HA     25 GLN  HE21    4.54            #peak  1540
 15 SER  HA     25 GLN  HE22    4.83            #peak  1542
 27 ALA  HA     31 TRP  H       4.54            #peak  1547
 31 TRP  H      32 ARG  QB      4.90            #peak  1548
 31 TRP  H      32 ARG  H       3.69            #peak  1549
 31 TRP  H      31 TRP  HB3     3.86            #peak  1550
 12 GLY  H      13 SER  H       3.71            #peak  1026
  2 ASN  HB3     2 ASN  HD21    3.54            #peak  1555
  2 ASN  HD21   35 GLY  HA3     4.09            #peak  1556
  2 ASN  HD21   35 GLY  HA2     4.09            #peak  1557
  2 ASN  HD22   33 ALA  HA      4.23            #peak  1559
  2 ASN  HD22   32 ARG  HA      4.05            #peak  1560
  2 ASN  HB3     2 ASN  HD22    3.87            #peak  1561
  6 ILE  HA      9 ASN  HD21    5.00            #peak  1574
 16 ALA  H      18 ALA  H       5.38            #peak  1583
 40 GLY  H      42 CYSS H       4.91            #peak  1585
 29 SER  H      29 SER  QB      3.61            #peak  1586
 29 SER  H      30 GLN  QB      5.53            #peak  1587
 37 VAL  H      37 VAL  QG2     3.30            #peak  1589
 32 ARG  HG3    32 ARG  HE      3.74            #peak  1590
 64 GLY  H      65 ALA  H       4.39            #peak  1591
 59 ARG  H      59 ARG  QD      5.75            #peak  1592
 50 ASP  HB3    51 GLY  H       5.64            #peak  1596
  5 ASP  H       5 ASP  HB2     4.02            #peak  1598
  5 ASP  H       5 ASP  HB3     4.02            #peak  1599
 62 VAL  H      62 VAL  QG2     4.13            #peak  1602
 10 LYS  HA     12 GLY  H       5.43            #peak  1607
 11 LEU  HB3    12 GLY  H       4.70            #peak  1608
 21 LEU  HB2    22 GLY  H       4.55            #peak  1609
 21 LEU  HB3    22 GLY  H       4.55            #peak  1610
 21 LEU  H      22 GLY  H       3.46            #peak  1514
 20 ALA  H      22 GLY  H       4.90            #peak  1612
 34 ARG  H      36 ARG  H       4.70            #peak  1616
 50 ASP  HB2    51 GLY  H       5.64            #peak  1617
 24 ASN  HB2    27 ALA  H       5.05            #peak  1618
 57 GLU  HG3    58 LEU  H       6.00            #peak  1620
 57 GLU  HG2    58 LEU  H       6.00            #peak  1621
 42 CYSS H      42 CYSS HB2     3.58            #peak  1623
 42 CYSS H      42 CYSS HB3     3.58            #peak  1624
 17 LEU  H      17 LEU  HG      4.59            #peak  1625
 15 SER  HA     17 LEU  H       5.22            #peak  1626
 13 SER  H      17 LEU  H       5.23            #peak  1628
 19 ALA  H      20 ALA  H       3.39            #peak  1629
  7 ALA  H       8 ILE  H       3.63            #peak  1630
  8 ILE  H       9 ASN  H       3.56            #peak  1631
  6 ILE  H       8 ILE  H       4.98            #peak  1632
 28 ILE  QG2    29 SER  H       4.40            #peak  1633
 28 ILE  HG13   29 SER  H       4.91            #peak  1634
 14 VAL  QG1    29 SER  H       4.46            #peak  1635
 48 TYR  H      49 THR  QG2     4.60            #peak  1636
 47 LEU  HB2    48 TYR  H       4.72            #peak  1637
 10 LYS  HB3    11 LEU  H       4.07            #peak  1638
  8 ILE  H       8 ILE  HB      3.18            #peak  1639
  8 ILE  H      10 LYS  H       4.61            #peak  1682
 42 CYSS HB3    43 ILE  H       4.61            #peak  1644
 45 ILE  H      45 ILE  QG2     3.89            #peak  1646
 29 SER  QB     30 GLN  H       4.15            #peak  1647
 30 GLN  H      32 ARG  H       5.33            #peak  1648
 28 ILE  H      30 GLN  H       5.77            #peak  1649
 30 GLN  H      31 TRP  HD1     5.87            #peak  1650
 27 ALA  H      30 GLN  H       5.81            #peak  1651
 31 TRP  HB3    32 ARG  H       3.97            #peak  1653
 10 LYS  H      10 LYS  HB3     3.51            #peak  1654
 10 LYS  H      10 LYS  HB2     3.51            #peak  1655
 21 LEU  HB2    23 VAL  H       5.08            #peak  1656
 21 LEU  HB3    23 VAL  H       5.08            #peak  1657
 34 ARG  H      34 ARG  HB3     3.47            #peak  1660
 34 ARG  H      34 ARG  HB2     3.47            #peak  1661
 34 ARG  HG3    35 GLY  H       4.55            #peak  1662
 34 ARG  HG2    35 GLY  H       4.55            #peak  1663
 34 ARG  HB3    35 GLY  H       4.11            #peak  1664
 34 ARG  HB2    35 GLY  H       4.11            #peak  1665
 34 ARG  HG2    36 ARG  H       4.00            #peak  1666
 34 ARG  HG3    36 ARG  H       4.00            #peak  1667
 34 ARG  HB3    36 ARG  H       4.16            #peak  1668
 34 ARG  HB2    36 ARG  H       4.16            #peak  1669
 21 LEU  H      21 LEU  QD2     4.11            #peak  1672
 21 LEU  H      21 LEU  QD1     4.11            #peak  1673
  2 ASN  HB2     2 ASN  HD21    3.54            #peak  1674
  2 ASN  HB2     2 ASN  HD22    3.87            #peak  1675
  2 ASN  HB3     3 ALA  H       3.62            #peak  1676
  2 ASN  HB2     4 ILE  H       4.73            #peak  1677
  2 ASN  HB3     4 ILE  H       4.73            #peak  1678
  4 ILE  H       4 ILE  QG2     4.08            #peak  1679
  6 ILE  QG2    10 LYS  H       5.78            #peak  1683
 23 VAL  H      24 ASN  H       4.92            #peak  1685
 24 ASN  H      24 ASN  HB3     3.96            #peak  1686
 24 ASN  HB3    25 GLN  H       3.59            #peak  1687
 33 ALA  H      35 GLY  H       5.23            #peak  1752
 37 VAL  QG2    58 LEU  H       5.90            #peak  1694
 60 PRO  HG3    61 ASP  H       5.25            #peak  1697
 60 PRO  HG2    61 ASP  H       5.25            #peak  1698
  3 ALA  H      55 CYSS HA      5.26            #peak  1710
  3 ALA  H       5 ASP  H       5.65            #peak  1711
  3 ALA  H       6 ILE  HB      5.08            #peak  1712
  3 ALA  H      53 VAL  HB      5.24            #peak  1713
  2 ASN  HA      4 ILE  H       5.56            #peak  1714
  4 ILE  H      32 ARG  HA      5.40            #peak  1715
  4 ILE  H       5 ASP  HA      5.97            #peak  1716
  7 ALA  H      49 THR  HB      6.00            #peak  1718
  7 ALA  H      49 THR  HA      6.00            #peak  1719
  4 ILE  HA      7 ALA  H       4.35            #peak  1720
 25 GLN  H      26 SER  H       3.86            #peak  1614
 24 ASN  H      25 GLN  H       4.76            #peak  1729
 24 ASN  H      25 GLN  HE22    6.00            #peak  1733
 11 LEU  H      13 SER  H       5.18            #peak  1735
 24 ASN  H      27 ALA  H       5.58            #peak  1732
 27 ALA  H      29 SER  H       5.38            #peak  1091
 31 TRP  H      31 TRP  HE1     5.89            #peak  1740
 31 TRP  HE3    32 ARG  H       5.67            #peak  1742
 31 TRP  HD1    32 ARG  H       5.68            #peak  1743
 32 ARG  H      34 ARG  H       5.18            #peak  1744
 32 ARG  H      35 GLY  H       5.75            #peak  1745
  2 ASN  HD22   35 GLY  H       4.96            #peak  1751
 37 VAL  H      56 ARG  H       5.58            #peak  1753
 45 ILE  H      47 LEU  H       5.51            #peak  1758
 56 ARG  H      57 GLU  H       5.33            #peak  1761
 57 GLU  H      58 LEU  H       4.95            #peak  1764
 63 PHE  HA     63 PHE  QD      4.42            #peak     7
 48 TYR  HA     48 TYR  QD      3.61            #peak    12
 47 LEU  QD2    48 TYR  QE      4.16            #peak    26
 48 TYR  HA     48 TYR  QE      4.74            #peak    28
 31 TRP  HA     31 TRP  HD1     3.51            #peak    37
 27 ALA  QB     31 TRP  HZ2     4.17            #peak    49
  1 MET  HA      2 ASN  QB      4.83            #peak   334
  2 ASN  QB      2 ASN  HD21    3.00            #peak  1555
  2 ASN  QB      2 ASN  HD22    3.33            #peak  1561
  2 ASN  QB      3 ALA  H       3.06            #peak  1286
  2 ASN  HD21   35 GLY  QA      3.57            #peak  1556
  2 ASN  HD22   35 GLY  QA      3.99            #peak  1563
  3 ALA  QB     55 CYSS QB      4.26            #peak   276
  4 ILE  QG2    45 ILE  QG1     4.03            #peak    99
  4 ILE  QG1    37 VAL  QG1     3.45            #peak   230
  4 ILE  QD1    31 TRP  QB      4.47            #peak    42
  4 ILE  QD1    35 GLY  QA      4.99            #peak   318
  5 ASP  H       5 ASP  QB      3.49            #peak  1598
  5 ASP  QB      6 ILE  H       3.45            #peak  1257
  6 ILE  H       6 ILE  QG1     3.30            #peak  1260
  7 ALA  HA     48 TYR  QB      4.88            #peak   554
  7 ALA  QB     48 TYR  QB      3.68            #peak   291
  8 ILE  H       8 ILE  QG1     3.31            #peak  1640
  8 ILE  QG1    14 VAL  HA      4.68            #peak   380
  8 ILE  QG1    17 LEU  QD2     3.44            #peak   212
  8 ILE  QD1    32 ARG  QG      4.52            #peak    37
  8 ILE  QD1    32 ARG  QD      3.79            #peak    38
 10 LYS  H      10 LYS  QB      3.06            #peak  1654
 10 LYS  HA     10 LYS  QD      4.46            #peak   462
 10 LYS  QB     11 LEU  H       3.49            #peak  1193
 10 LYS  QB     48 TYR  QB      2.06            #peak   557
 10 LYS  QD     11 LEU  H       4.86            #peak  1194
 10 LYS  QD     11 LEU  QD2     4.53            #peak   144
 10 LYS  QD     48 TYR  HA      5.22            #peak   457
 10 LYS  QD     48 TYR  QB      2.07            #peak   558
 10 LYS  QD     48 TYR  QD      4.69            #peak    20
 11 LEU  H      11 LEU  QB      3.27            #peak  1195
 11 LEU  QB     12 GLY  H       4.00            #peak  1031
 11 LEU  QB     13 SER  H       4.81            #peak  1036
 11 LEU  QD1    17 LEU  QB      4.26            #peak   152
 13 SER  QB     14 VAL  H       3.15            #peak  1404
 13 SER  QB     15 SER  H       3.61            #peak  1106
 14 VAL  QG2    17 LEU  QB      3.34            #peak   176
 15 SER  HA     25 GLN  QG      4.45            #peak   382
 15 SER  QB     25 GLN  QG      4.55            #peak   385
 16 ALA  H      17 LEU  QB      5.81            #peak  1652
 17 LEU  QB     18 ALA  H       3.88            #peak  1389
 17 LEU  QB     21 LEU  QD1     3.56            #peak   197
 17 LEU  QD1    45 ILE  QG1     3.26            #peak   240
 17 LEU  QD2    45 ILE  QG1     3.35            #peak   210
 17 LEU  QD2    48 TYR  QB      4.83            #peak   214
 18 ALA  H      28 ILE  QG1     4.14            #peak  1393
 18 ALA  QB     25 GLN  QG      3.93            #peak   268
 20 ALA  H      21 LEU  QB      5.54            #peak  1358
 21 LEU  H      21 LEU  QB      3.25            #peak  1160
 21 LEU  QB     23 VAL  H       4.43            #peak  1656
 21 LEU  QD1    41 ARG  QG      4.15            #peak   198
 21 LEU  QD2    45 ILE  QG1     4.02            #peak   185
 23 VAL  QG2    41 ARG  QG      4.22            #peak    78
 24 ASN  H      24 ASN  QB      3.45            #peak  1183
 24 ASN  QB     25 GLN  H       3.08            #peak  1372
 24 ASN  QB     26 SER  H       3.62            #peak  1118
 24 ASN  QB     27 ALA  H       4.38            #peak  1473
 25 GLN  H      25 GLN  QG      3.33            #peak  1373
 28 ILE  H      28 ILE  QG1     3.73            #peak  1080
 28 ILE  HA     31 TRP  QB      4.29            #peak   432
 30 GLN  H      30 GLN  QG      4.12            #peak  1444
 31 TRP  H      31 TRP  QB      3.37            #peak  1379
 31 TRP  QB     32 ARG  H       3.38            #peak  1213
 31 TRP  QB     37 VAL  QG1     3.54            #peak   300
 31 TRP  HE1    38 PRO  QB      4.38            #peak  1500
 31 TRP  HZ2    38 PRO  QG      4.04            #peak    45
 32 ARG  H      32 ARG  QG      4.35            #peak  1215
 32 ARG  QG     33 ALA  H       4.86            #peak  1689
 32 ARG  QG     35 GLY  H       5.02            #peak  1584
 32 ARG  QD     33 ALA  H       5.81            #peak  1748
 33 ALA  H      34 ARG  QB      5.34            #peak  1688
 34 ARG  H      34 ARG  QG      3.81            #peak  1658
 34 ARG  H      34 ARG  QD      4.91            #peak  1152
 34 ARG  H      35 GLY  QA      5.44            #peak  1595
 34 ARG  HA     34 ARG  QG      3.67            #peak   468
 34 ARG  QG     34 ARG  HE      2.69            #peak  1545
 34 ARG  QG     58 LEU  QD1     4.33            #peak   248
 36 ARG  QB     37 VAL  H       3.66            #peak  1095
 36 ARG  QB     58 LEU  QD2     4.30            #peak   478
 37 VAL  HB     38 PRO  QD      3.83            #peak   493
 37 VAL  QG1    38 PRO  QD      4.62            #peak   494
 37 VAL  QG1    41 ARG  QB      4.13            #peak   304
 37 VAL  QG2    41 ARG  QG      4.35            #peak   139
 37 VAL  QG2    57 GLU  QG      3.76            #peak   134
 38 PRO  HA     58 LEU  QB      4.68            #peak   586
 38 PRO  QB     39 ALA  H       3.87            #peak  1414
 38 PRO  QG     39 ALA  H       5.06            #peak  1554
 39 ALA  HA     57 GLU  QG      4.46            #peak   504
 39 ALA  QB     60 PRO  QG      4.51            #peak   257
 39 ALA  QB     60 PRO  QD      4.86            #peak   606
 41 ARG  H      41 ARG  QD      5.07            #peak  1615
 41 ARG  HA     41 ARG  QD      3.61            #peak   507
 41 ARG  QB     41 ARG  HE      3.85            #peak  1530
 41 ARG  QG     41 ARG  HE      3.32            #peak  1531
 42 CYSS H      42 CYSS QB      3.10            #peak  1623
 42 CYSS QB     43 ILE  H       4.03            #peak  1231
 43 ILE  H      43 ILE  QG1     3.89            #peak  1233
 43 ILE  QG2    43 ILE  QG1     3.23            #peak    52
 45 ILE  H      45 ILE  QG1     3.33            #peak  1244
 45 ILE  QG2    55 CYSS QB      4.62            #peak    68
 46 GLU  HA     46 GLU  QG      3.66            #peak   545
 46 GLU  QG     49 THR  QG2     5.01            #peak   326
 47 LEU  H      47 LEU  QB      3.22            #peak  1280
 47 LEU  QB     48 TYR  H       4.05            #peak  1637
 47 LEU  QB     48 TYR  QE      4.65            #peak    29
 48 TYR  H      48 TYR  QB      3.55            #peak  1141
 50 ASP  QB     52 ARG  H       5.28            #peak  1270
 55 CYSS H      55 CYSS QB      3.28            #peak  1489
 56 ARG  H      56 ARG  QB      3.49            #peak  1504
 56 ARG  H      56 ARG  QG      4.07            #peak  1505
 57 GLU  H      57 GLU  QG      3.78            #peak  1311
 57 GLU  QG     58 LEU  H       5.23            #peak  1620
 58 LEU  H      58 LEU  QB      3.67            #peak  1430
 58 LEU  QB     59 ARG  H       3.96            #peak  1425
 59 ARG  H      59 ARG  QB      3.31            #peak  1423
 59 ARG  H      60 PRO  QD      5.69            #peak  1593
 59 ARG  QB     60 PRO  QD      1.56            #peak   593
 59 ARG  QB     61 ASP  H       5.60            #peak  1340
 60 PRO  QB     61 ASP  H       4.08            #peak  1339
 60 PRO  QG     61 ASP  H       4.59            #peak  1697
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HT1      MET   1 -15.238  -2.312  11.805
    2    H2   MET   1           HT2      MET   1 -14.394  -0.876  12.082
    3    H3   MET   1           HT3      MET   1 -13.553  -2.287  11.696
    4    HA   MET   1           HA       MET   1 -14.487  -2.341   9.529
    5    HB2  MET   1           HB2      MET   1 -15.895  -0.450   8.711
    6    HB3  MET   1           HB1      MET   1 -16.679  -1.352   9.996
    7    HG2  MET   1           HG2      MET   1 -16.196   0.414  11.598
    8    HG3  MET   1           HG1      MET   1 -15.244   1.287  10.395
    9    HE1  MET   1           HE1      MET   1 -18.367   3.620  10.761
   10    HE2  MET   1           HE2      MET   1 -16.607   3.539  10.765
   11    HE3  MET   1           HE3      MET   1 -17.528   2.736  12.037
   12    H    ASN   2           HN       ASN   2 -12.799  -1.886   8.275
   13    HA   ASN   2           HA       ASN   2 -11.748   0.813   8.026
   14    HB2  ASN   2           HB2      ASN   2  -9.365   0.117   8.254
   15    HB3  ASN   2           HB1      ASN   2 -10.253   0.003   9.762
   16   HD21  ASN   2          HD21      ASN   2  -9.146  -1.532  10.809
   17   HD22  ASN   2          HD22      ASN   2  -8.845  -3.131  10.240
   18    H    ALA   3           HN       ALA   3 -10.227   0.951   6.223
   19    HA   ALA   3           HA       ALA   3 -11.277   0.167   3.833
   20    HB1  ALA   3           HB1      ALA   3  -9.167   0.902   2.819
   21    HB2  ALA   3           HB2      ALA   3  -8.363   0.832   4.391
   22    HB3  ALA   3           HB3      ALA   3  -9.666   1.989   4.113
   23    H    ILE   4           HN       ILE   4  -8.678  -1.443   5.622
   24    HA   ILE   4           HA       ILE   4  -7.898  -3.278   3.609
   25    HB   ILE   4           HB       ILE   4  -7.570  -3.785   6.588
   26   HG12  ILE   4          HG12      ILE   4  -5.179  -2.713   6.156
   27   HG13  ILE   4          HG11      ILE   4  -5.988  -1.882   4.839
   28   HG21  ILE   4          HG21      ILE   4  -5.889  -4.733   4.247
   29   HG22  ILE   4          HG22      ILE   4  -7.027  -5.708   5.175
   30   HG23  ILE   4          HG23      ILE   4  -5.570  -5.087   5.952
   31   HD11  ILE   4          HD11      ILE   4  -5.832  -0.468   6.790
   32   HD12  ILE   4          HD12      ILE   4  -6.649  -1.671   7.784
   33   HD13  ILE   4          HD13      ILE   4  -7.534  -0.848   6.495
   34    H    ASP   5           HN       ASP   5 -10.245  -3.390   6.218
   35    HA   ASP   5           HA       ASP   5 -10.977  -6.141   6.099
   36    HB2  ASP   5           HB2      ASP   5 -11.351  -4.766   8.115
   37    HB3  ASP   5           HB1      ASP   5 -12.466  -3.730   7.234
   38    H    ILE   6           HN       ILE   6 -12.445  -3.169   4.859
   39    HA   ILE   6           HA       ILE   6 -14.762  -4.348   3.719
   40    HB   ILE   6           HB       ILE   6 -13.422  -1.668   3.177
   41   HG12  ILE   6          HG12      ILE   6 -14.211  -1.945   5.507
   42   HG13  ILE   6          HG11      ILE   6 -15.157  -0.725   4.670
   43   HG21  ILE   6          HG21      ILE   6 -14.813  -2.225   1.233
   44   HG22  ILE   6          HG22      ILE   6 -15.547  -0.914   2.150
   45   HG23  ILE   6          HG23      ILE   6 -16.196  -2.549   2.283
   46   HD11  ILE   6          HD11      ILE   6 -16.564  -2.092   6.087
   47   HD12  ILE   6          HD12      ILE   6 -16.019  -3.555   5.269
   48   HD13  ILE   6          HD13      ILE   6 -16.977  -2.360   4.394
   49    H    ALA   7           HN       ALA   7 -11.515  -3.818   2.538
   50    HA   ALA   7           HA       ALA   7 -12.009  -4.454  -0.209
   51    HB1  ALA   7           HB1      ALA   7  -9.401  -4.589   1.330
   52    HB2  ALA   7           HB2      ALA   7 -10.032  -3.167   0.494
   53    HB3  ALA   7           HB3      ALA   7  -9.584  -4.608  -0.428
   54    H    ILE   8           HN       ILE   8 -11.167  -6.375   2.676
   55    HA   ILE   8           HA       ILE   8 -10.828  -8.918   1.458
   56    HB   ILE   8           HB       ILE   8 -12.101  -8.359   4.184
   57   HG12  ILE   8          HG12      ILE   8  -9.169  -8.997   3.623
   58   HG13  ILE   8          HG11      ILE   8  -9.782  -7.373   3.891
   59   HG21  ILE   8          HG21      ILE   8 -11.406 -10.669   4.781
   60   HG22  ILE   8          HG22      ILE   8 -10.821 -10.919   3.134
   61   HG23  ILE   8          HG23      ILE   8 -12.540 -10.656   3.432
   62   HD11  ILE   8          HD11      ILE   8  -9.849  -9.635   5.876
   63   HD12  ILE   8          HD12      ILE   8 -10.479  -8.008   6.147
   64   HD13  ILE   8          HD13      ILE   8  -8.754  -8.254   5.884
   65    H    ASN   9           HN       ASN   9 -13.705  -7.288   2.782
   66    HA   ASN   9           HA       ASN   9 -15.644  -9.236   2.213
   67    HB2  ASN   9           HB2      ASN   9 -15.937  -6.212   2.469
   68    HB3  ASN   9           HB1      ASN   9 -17.313  -7.306   2.334
   69   HD21  ASN   9          HD21      ASN   9 -14.994  -5.928   4.448
   70   HD22  ASN   9          HD22      ASN   9 -15.463  -6.747   5.891
   71    H    LYS  10           HN       LYS  10 -14.445  -6.504   0.276
   72    HA   LYS  10           HA       LYS  10 -16.414  -6.652  -1.767
   73    HB2  LYS  10           HB2      LYS  10 -14.739  -4.688  -1.114
   74    HB3  LYS  10           HB1      LYS  10 -13.671  -5.424  -2.295
   75    HG2  LYS  10           HG2      LYS  10 -16.457  -4.876  -3.244
   76    HG3  LYS  10           HG1      LYS  10 -15.521  -3.450  -2.834
   77    HD2  LYS  10           HD2      LYS  10 -15.158  -3.720  -5.139
   78    HD3  LYS  10           HD1      LYS  10 -13.697  -4.383  -4.406
   79    HE2  LYS  10           HE2      LYS  10 -14.502  -6.652  -4.777
   80    HE3  LYS  10           HE1      LYS  10 -16.049  -6.056  -5.376
   81    HZ1  LYS  10           HZ1      LYS  10 -14.595  -6.707  -7.168
   82    HZ2  LYS  10           HZ2      LYS  10 -13.401  -5.637  -6.648
   83    HZ3  LYS  10           HZ3      LYS  10 -14.870  -5.041  -7.232
   84    H    LEU  11           HN       LEU  11 -13.017  -7.793  -1.627
   85    HA   LEU  11           HA       LEU  11 -13.200  -9.060  -4.222
   86    HB2  LEU  11           HB2      LEU  11 -11.003  -9.406  -2.163
   87    HB3  LEU  11           HB1      LEU  11 -10.931  -9.863  -3.856
   88    HG   LEU  11           HG       LEU  11 -10.680  -7.127  -2.597
   89   HD11  LEU  11          HD11      LEU  11  -8.768  -6.907  -4.120
   90   HD12  LEU  11          HD12      LEU  11  -9.130  -8.489  -4.810
   91   HD13  LEU  11          HD13      LEU  11  -8.646  -8.355  -3.122
   92   HD21  LEU  11          HD21      LEU  11 -10.981  -5.985  -4.755
   93   HD22  LEU  11          HD22      LEU  11 -12.473  -6.734  -4.204
   94   HD23  LEU  11          HD23      LEU  11 -11.535  -7.495  -5.492
   95    H    GLY  12           HN       GLY  12 -14.035  -9.972  -1.036
   96    HA2  GLY  12           HA2      GLY  12 -15.510 -11.772  -0.629
   97    HA3  GLY  12           HA1      GLY  12 -14.830 -12.631  -2.002
   98    H    SER  13           HN       SER  13 -12.074 -11.643  -0.568
   99    HA   SER  13           HA       SER  13 -11.859 -13.285   1.741
  100    HB2  SER  13           HB2      SER  13 -10.404 -15.100   0.749
  101    HB3  SER  13           HB1      SER  13 -12.074 -15.157   0.179
  102    HG   SER  13           HG       SER  13 -11.452 -14.290  -1.738
  103    H    VAL  14           HN       VAL  14  -9.596 -13.644   2.401
  104    HA   VAL  14           HA       VAL  14  -7.943 -11.294   1.991
  105    HB   VAL  14           HB       VAL  14  -7.853 -13.670   3.900
  106   HG11  VAL  14          HG11      VAL  14  -5.843 -12.729   4.991
  107   HG12  VAL  14          HG12      VAL  14  -5.689 -11.540   3.694
  108   HG13  VAL  14          HG13      VAL  14  -5.495 -13.255   3.346
  109   HG21  VAL  14          HG21      VAL  14  -8.093 -10.663   4.289
  110   HG22  VAL  14          HG22      VAL  14  -8.051 -11.859   5.603
  111   HG23  VAL  14          HG23      VAL  14  -9.387 -11.863   4.453
  112    H    SER  15           HN       SER  15  -7.978 -14.658   0.988
  113    HA   SER  15           HA       SER  15  -5.279 -14.777   0.073
  114    HB2  SER  15           HB2      SER  15  -6.097 -16.832  -1.190
  115    HB3  SER  15           HB1      SER  15  -6.398 -16.863   0.547
  116    HG   SER  15           HG       SER  15  -8.165 -16.976  -1.477
  117    H    ALA  16           HN       ALA  16  -8.405 -14.043  -1.479
  118    HA   ALA  16           HA       ALA  16  -7.411 -13.407  -4.070
  119    HB1  ALA  16           HB1      ALA  16  -9.894 -12.325  -2.674
  120    HB2  ALA  16           HB2      ALA  16  -9.814 -13.796  -3.648
  121    HB3  ALA  16           HB3      ALA  16  -9.557 -12.224  -4.405
  122    H    LEU  17           HN       LEU  17  -7.960 -11.444  -1.142
  123    HA   LEU  17           HA       LEU  17  -7.410  -8.916  -2.263
  124    HB2  LEU  17           HB2      LEU  17  -8.612  -9.216  -0.115
  125    HB3  LEU  17           HB1      LEU  17  -7.127  -9.773   0.644
  126    HG   LEU  17           HG       LEU  17  -6.098  -7.589   0.356
  127   HD11  LEU  17          HD11      LEU  17  -7.330  -5.621  -0.509
  128   HD12  LEU  17          HD12      LEU  17  -8.680  -6.666  -0.960
  129   HD13  LEU  17          HD13      LEU  17  -7.114  -6.854  -1.750
  130   HD21  LEU  17          HD21      LEU  17  -7.420  -6.270   1.910
  131   HD22  LEU  17          HD22      LEU  17  -7.378  -7.968   2.383
  132   HD23  LEU  17          HD23      LEU  17  -8.827  -7.302   1.617
  133    H    ALA  18           HN       ALA  18  -5.334 -11.187  -0.560
  134    HA   ALA  18           HA       ALA  18  -3.015  -9.526  -0.435
  135    HB1  ALA  18           HB1      ALA  18  -3.473 -11.297   1.224
  136    HB2  ALA  18           HB2      ALA  18  -1.892 -11.507   0.465
  137    HB3  ALA  18           HB3      ALA  18  -3.250 -12.525  -0.026
  138    H    ALA  19           HN       ALA  19  -4.179 -12.071  -2.615
  139    HA   ALA  19           HA       ALA  19  -1.865 -12.366  -4.228
  140    HB1  ALA  19           HB1      ALA  19  -3.402 -13.317  -5.919
  141    HB2  ALA  19           HB2      ALA  19  -4.785 -12.722  -4.996
  142    HB3  ALA  19           HB3      ALA  19  -3.736 -13.963  -4.309
  143    H    ALA  20           HN       ALA  20  -4.576 -10.113  -4.291
  144    HA   ALA  20           HA       ALA  20  -3.945  -8.792  -6.755
  145    HB1  ALA  20           HB1      ALA  20  -5.731  -7.905  -4.461
  146    HB2  ALA  20           HB2      ALA  20  -6.241  -8.844  -5.865
  147    HB3  ALA  20           HB3      ALA  20  -5.696  -7.177  -6.069
  148    H    LEU  21           HN       LEU  21  -3.272  -8.164  -3.349
  149    HA   LEU  21           HA       LEU  21  -2.062  -5.569  -3.804
  150    HB2  LEU  21           HB2      LEU  21  -2.349  -7.259  -1.300
  151    HB3  LEU  21           HB1      LEU  21  -1.637  -5.648  -1.318
  152    HG   LEU  21           HG       LEU  21  -4.507  -6.295  -2.104
  153   HD11  LEU  21          HD11      LEU  21  -3.449  -5.066   0.443
  154   HD12  LEU  21          HD12      LEU  21  -4.303  -6.602   0.250
  155   HD13  LEU  21          HD13      LEU  21  -5.152  -5.085  -0.038
  156   HD21  LEU  21          HD21      LEU  21  -3.132  -3.609  -1.838
  157   HD22  LEU  21          HD22      LEU  21  -4.856  -3.858  -2.134
  158   HD23  LEU  21          HD23      LEU  21  -3.675  -4.371  -3.334
  159    H    GLY  22           HN       GLY  22  -0.982  -8.799  -3.858
  160    HA2  GLY  22           HA2      GLY  22   1.084  -9.691  -4.347
  161    HA3  GLY  22           HA1      GLY  22   1.739  -8.062  -4.424
  162    H    VAL  23           HN       VAL  23   0.078  -9.481  -1.669
  163    HA   VAL  23           HA       VAL  23   2.590  -9.877  -0.165
  164    HB   VAL  23           HB       VAL  23   1.439  -9.078   1.908
  165   HG11  VAL  23          HG11      VAL  23   1.556  -6.970  -0.277
  166   HG12  VAL  23          HG12      VAL  23   2.916  -7.541   0.692
  167   HG13  VAL  23          HG13      VAL  23   1.593  -6.665   1.462
  168   HG21  VAL  23          HG21      VAL  23  -0.820  -8.178   0.053
  169   HG22  VAL  23          HG22      VAL  23  -0.683  -7.771   1.764
  170   HG23  VAL  23          HG23      VAL  23  -0.925  -9.447   1.278
  171    H    ASN  24           HN       ASN  24   1.805 -11.158   2.040
  172    HA   ASN  24           HA       ASN  24   0.316 -13.506   1.090
  173    HB2  ASN  24           HB2      ASN  24   1.191 -14.718   3.017
  174    HB3  ASN  24           HB1      ASN  24   2.504 -13.953   2.144
  175   HD21  ASN  24          HD21      ASN  24   2.447 -14.919   4.879
  176   HD22  ASN  24          HD22      ASN  24   2.843 -13.573   5.885
  177    H    GLN  25           HN       GLN  25  -1.068 -14.601   2.748
  178    HA   GLN  25           HA       GLN  25  -3.322 -13.035   3.301
  179    HB2  GLN  25           HB2      GLN  25  -2.514 -15.820   4.226
  180    HB3  GLN  25           HB1      GLN  25  -4.032 -15.096   4.733
  181    HG2  GLN  25           HG2      GLN  25  -4.489 -16.545   2.899
  182    HG3  GLN  25           HG1      GLN  25  -4.705 -14.892   2.341
  183   HE21  GLN  25          HE21      GLN  25  -3.193 -14.040   0.854
  184   HE22  GLN  25          HE22      GLN  25  -2.136 -15.048  -0.065
  185    H    SER  26           HN       SER  26  -0.637 -13.947   5.386
  186    HA   SER  26           HA       SER  26  -1.722 -13.095   7.860
  187    HB2  SER  26           HB2      SER  26   1.205 -13.360   7.041
  188    HB3  SER  26           HB1      SER  26   0.594 -13.264   8.700
  189    HG   SER  26           HG       SER  26  -0.786 -15.180   7.757
  190    H    ALA  27           HN       ALA  27   0.274 -11.406   5.397
  191    HA   ALA  27           HA       ALA  27   0.874  -9.055   6.800
  192    HB1  ALA  27           HB1      ALA  27   1.873  -9.599   4.616
  193    HB2  ALA  27           HB2      ALA  27   1.186  -7.975   4.610
  194    HB3  ALA  27           HB3      ALA  27   0.322  -9.303   3.828
  195    H    ILE  28           HN       ILE  28  -1.972  -9.867   4.860
  196    HA   ILE  28           HA       ILE  28  -3.380  -7.430   4.996
  197    HB   ILE  28           HB       ILE  28  -4.516 -10.259   4.839
  198   HG12  ILE  28          HG12      ILE  28  -2.893  -9.790   3.034
  199   HG13  ILE  28          HG11      ILE  28  -4.525  -9.942   2.398
  200   HG21  ILE  28          HG21      ILE  28  -6.500  -9.229   3.779
  201   HG22  ILE  28          HG22      ILE  28  -5.819  -7.625   4.063
  202   HG23  ILE  28          HG23      ILE  28  -6.275  -8.648   5.429
  203   HD11  ILE  28          HD11      ILE  28  -4.675  -7.498   2.248
  204   HD12  ILE  28          HD12      ILE  28  -3.336  -8.148   1.307
  205   HD13  ILE  28          HD13      ILE  28  -3.024  -7.366   2.856
  206    H    SER  29           HN       SER  29  -3.386 -10.250   7.138
  207    HA   SER  29           HA       SER  29  -5.458  -9.448   8.897
  208    HB2  SER  29           HB2      SER  29  -3.090 -11.275   9.502
  209    HB3  SER  29           HB1      SER  29  -4.646 -11.253  10.340
  210    HG   SER  29           HG       SER  29  -4.523 -11.719   7.554
  211    H    GLN  30           HN       GLN  30  -1.909  -9.030   9.003
  212    HA   GLN  30           HA       GLN  30  -1.729  -7.621  11.436
  213    HB2  GLN  30           HB2      GLN  30   0.098  -8.075   9.116
  214    HB3  GLN  30           HB1      GLN  30   0.399  -6.573   9.974
  215    HG2  GLN  30           HG2      GLN  30   1.840  -8.220  10.910
  216    HG3  GLN  30           HG1      GLN  30   0.600  -7.875  12.111
  217   HE21  GLN  30          HE21      GLN  30   0.768  -9.786  13.193
  218   HE22  GLN  30          HE22      GLN  30   0.359 -11.323  12.531
  219    H    TRP  31           HN       TRP  31  -2.166  -6.459   8.086
  220    HA   TRP  31           HA       TRP  31  -1.980  -3.691   8.600
  221    HB2  TRP  31           HB2      TRP  31  -3.354  -5.177   6.342
  222    HB3  TRP  31           HB1      TRP  31  -3.154  -3.427   6.375
  223    HD1  TRP  31           HD1      TRP  31   0.046  -4.439   7.683
  224    HE1  TRP  31           HE1      TRP  31   1.796  -4.699   5.814
  225    HE3  TRP  31           HE3      TRP  31  -3.084  -4.665   3.632
  226    HZ2  TRP  31           HZ2      TRP  31   1.841  -4.958   3.014
  227    HZ3  TRP  31           HZ3      TRP  31  -2.105  -4.911   1.401
  228    HH2  TRP  31           HH2      TRP  31   0.305  -5.057   1.098
  229    H    ARG  32           HN       ARG  32  -4.702  -5.906   8.651
  230    HA   ARG  32           HA       ARG  32  -6.791  -3.937   8.752
  231    HB2  ARG  32           HB2      ARG  32  -7.012  -6.390   7.964
  232    HB3  ARG  32           HB1      ARG  32  -7.001  -6.855   9.663
  233    HG2  ARG  32           HG2      ARG  32  -9.008  -5.268   9.942
  234    HG3  ARG  32           HG1      ARG  32  -9.075  -5.205   8.183
  235    HD2  ARG  32           HD2      ARG  32 -10.663  -6.853   8.852
  236    HD3  ARG  32           HD1      ARG  32  -9.278  -7.748   8.224
  237    HE   ARG  32           HE       ARG  32  -8.593  -8.049  10.600
  238   HH11  ARG  32          HH11      ARG  32 -12.530  -8.242  11.345
  239   HH12  ARG  32          HH12      ARG  32 -11.985  -7.468   9.895
  240   HH21  ARG  32          HH21      ARG  32  -9.328  -9.012  12.506
  241   HH22  ARG  32          HH22      ARG  32 -11.029  -9.119  12.828
  242    H    ALA  33           HN       ALA  33  -5.020  -5.907  11.092
  243    HA   ALA  33           HA       ALA  33  -6.467  -4.941  13.390
  244    HB1  ALA  33           HB1      ALA  33  -5.531  -7.206  13.383
  245    HB2  ALA  33           HB2      ALA  33  -4.828  -6.263  14.698
  246    HB3  ALA  33           HB3      ALA  33  -3.899  -6.553  13.223
  247    H    ARG  34           HN       ARG  34  -3.755  -3.907  11.552
  248    HA   ARG  34           HA       ARG  34  -2.506  -2.168  13.484
  249    HB2  ARG  34           HB2      ARG  34  -1.258  -3.235  11.629
  250    HB3  ARG  34           HB1      ARG  34  -2.297  -2.449  10.461
  251    HG2  ARG  34           HG2      ARG  34  -0.208  -1.351  10.452
  252    HG3  ARG  34           HG1      ARG  34  -1.385  -0.259  11.162
  253    HD2  ARG  34           HD2      ARG  34  -0.532  -0.722  13.400
  254    HD3  ARG  34           HD1      ARG  34   0.574  -1.941  12.754
  255    HE   ARG  34           HE       ARG  34   1.462   0.094  11.403
  256   HH11  ARG  34          HH11      ARG  34   0.477   0.179  14.772
  257   HH12  ARG  34          HH12      ARG  34   1.566   1.464  15.162
  258   HH21  ARG  34          HH21      ARG  34   2.878   1.751  11.944
  259   HH22  ARG  34          HH22      ARG  34   2.928   2.361  13.565
  260    H    GLY  35           HN       GLY  35  -4.874  -1.950  10.914
  261    HA2  GLY  35           HA2      GLY  35  -6.652  -0.447  10.681
  262    HA3  GLY  35           HA1      GLY  35  -5.903   0.619  11.864
  263    H    ARG  36           HN       ARG  36  -3.591  -0.328   9.634
  264    HA   ARG  36           HA       ARG  36  -4.124   1.603   7.533
  265    HB2  ARG  36           HB2      ARG  36  -2.112   2.976   7.901
  266    HB3  ARG  36           HB1      ARG  36  -3.124   3.066   9.327
  267    HG2  ARG  36           HG2      ARG  36  -1.251   0.904   9.692
  268    HG3  ARG  36           HG1      ARG  36  -0.356   2.314   9.150
  269    HD2  ARG  36           HD2      ARG  36  -2.299   2.422  11.483
  270    HD3  ARG  36           HD1      ARG  36  -0.602   1.979  11.689
  271    HE   ARG  36           HE       ARG  36  -1.116   4.502  10.324
  272   HH11  ARG  36          HH11      ARG  36   0.192   4.422  14.124
  273   HH12  ARG  36          HH12      ARG  36  -0.422   2.975  13.403
  274   HH21  ARG  36          HH21      ARG  36   0.315   6.376  12.873
  275   HH22  ARG  36          HH22      ARG  36  -0.210   6.371  11.219
  276    H    VAL  37           HN       VAL  37  -2.425   1.480   5.866
  277    HA   VAL  37           HA       VAL  37  -0.918  -1.088   5.881
  278    HB   VAL  37           HB       VAL  37  -1.088  -1.135   3.431
  279   HG11  VAL  37          HG11      VAL  37  -3.497  -1.605   3.204
  280   HG12  VAL  37          HG12      VAL  37  -3.807  -0.761   4.724
  281   HG13  VAL  37          HG13      VAL  37  -2.847  -2.241   4.716
  282   HG21  VAL  37          HG21      VAL  37  -1.134   1.282   2.946
  283   HG22  VAL  37          HG22      VAL  37  -2.752   1.412   3.638
  284   HG23  VAL  37          HG23      VAL  37  -2.493   0.471   2.167
  285    HA   PRO  38           HA       PRO  38   3.036   1.084   5.192
  286    HB2  PRO  38           HB2      PRO  38   3.293  -0.992   2.977
  287    HB3  PRO  38           HB1      PRO  38   4.482  -0.507   4.208
  288    HG2  PRO  38           HG2      PRO  38   3.179  -2.757   4.530
  289    HG3  PRO  38           HG1      PRO  38   3.387  -1.657   5.916
  290    HD2  PRO  38           HD2      PRO  38   0.948  -2.085   4.204
  291    HD3  PRO  38           HD1      PRO  38   1.067  -1.884   5.965
  292    H    ALA  39           HN       ALA  39   4.226   2.215   3.522
  293    HA   ALA  39           HA       ALA  39   2.611   3.990   2.072
  294    HB1  ALA  39           HB1      ALA  39   4.783   4.608   3.027
  295    HB2  ALA  39           HB2      ALA  39   4.759   4.928   1.291
  296    HB3  ALA  39           HB3      ALA  39   5.607   3.512   1.911
  297    H    GLY  40           HN       GLY  40   1.675   3.697   0.126
  298    HA2  GLY  40           HA2      GLY  40   1.483   3.347  -2.151
  299    HA3  GLY  40           HA1      GLY  40   3.041   2.532  -2.154
  300    H    ARG  41           HN       ARG  41  -0.266   2.073  -0.841
  301    HA   ARG  41           HA       ARG  41  -0.649  -0.389  -2.262
  302    HB2  ARG  41           HB2      ARG  41   0.820  -1.060  -0.247
  303    HB3  ARG  41           HB1      ARG  41  -0.559  -0.676   0.770
  304    HG2  ARG  41           HG2      ARG  41  -0.646  -3.015   0.481
  305    HG3  ARG  41           HG1      ARG  41  -1.877  -2.391  -0.615
  306    HD2  ARG  41           HD2      ARG  41   0.938  -3.205  -1.422
  307    HD3  ARG  41           HD1      ARG  41  -0.502  -4.198  -1.626
  308    HE   ARG  41           HE       ARG  41  -1.225  -2.034  -3.035
  309   HH11  ARG  41          HH11      ARG  41   1.849  -3.764  -3.055
  310   HH12  ARG  41          HH12      ARG  41   2.201  -3.358  -4.704
  311   HH21  ARG  41          HH21      ARG  41   0.761  -2.108  -5.922
  312   HH22  ARG  41          HH22      ARG  41  -0.717  -1.536  -5.224
  313    H    CYS  42           HN       CYS  42  -1.684   1.937   0.105
  314    HA   CYS  42           HA       CYS  42  -4.343   1.156   0.564
  315    HB2  CYS  42           HB2      CYS  42  -3.429   2.889   1.930
  316    HB3  CYS  42           HB1      CYS  42  -3.015   3.877   0.535
  317    H    ILE  43           HN       ILE  43  -2.855   2.703  -2.161
  318    HA   ILE  43           HA       ILE  43  -4.950   3.889  -3.552
  319    HB   ILE  43           HB       ILE  43  -2.565   2.334  -4.655
  320   HG12  ILE  43          HG12      ILE  43  -2.878   5.330  -4.109
  321   HG13  ILE  43          HG11      ILE  43  -1.972   4.209  -3.098
  322   HG21  ILE  43          HG21      ILE  43  -4.320   4.356  -6.109
  323   HG22  ILE  43          HG22      ILE  43  -4.239   2.623  -6.427
  324   HG23  ILE  43          HG23      ILE  43  -2.837   3.639  -6.751
  325   HD11  ILE  43          HD11      ILE  43  -1.325   4.979  -5.936
  326   HD12  ILE  43          HD12      ILE  43  -0.417   3.827  -4.953
  327   HD13  ILE  43          HD13      ILE  43  -0.499   5.524  -4.478
  328    H    ASP  44           HN       ASP  44  -3.873   0.510  -3.574
  329    HA   ASP  44           HA       ASP  44  -5.758  -0.379  -5.542
  330    HB2  ASP  44           HB2      ASP  44  -4.280  -2.137  -3.545
  331    HB3  ASP  44           HB1      ASP  44  -4.889  -2.583  -5.139
  332    H    ILE  45           HN       ILE  45  -5.482  -0.806  -2.012
  333    HA   ILE  45           HA       ILE  45  -7.895  -2.117  -1.512
  334    HB   ILE  45           HB       ILE  45  -6.260  -0.250   0.257
  335   HG12  ILE  45          HG12      ILE  45  -6.495  -3.293   0.068
  336   HG13  ILE  45          HG11      ILE  45  -5.068  -2.308  -0.236
  337   HG21  ILE  45          HG21      ILE  45  -8.596  -1.966   1.155
  338   HG22  ILE  45          HG22      ILE  45  -8.590  -0.205   1.064
  339   HG23  ILE  45          HG23      ILE  45  -7.531  -1.027   2.207
  340   HD11  ILE  45          HD11      ILE  45  -6.367  -2.871   2.443
  341   HD12  ILE  45          HD12      ILE  45  -5.024  -1.749   2.197
  342   HD13  ILE  45          HD13      ILE  45  -4.813  -3.463   1.847
  343    H    GLU  46           HN       GLU  46  -7.284   1.297  -2.081
  344    HA   GLU  46           HA       GLU  46  -9.811   2.252  -1.113
  345    HB2  GLU  46           HB2      GLU  46  -7.755   3.674  -1.099
  346    HB3  GLU  46           HB1      GLU  46  -7.794   3.727  -2.857
  347    HG2  GLU  46           HG2      GLU  46  -9.753   5.032  -2.891
  348    HG3  GLU  46           HG1      GLU  46 -10.151   4.648  -1.219
  349    H    LEU  47           HN       LEU  47  -8.581   1.138  -4.208
  350    HA   LEU  47           HA       LEU  47 -10.724   1.864  -5.900
  351    HB2  LEU  47           HB2      LEU  47  -8.999  -0.642  -5.832
  352    HB3  LEU  47           HB1      LEU  47 -10.140  -0.312  -7.121
  353    HG   LEU  47           HG       LEU  47  -7.876   1.617  -6.490
  354   HD11  LEU  47          HD11      LEU  47  -7.727  -0.722  -8.429
  355   HD12  LEU  47          HD12      LEU  47  -6.835  -0.573  -6.917
  356   HD13  LEU  47          HD13      LEU  47  -6.514   0.548  -8.234
  357   HD21  LEU  47          HD21      LEU  47  -9.513   1.108  -8.995
  358   HD22  LEU  47          HD22      LEU  47  -8.234   2.320  -8.834
  359   HD23  LEU  47          HD23      LEU  47  -9.713   2.468  -7.886
  360    H    TYR  48           HN       TYR  48 -10.286  -0.779  -3.577
  361    HA   TYR  48           HA       TYR  48 -12.791  -2.089  -4.315
  362    HB2  TYR  48           HB2      TYR  48 -11.139  -2.914  -1.902
  363    HB3  TYR  48           HB1      TYR  48 -12.118  -3.923  -2.973
  364    HD1  TYR  48           HD1      TYR  48  -9.133  -4.283  -1.989
  365    HD2  TYR  48           HD2      TYR  48 -10.801  -2.796  -5.637
  366    HE1  TYR  48           HE1      TYR  48  -7.077  -4.868  -3.177
  367    HE2  TYR  48           HE2      TYR  48  -8.730  -3.368  -6.823
  368    HH   TYR  48           HH       TYR  48  -6.300  -3.747  -6.210
  369    H    THR  49           HN       THR  49 -11.824   0.342  -2.096
  370    HA   THR  49           HA       THR  49 -14.298   0.063  -0.449
  371    HB   THR  49           HB       THR  49 -13.104   1.085   1.419
  372    HG1  THR  49           HG1      THR  49 -11.659   2.491   0.620
  373   HG21  THR  49          HG21      THR  49 -11.368  -1.071   0.158
  374   HG22  THR  49          HG22      THR  49 -12.797  -1.348   1.158
  375   HG23  THR  49          HG23      THR  49 -11.365  -0.598   1.855
  376    H    ASP  50           HN       ASP  50 -13.840   1.433  -2.988
  377    HA   ASP  50           HA       ASP  50 -13.066   4.023  -3.114
  378    HB2  ASP  50           HB2      ASP  50 -14.473   4.190  -5.177
  379    HB3  ASP  50           HB1      ASP  50 -13.561   2.688  -5.085
  380    H    GLY  51           HN       GLY  51 -16.434   3.063  -2.407
  381    HA2  GLY  51           HA2      GLY  51 -16.996   5.823  -1.404
  382    HA3  GLY  51           HA1      GLY  51 -18.162   4.884  -2.335
  383    H    ARG  52           HN       ARG  52 -16.346   2.914  -0.305
  384    HA   ARG  52           HA       ARG  52 -18.619   2.488   1.503
  385    HB2  ARG  52           HB2      ARG  52 -16.140   0.868   0.847
  386    HB3  ARG  52           HB1      ARG  52 -17.144   0.464   2.230
  387    HG2  ARG  52           HG2      ARG  52 -17.819  -0.979   0.469
  388    HG3  ARG  52           HG1      ARG  52 -19.099   0.214   0.646
  389    HD2  ARG  52           HD2      ARG  52 -18.075   1.454  -1.317
  390    HD3  ARG  52           HD1      ARG  52 -17.007   0.060  -1.554
  391    HE   ARG  52           HE       ARG  52 -19.715  -0.779  -1.376
  392   HH11  ARG  52          HH11      ARG  52 -17.551   0.767  -3.709
  393   HH12  ARG  52          HH12      ARG  52 -18.477   0.222  -5.068
  394   HH21  ARG  52          HH21      ARG  52 -20.378  -1.012  -4.749
  395   HH22  ARG  52          HH22      ARG  52 -20.910  -1.415  -3.154
  396    H    VAL  53           HN       VAL  53 -15.095   2.938   1.681
  397    HA   VAL  53           HA       VAL  53 -15.298   4.641   4.019
  398    HB   VAL  53           HB       VAL  53 -15.230   2.452   5.157
  399   HG11  VAL  53          HG11      VAL  53 -14.256   1.088   3.374
  400   HG12  VAL  53          HG12      VAL  53 -13.360   0.860   4.876
  401   HG13  VAL  53          HG13      VAL  53 -12.689   1.874   3.595
  402   HG21  VAL  53          HG21      VAL  53 -14.004   4.298   6.255
  403   HG22  VAL  53          HG22      VAL  53 -12.530   3.860   5.390
  404   HG23  VAL  53          HG23      VAL  53 -13.213   2.754   6.585
  405    H    GLU  54           HN       GLU  54 -13.618   6.137   4.018
  406    HA   GLU  54           HA       GLU  54 -11.841   6.219   1.779
  407    HB2  GLU  54           HB2      GLU  54 -12.723   8.279   2.896
  408    HB3  GLU  54           HB1      GLU  54 -11.732   7.926   4.311
  409    HG2  GLU  54           HG2      GLU  54  -9.689   8.222   3.011
  410    HG3  GLU  54           HG1      GLU  54 -10.616   8.403   1.523
  411    H    CYS  55           HN       CYS  55  -9.764   5.610   1.611
  412    HA   CYS  55           HA       CYS  55  -8.651   3.903   3.727
  413    HB2  CYS  55           HB2      CYS  55  -8.946   2.794   1.620
  414    HB3  CYS  55           HB1      CYS  55  -8.155   4.102   0.748
  415    H    ARG  56           HN       ARG  56  -6.456   4.096   4.391
  416    HA   ARG  56           HA       ARG  56  -4.881   6.357   3.420
  417    HB2  ARG  56           HB2      ARG  56  -4.347   7.244   5.618
  418    HB3  ARG  56           HB1      ARG  56  -6.090   7.228   5.423
  419    HG2  ARG  56           HG2      ARG  56  -4.549   5.137   6.995
  420    HG3  ARG  56           HG1      ARG  56  -5.257   6.578   7.719
  421    HD2  ARG  56           HD2      ARG  56  -7.508   5.794   6.981
  422    HD3  ARG  56           HD1      ARG  56  -6.751   4.344   6.312
  423    HE   ARG  56           HE       ARG  56  -5.938   3.973   8.717
  424   HH11  ARG  56          HH11      ARG  56  -9.036   5.477   8.006
  425   HH12  ARG  56          HH12      ARG  56  -9.752   4.938   9.483
  426   HH21  ARG  56          HH21      ARG  56  -6.902   3.311  10.654
  427   HH22  ARG  56          HH22      ARG  56  -8.553   3.712  10.990
  428    H    GLU  57           HN       GLU  57  -2.764   5.990   3.307
  429    HA   GLU  57           HA       GLU  57  -1.554   3.535   4.471
  430    HB2  GLU  57           HB2      GLU  57   0.197   3.823   2.633
  431    HB3  GLU  57           HB1      GLU  57  -1.404   3.387   2.062
  432    HG2  GLU  57           HG2      GLU  57  -1.828   5.768   1.473
  433    HG3  GLU  57           HG1      GLU  57  -0.180   6.158   1.980
  434    H    LEU  58           HN       LEU  58   0.726   3.791   5.034
  435    HA   LEU  58           HA       LEU  58   1.355   6.194   6.472
  436    HB2  LEU  58           HB2      LEU  58   3.069   3.765   5.825
  437    HB3  LEU  58           HB1      LEU  58   3.500   5.028   6.973
  438    HG   LEU  58           HG       LEU  58   1.105   3.167   7.260
  439   HD11  LEU  58          HD11      LEU  58   2.336   2.037   9.043
  440   HD12  LEU  58          HD12      LEU  58   3.752   3.049   8.734
  441   HD13  LEU  58          HD13      LEU  58   3.190   1.912   7.505
  442   HD21  LEU  58          HD21      LEU  58   2.232   5.205   9.223
  443   HD22  LEU  58          HD22      LEU  58   0.926   4.067   9.563
  444   HD23  LEU  58          HD23      LEU  58   0.699   5.325   8.353
  445    H    ARG  59           HN       ARG  59   3.160   7.580   6.003
  446    HA   ARG  59           HA       ARG  59   3.587   8.012   3.142
  447    HB2  ARG  59           HB2      ARG  59   4.589   9.679   5.498
  448    HB3  ARG  59           HB1      ARG  59   4.597  10.140   3.783
  449    HG2  ARG  59           HG2      ARG  59   2.084  10.018   3.806
  450    HG3  ARG  59           HG1      ARG  59   2.148   9.680   5.534
  451    HD2  ARG  59           HD2      ARG  59   3.210  11.888   5.905
  452    HD3  ARG  59           HD1      ARG  59   3.099  12.228   4.174
  453    HE   ARG  59           HE       ARG  59   0.944  12.252   6.132
  454   HH11  ARG  59          HH11      ARG  59   0.145  12.799   2.228
  455   HH12  ARG  59          HH12      ARG  59   1.697  12.184   2.695
  456   HH21  ARG  59          HH21      ARG  59  -1.095  13.046   5.482
  457   HH22  ARG  59          HH22      ARG  59  -1.434  13.285   3.800
  458    HA   PRO  60           HA       PRO  60   7.369   5.891   2.696
  459    HB2  PRO  60           HB2      PRO  60   9.074   7.663   1.399
  460    HB3  PRO  60           HB1      PRO  60   7.744   6.799   0.597
  461    HG2  PRO  60           HG2      PRO  60   7.797   9.593   1.693
  462    HG3  PRO  60           HG1      PRO  60   7.154   8.975   0.163
  463    HD2  PRO  60           HD2      PRO  60   5.487   9.500   2.216
  464    HD3  PRO  60           HD1      PRO  60   5.223   8.092   1.146
  465    H    ASP  61           HN       ASP  61   8.735   5.347   4.137
  466    HA   ASP  61           HA       ASP  61   9.870   7.181   6.121
  467    HB2  ASP  61           HB2      ASP  61   8.739   5.103   6.902
  468    HB3  ASP  61           HB1      ASP  61   9.895   4.127   6.008
  469    H    VAL  62           HN       VAL  62  11.186   4.258   4.523
  470    HA   VAL  62           HA       VAL  62  13.838   5.430   4.302
  471    HB   VAL  62           HB       VAL  62  12.858   2.695   3.349
  472   HG11  VAL  62          HG11      VAL  62  15.715   3.682   3.753
  473   HG12  VAL  62          HG12      VAL  62  14.928   3.370   2.204
  474   HG13  VAL  62          HG13      VAL  62  15.240   2.037   3.314
  475   HG21  VAL  62          HG21      VAL  62  14.243   3.387   5.978
  476   HG22  VAL  62          HG22      VAL  62  13.819   1.765   5.421
  477   HG23  VAL  62          HG23      VAL  62  12.547   2.930   5.783
  478    H    PHE  63           HN       PHE  63  11.499   3.887   2.112
  479    HA   PHE  63           HA       PHE  63  10.876   4.068  -0.007
  480    HB2  PHE  63           HB2      PHE  63  10.293   6.374   0.661
  481    HB3  PHE  63           HB1      PHE  63  11.895   6.929   0.190
  482    HD1  PHE  63           HD1      PHE  63   8.759   5.374  -1.174
  483    HD2  PHE  63           HD2      PHE  63  12.320   7.575  -2.085
  484    HE1  PHE  63           HE1      PHE  63   7.961   5.725  -3.482
  485    HE2  PHE  63           HE2      PHE  63  11.506   7.922  -4.377
  486    HZ   PHE  63           HZ       PHE  63   9.336   7.003  -5.083
  487    H    GLY  64           HN       GLY  64  13.712   6.174  -0.236
  488    HA2  GLY  64           HA2      GLY  64  15.645   4.587  -1.327
  489    HA3  GLY  64           HA1      GLY  64  14.590   4.970  -2.693
  490    H    ALA  65           HN       ALA  65  16.704   5.953  -3.365
  491    HA   ALA  65           HA       ALA  65  17.960   7.697  -3.968
  492    HB1  ALA  65           HB1      ALA  65  16.927   9.933  -4.059
  493    HB2  ALA  65           HB2      ALA  65  15.624   9.391  -2.999
  494    HB3  ALA  65           HB3      ALA  65  15.803   8.693  -4.611
  Start of MODEL    2
    1    H1   MET   1           HT1      MET   1 -14.790  -2.140  11.602
    2    H2   MET   1           HT2      MET   1 -13.374  -3.031  11.374
    3    H3   MET   1           HT3      MET   1 -14.857  -3.828  11.528
    4    HA   MET   1           HA       MET   1 -14.151  -3.803   9.246
    5    HB2  MET   1           HB2      MET   1 -16.528  -1.957   9.769
    6    HB3  MET   1           HB1      MET   1 -16.197  -2.756   8.239
    7    HG2  MET   1           HG2      MET   1 -16.476  -4.950   9.364
    8    HG3  MET   1           HG1      MET   1 -16.901  -4.101  10.853
    9    HE1  MET   1           HE1      MET   1 -18.751  -6.336   9.330
   10    HE2  MET   1           HE2      MET   1 -20.338  -5.597   9.536
   11    HE3  MET   1           HE3      MET   1 -19.187  -5.593  10.870
   12    H    ASN   2           HN       ASN   2 -12.080  -2.686   9.270
   13    HA   ASN   2           HA       ASN   2 -12.058   0.139   8.490
   14    HB2  ASN   2           HB2      ASN   2  -9.562  -0.131   8.487
   15    HB3  ASN   2           HB1      ASN   2 -10.318  -0.464  10.037
   16   HD21  ASN   2          HD21      ASN   2  -8.553  -1.613  10.703
   17   HD22  ASN   2          HD22      ASN   2  -8.208  -3.202  10.150
   18    H    ALA   3           HN       ALA   3 -10.504   0.638   6.623
   19    HA   ALA   3           HA       ALA   3 -11.593   0.032   4.209
   20    HB1  ALA   3           HB1      ALA   3 -10.066   1.911   4.608
   21    HB2  ALA   3           HB2      ALA   3  -9.563   0.980   3.197
   22    HB3  ALA   3           HB3      ALA   3  -8.703   0.792   4.729
   23    H    ILE   4           HN       ILE   4  -8.838  -1.570   5.749
   24    HA   ILE   4           HA       ILE   4  -8.043  -3.232   3.600
   25    HB   ILE   4           HB       ILE   4  -7.665  -3.912   6.543
   26   HG12  ILE   4          HG12      ILE   4  -5.315  -2.753   6.137
   27   HG13  ILE   4          HG11      ILE   4  -6.167  -1.864   4.888
   28   HG21  ILE   4          HG21      ILE   4  -5.631  -5.091   5.811
   29   HG22  ILE   4          HG22      ILE   4  -5.979  -4.658   4.134
   30   HG23  ILE   4          HG23      ILE   4  -7.069  -5.731   5.018
   31   HD11  ILE   4          HD11      ILE   4  -7.723  -0.999   6.648
   32   HD12  ILE   4          HD12      ILE   4  -6.029  -0.562   6.908
   33   HD13  ILE   4          HD13      ILE   4  -6.755  -1.856   7.856
   34    H    ASP   5           HN       ASP   5 -10.351  -3.595   6.234
   35    HA   ASP   5           HA       ASP   5 -10.965  -6.366   5.839
   36    HB2  ASP   5           HB2      ASP   5 -11.264  -5.200   8.034
   37    HB3  ASP   5           HB1      ASP   5 -12.582  -4.262   7.341
   38    H    ILE   6           HN       ILE   6 -12.560  -3.328   4.916
   39    HA   ILE   6           HA       ILE   6 -14.921  -4.459   3.826
   40    HB   ILE   6           HB       ILE   6 -13.595  -1.778   3.188
   41   HG12  ILE   6          HG12      ILE   6 -14.173  -2.027   5.594
   42   HG13  ILE   6          HG11      ILE   6 -15.111  -0.766   4.813
   43   HG21  ILE   6          HG21      ILE   6 -15.196  -2.344   1.419
   44   HG22  ILE   6          HG22      ILE   6 -15.844  -1.039   2.409
   45   HG23  ILE   6          HG23      ILE   6 -16.451  -2.682   2.614
   46   HD11  ILE   6          HD11      ILE   6 -16.447  -2.053   6.385
   47   HD12  ILE   6          HD12      ILE   6 -16.108  -3.534   5.490
   48   HD13  ILE   6          HD13      ILE   6 -17.055  -2.247   4.742
   49    H    ALA   7           HN       ALA   7 -11.706  -3.837   2.536
   50    HA   ALA   7           HA       ALA   7 -12.210  -4.381  -0.213
   51    HB1  ALA   7           HB1      ALA   7  -9.621  -4.716   1.337
   52    HB2  ALA   7           HB2      ALA   7 -10.180  -3.225   0.573
   53    HB3  ALA   7           HB3      ALA   7  -9.782  -4.633  -0.418
   54    H    ILE   8           HN       ILE   8 -11.304  -6.478   2.526
   55    HA   ILE   8           HA       ILE   8 -10.950  -8.948   1.218
   56    HB   ILE   8           HB       ILE   8 -12.209  -8.486   3.976
   57   HG12  ILE   8          HG12      ILE   8  -9.273  -9.040   3.330
   58   HG13  ILE   8          HG11      ILE   8  -9.925  -7.448   3.690
   59   HG21  ILE   8          HG21      ILE   8 -11.477 -10.786   4.525
   60   HG22  ILE   8          HG22      ILE   8 -10.903 -11.008   2.870
   61   HG23  ILE   8          HG23      ILE   8 -12.624 -10.777   3.189
   62   HD11  ILE   8          HD11      ILE   8  -9.870  -9.798   5.576
   63   HD12  ILE   8          HD12      ILE   8 -10.522  -8.198   5.938
   64   HD13  ILE   8          HD13      ILE   8  -8.803  -8.395   5.605
   65    H    ASN   9           HN       ASN   9 -13.886  -7.423   2.522
   66    HA   ASN   9           HA       ASN   9 -15.699  -9.528   1.890
   67    HB2  ASN   9           HB2      ASN   9 -16.218  -6.577   2.448
   68    HB3  ASN   9           HB1      ASN   9 -17.490  -7.781   2.303
   69   HD21  ASN   9          HD21      ASN   9 -15.044  -6.465   4.324
   70   HD22  ASN   9          HD22      ASN   9 -15.375  -7.402   5.732
   71    H    LYS  10           HN       LYS  10 -14.551  -6.718   0.089
   72    HA   LYS  10           HA       LYS  10 -16.603  -6.742  -1.912
   73    HB2  LYS  10           HB2      LYS  10 -14.930  -4.811  -1.221
   74    HB3  LYS  10           HB1      LYS  10 -13.838  -5.530  -2.394
   75    HG2  LYS  10           HG2      LYS  10 -16.561  -5.063  -3.491
   76    HG3  LYS  10           HG1      LYS  10 -15.807  -3.594  -2.893
   77    HD2  LYS  10           HD2      LYS  10 -15.198  -3.633  -5.147
   78    HD3  LYS  10           HD1      LYS  10 -13.762  -4.250  -4.335
   79    HE2  LYS  10           HE2      LYS  10 -14.401  -6.546  -4.945
   80    HE3  LYS  10           HE1      LYS  10 -15.872  -5.944  -5.714
   81    HZ1  LYS  10           HZ1      LYS  10 -13.117  -5.192  -6.556
   82    HZ2  LYS  10           HZ2      LYS  10 -14.561  -4.795  -7.340
   83    HZ3  LYS  10           HZ3      LYS  10 -14.045  -6.403  -7.287
   84    H    LEU  11           HN       LEU  11 -13.263  -7.991  -1.779
   85    HA   LEU  11           HA       LEU  11 -13.384  -9.109  -4.444
   86    HB2  LEU  11           HB2      LEU  11 -11.294  -9.695  -2.313
   87    HB3  LEU  11           HB1      LEU  11 -11.164 -10.004  -4.034
   88    HG   LEU  11           HG       LEU  11 -10.877  -7.396  -2.541
   89   HD11  LEU  11          HD11      LEU  11  -9.264  -8.653  -4.784
   90   HD12  LEU  11          HD12      LEU  11  -8.850  -8.643  -3.071
   91   HD13  LEU  11          HD13      LEU  11  -8.886  -7.130  -3.969
   92   HD21  LEU  11          HD21      LEU  11 -11.041  -6.092  -4.610
   93   HD22  LEU  11          HD22      LEU  11 -12.576  -6.839  -4.187
   94   HD23  LEU  11          HD23      LEU  11 -11.594  -7.527  -5.481
   95    H    GLY  12           HN       GLY  12 -14.102 -10.195  -1.226
   96    HA2  GLY  12           HA2      GLY  12 -15.626 -12.021  -0.907
   97    HA3  GLY  12           HA1      GLY  12 -14.887 -12.860  -2.266
   98    H    SER  13           HN       SER  13 -12.125 -12.040  -1.220
   99    HA   SER  13           HA       SER  13 -11.832 -13.556   1.245
  100    HB2  SER  13           HB2      SER  13 -10.366 -15.297   0.276
  101    HB3  SER  13           HB1      SER  13 -11.967 -15.363  -0.453
  102    HG   SER  13           HG       SER  13 -11.155 -14.285  -2.258
  103    H    VAL  14           HN       VAL  14  -9.650 -13.656   2.014
  104    HA   VAL  14           HA       VAL  14  -8.016 -11.342   1.458
  105    HB   VAL  14           HB       VAL  14  -7.702 -13.708   3.363
  106   HG11  VAL  14          HG11      VAL  14  -5.429 -13.029   2.718
  107   HG12  VAL  14          HG12      VAL  14  -5.761 -12.555   4.380
  108   HG13  VAL  14          HG13      VAL  14  -5.799 -11.344   3.095
  109   HG21  VAL  14          HG21      VAL  14  -8.053 -11.987   5.103
  110   HG22  VAL  14          HG22      VAL  14  -9.408 -12.067   3.978
  111   HG23  VAL  14          HG23      VAL  14  -8.228 -10.753   3.845
  112    H    SER  15           HN       SER  15  -8.013 -14.773   0.644
  113    HA   SER  15           HA       SER  15  -5.380 -15.048  -0.258
  114    HB2  SER  15           HB2      SER  15  -6.263 -16.975  -1.606
  115    HB3  SER  15           HB1      SER  15  -6.781 -16.999   0.082
  116    HG   SER  15           HG       SER  15  -8.297 -16.149  -2.169
  117    H    ALA  16           HN       ALA  16  -8.280 -13.847  -1.853
  118    HA   ALA  16           HA       ALA  16  -7.080 -13.275  -4.407
  119    HB1  ALA  16           HB1      ALA  16  -9.642 -12.227  -3.149
  120    HB2  ALA  16           HB2      ALA  16  -9.496 -13.662  -4.166
  121    HB3  ALA  16           HB3      ALA  16  -9.189 -12.064  -4.847
  122    H    LEU  17           HN       LEU  17  -7.728 -11.432  -1.433
  123    HA   LEU  17           HA       LEU  17  -7.194  -8.846  -2.462
  124    HB2  LEU  17           HB2      LEU  17  -8.508  -9.265  -0.379
  125    HB3  LEU  17           HB1      LEU  17  -7.037  -9.798   0.425
  126    HG   LEU  17           HG       LEU  17  -6.074  -7.551   0.214
  127   HD11  LEU  17          HD11      LEU  17  -7.397  -5.625  -0.553
  128   HD12  LEU  17          HD12      LEU  17  -8.703  -6.707  -1.047
  129   HD13  LEU  17          HD13      LEU  17  -7.132  -6.786  -1.850
  130   HD21  LEU  17          HD21      LEU  17  -8.810  -7.450   1.496
  131   HD22  LEU  17          HD22      LEU  17  -7.448  -6.372   1.829
  132   HD23  LEU  17          HD23      LEU  17  -7.333  -8.085   2.230
  133    H    ALA  18           HN       ALA  18  -5.198 -10.816  -0.283
  134    HA   ALA  18           HA       ALA  18  -2.822  -9.414  -0.341
  135    HB1  ALA  18           HB1      ALA  18  -3.368 -11.214   1.250
  136    HB2  ALA  18           HB2      ALA  18  -1.791 -11.465   0.501
  137    HB3  ALA  18           HB3      ALA  18  -3.187 -12.409  -0.035
  138    H    ALA  19           HN       ALA  19  -3.981 -11.933  -2.590
  139    HA   ALA  19           HA       ALA  19  -1.650 -12.227  -4.154
  140    HB1  ALA  19           HB1      ALA  19  -3.129 -13.114  -5.899
  141    HB2  ALA  19           HB2      ALA  19  -4.538 -12.453  -5.063
  142    HB3  ALA  19           HB3      ALA  19  -3.590 -13.736  -4.313
  143    H    ALA  20           HN       ALA  20  -4.262  -9.830  -4.317
  144    HA   ALA  20           HA       ALA  20  -3.276  -8.473  -6.687
  145    HB1  ALA  20           HB1      ALA  20  -5.389  -7.613  -4.675
  146    HB2  ALA  20           HB2      ALA  20  -5.682  -8.509  -6.165
  147    HB3  ALA  20           HB3      ALA  20  -5.084  -6.851  -6.236
  148    H    LEU  21           HN       LEU  21  -2.848  -8.192  -3.230
  149    HA   LEU  21           HA       LEU  21  -1.637  -5.517  -3.365
  150    HB2  LEU  21           HB2      LEU  21  -2.325  -7.303  -1.003
  151    HB3  LEU  21           HB1      LEU  21  -1.620  -5.697  -0.860
  152    HG   LEU  21           HG       LEU  21  -4.365  -6.343  -2.007
  153   HD11  LEU  21          HD11      LEU  21  -3.579  -5.005   0.588
  154   HD12  LEU  21          HD12      LEU  21  -4.374  -6.568   0.375
  155   HD13  LEU  21          HD13      LEU  21  -5.226  -5.089  -0.057
  156   HD21  LEU  21          HD21      LEU  21  -4.709  -3.911  -2.126
  157   HD22  LEU  21          HD22      LEU  21  -3.423  -4.459  -3.194
  158   HD23  LEU  21          HD23      LEU  21  -3.018  -3.653  -1.678
  159    H    GLY  22           HN       GLY  22  -0.596  -8.661  -3.663
  160    HA2  GLY  22           HA2      GLY  22   1.508  -9.502  -4.057
  161    HA3  GLY  22           HA1      GLY  22   2.139  -7.873  -3.884
  162    H    VAL  23           HN       VAL  23   0.309  -9.500  -1.385
  163    HA   VAL  23           HA       VAL  23   2.730  -9.937   0.255
  164    HB   VAL  23           HB       VAL  23   1.377  -9.276   2.281
  165   HG11  VAL  23          HG11      VAL  23   2.975  -7.687   1.326
  166   HG12  VAL  23          HG12      VAL  23   1.574  -6.845   1.991
  167   HG13  VAL  23          HG13      VAL  23   1.729  -7.052   0.244
  168   HG21  VAL  23          HG21      VAL  23  -0.651  -8.225   0.258
  169   HG22  VAL  23          HG22      VAL  23  -0.694  -7.925   1.998
  170   HG23  VAL  23          HG23      VAL  23  -0.901  -9.565   1.383
  171    H    ASN  24           HN       ASN  24   2.037 -11.263   2.276
  172    HA   ASN  24           HA       ASN  24   0.565 -13.634   1.442
  173    HB2  ASN  24           HB2      ASN  24   1.357 -14.641   3.552
  174    HB3  ASN  24           HB1      ASN  24   2.698 -13.976   2.634
  175   HD21  ASN  24          HD21      ASN  24   2.286 -14.539   5.577
  176   HD22  ASN  24          HD22      ASN  24   2.729 -13.060   6.357
  177    H    GLN  25           HN       GLN  25  -0.810 -14.597   3.307
  178    HA   GLN  25           HA       GLN  25  -3.136 -12.895   3.330
  179    HB2  GLN  25           HB2      GLN  25  -3.031 -15.577   4.762
  180    HB3  GLN  25           HB1      GLN  25  -4.369 -14.838   3.882
  181    HG2  GLN  25           HG2      GLN  25  -1.896 -16.149   2.722
  182    HG3  GLN  25           HG1      GLN  25  -3.566 -16.698   2.592
  183   HE21  GLN  25          HE21      GLN  25  -1.456 -15.942   0.546
  184   HE22  GLN  25          HE22      GLN  25  -2.214 -14.773  -0.471
  185    H    SER  26           HN       SER  26  -0.764 -13.912   5.623
  186    HA   SER  26           HA       SER  26  -1.957 -13.122   8.058
  187    HB2  SER  26           HB2      SER  26   0.041 -14.616   7.900
  188    HB3  SER  26           HB1      SER  26   1.019 -13.254   7.354
  189    HG   SER  26           HG       SER  26  -0.049 -13.809   9.883
  190    H    ALA  27           HN       ALA  27   0.117 -11.397   5.712
  191    HA   ALA  27           HA       ALA  27   0.635  -9.057   7.185
  192    HB1  ALA  27           HB1      ALA  27   1.898  -9.632   5.165
  193    HB2  ALA  27           HB2      ALA  27   1.243  -7.999   5.053
  194    HB3  ALA  27           HB3      ALA  27   0.471  -9.320   4.171
  195    H    ILE  28           HN       ILE  28  -2.061  -9.888   5.077
  196    HA   ILE  28           HA       ILE  28  -3.411  -7.397   4.994
  197    HB   ILE  28           HB       ILE  28  -4.584 -10.224   4.945
  198   HG12  ILE  28          HG12      ILE  28  -2.898  -9.844   3.175
  199   HG13  ILE  28          HG11      ILE  28  -4.510 -10.041   2.502
  200   HG21  ILE  28          HG21      ILE  28  -6.521  -9.239   3.776
  201   HG22  ILE  28          HG22      ILE  28  -5.848  -7.623   4.005
  202   HG23  ILE  28          HG23      ILE  28  -6.348  -8.582   5.403
  203   HD11  ILE  28          HD11      ILE  28  -4.673  -7.612   2.203
  204   HD12  ILE  28          HD12      ILE  28  -3.294  -8.305   1.353
  205   HD13  ILE  28          HD13      ILE  28  -3.044  -7.433   2.862
  206    H    SER  29           HN       SER  29  -3.738 -10.191   7.163
  207    HA   SER  29           HA       SER  29  -5.658  -9.141   8.933
  208    HB2  SER  29           HB2      SER  29  -3.470 -11.194   9.464
  209    HB3  SER  29           HB1      SER  29  -4.924 -10.957  10.441
  210    HG   SER  29           HG       SER  29  -4.710 -12.538   8.400
  211    H    GLN  30           HN       GLN  30  -2.141  -8.802   8.845
  212    HA   GLN  30           HA       GLN  30  -1.791  -7.620  11.422
  213    HB2  GLN  30           HB2      GLN  30   0.042  -7.353   8.988
  214    HB3  GLN  30           HB1      GLN  30   0.477  -7.000  10.660
  215    HG2  GLN  30           HG2      GLN  30  -0.136  -9.709   9.460
  216    HG3  GLN  30           HG1      GLN  30   1.429  -9.128  10.001
  217   HE21  GLN  30          HE21      GLN  30  -0.213 -11.506  10.769
  218   HE22  GLN  30          HE22      GLN  30  -0.335 -11.428  12.494
  219    H    TRP  31           HN       TRP  31  -2.248  -6.343   8.150
  220    HA   TRP  31           HA       TRP  31  -2.054  -3.570   8.749
  221    HB2  TRP  31           HB2      TRP  31  -3.472  -5.017   6.468
  222    HB3  TRP  31           HB1      TRP  31  -3.289  -3.267   6.555
  223    HD1  TRP  31           HD1      TRP  31  -0.073  -3.934   7.688
  224    HE1  TRP  31           HE1      TRP  31   1.645  -4.261   5.808
  225    HE3  TRP  31           HE3      TRP  31  -3.256  -4.854   3.797
  226    HZ2  TRP  31           HZ2      TRP  31   1.665  -4.811   3.071
  227    HZ3  TRP  31           HZ3      TRP  31  -2.298  -5.257   1.576
  228    HH2  TRP  31           HH2      TRP  31   0.109  -5.236   1.219
  229    H    ARG  32           HN       ARG  32  -4.643  -5.893   8.860
  230    HA   ARG  32           HA       ARG  32  -6.798  -4.002   9.124
  231    HB2  ARG  32           HB2      ARG  32  -7.099  -6.201   8.021
  232    HB3  ARG  32           HB1      ARG  32  -6.729  -7.027   9.533
  233    HG2  ARG  32           HG2      ARG  32  -8.742  -6.132  10.561
  234    HG3  ARG  32           HG1      ARG  32  -9.093  -5.160   9.129
  235    HD2  ARG  32           HD2      ARG  32 -10.493  -7.177   9.216
  236    HD3  ARG  32           HD1      ARG  32  -9.434  -7.197   7.808
  237    HE   ARG  32           HE       ARG  32  -8.124  -8.618   9.808
  238   HH11  ARG  32          HH11      ARG  32 -11.172 -10.649   8.107
  239   HH12  ARG  32          HH12      ARG  32 -11.142  -8.916   8.012
  240   HH21  ARG  32          HH21      ARG  32  -8.142 -10.905   9.869
  241   HH22  ARG  32          HH22      ARG  32  -9.461 -11.779   9.163
  242    H    ALA  33           HN       ALA  33  -4.691  -5.767  11.303
  243    HA   ALA  33           HA       ALA  33  -6.192  -5.005  13.676
  244    HB1  ALA  33           HB1      ALA  33  -4.960  -7.133  13.664
  245    HB2  ALA  33           HB2      ALA  33  -4.336  -6.072  14.924
  246    HB3  ALA  33           HB3      ALA  33  -3.433  -6.281  13.420
  247    H    ARG  34           HN       ARG  34  -3.579  -3.835  11.750
  248    HA   ARG  34           HA       ARG  34  -2.430  -1.956  13.592
  249    HB2  ARG  34           HB2      ARG  34  -1.216  -3.071  11.709
  250    HB3  ARG  34           HB1      ARG  34  -2.269  -2.265  10.554
  251    HG2  ARG  34           HG2      ARG  34  -0.228  -1.117  10.536
  252    HG3  ARG  34           HG1      ARG  34  -1.360  -0.076  11.388
  253    HD2  ARG  34           HD2      ARG  34  -0.420  -0.706  13.529
  254    HD3  ARG  34           HD1      ARG  34   0.635  -1.906  12.772
  255    HE   ARG  34           HE       ARG  34   0.952   0.997  12.783
  256   HH11  ARG  34          HH11      ARG  34   3.668  -1.410  11.044
  257   HH12  ARG  34          HH12      ARG  34   2.141  -2.075  11.519
  258   HH21  ARG  34          HH21      ARG  34   4.128   0.804  11.415
  259   HH22  ARG  34          HH22      ARG  34   2.951   1.827  12.174
  260    H    GLY  35           HN       GLY  35  -4.886  -1.955  11.102
  261    HA2  GLY  35           HA2      GLY  35  -6.530  -0.448  10.498
  262    HA3  GLY  35           HA1      GLY  35  -5.952   0.662  11.735
  263    H    ARG  36           HN       ARG  36  -3.373  -0.337   9.899
  264    HA   ARG  36           HA       ARG  36  -3.408   1.941   8.035
  265    HB2  ARG  36           HB2      ARG  36  -1.167   1.332  10.033
  266    HB3  ARG  36           HB1      ARG  36  -1.081   2.551   8.770
  267    HG2  ARG  36           HG2      ARG  36  -3.041   2.604  11.083
  268    HG3  ARG  36           HG1      ARG  36  -1.501   3.462  11.063
  269    HD2  ARG  36           HD2      ARG  36  -2.242   4.826   9.180
  270    HD3  ARG  36           HD1      ARG  36  -3.746   3.902   9.065
  271    HE   ARG  36           HE       ARG  36  -3.947   4.775  11.558
  272   HH11  ARG  36          HH11      ARG  36  -2.952   6.571   8.715
  273   HH12  ARG  36          HH12      ARG  36  -3.578   8.072   9.301
  274   HH21  ARG  36          HH21      ARG  36  -4.665   8.176  11.320
  275   HH22  ARG  36          HH22      ARG  36  -4.858   6.740  12.271
  276    H    VAL  37           HN       VAL  37  -2.343   1.481   6.142
  277    HA   VAL  37           HA       VAL  37  -0.818  -1.062   5.912
  278    HB   VAL  37           HB       VAL  37  -1.303  -1.021   3.499
  279   HG11  VAL  37          HG11      VAL  37  -3.744  -1.438   3.572
  280   HG12  VAL  37          HG12      VAL  37  -3.813  -0.704   5.177
  281   HG13  VAL  37          HG13      VAL  37  -2.891  -2.185   4.919
  282   HG21  VAL  37          HG21      VAL  37  -1.402   1.402   3.115
  283   HG22  VAL  37          HG22      VAL  37  -2.906   1.515   4.027
  284   HG23  VAL  37          HG23      VAL  37  -2.861   0.630   2.498
  285    HA   PRO  38           HA       PRO  38   2.903   1.366   4.744
  286    HB2  PRO  38           HB2      PRO  38   3.218  -0.787   2.626
  287    HB3  PRO  38           HB1      PRO  38   4.389  -0.191   3.825
  288    HG2  PRO  38           HG2      PRO  38   3.240  -2.526   4.198
  289    HG3  PRO  38           HG1      PRO  38   3.437  -1.410   5.573
  290    HD2  PRO  38           HD2      PRO  38   0.966  -1.957   3.930
  291    HD3  PRO  38           HD1      PRO  38   1.141  -1.809   5.694
  292    H    ALA  39           HN       ALA  39   3.820   2.454   2.881
  293    HA   ALA  39           HA       ALA  39   2.063   4.010   1.431
  294    HB1  ALA  39           HB1      ALA  39   4.393   4.613   1.866
  295    HB2  ALA  39           HB2      ALA  39   4.037   4.735   0.143
  296    HB3  ALA  39           HB3      ALA  39   4.949   3.354   0.756
  297    H    GLY  40           HN       GLY  40   1.445   4.113  -0.774
  298    HA2  GLY  40           HA2      GLY  40   0.772   3.447  -2.844
  299    HA3  GLY  40           HA1      GLY  40   2.245   2.489  -2.899
  300    H    ARG  41           HN       ARG  41  -0.478   2.011  -0.606
  301    HA   ARG  41           HA       ARG  41  -1.156  -0.506  -2.010
  302    HB2  ARG  41           HB2      ARG  41   0.505  -0.815  -0.022
  303    HB3  ARG  41           HB1      ARG  41  -0.877  -0.500   1.015
  304    HG2  ARG  41           HG2      ARG  41  -0.763  -2.846   0.892
  305    HG3  ARG  41           HG1      ARG  41  -2.046  -2.435  -0.247
  306    HD2  ARG  41           HD2      ARG  41   0.841  -3.059  -0.978
  307    HD3  ARG  41           HD1      ARG  41  -0.514  -4.176  -1.118
  308    HE   ARG  41           HE       ARG  41  -1.237  -1.998  -2.680
  309   HH11  ARG  41          HH11      ARG  41   1.472  -4.283  -2.658
  310   HH12  ARG  41          HH12      ARG  41   1.754  -4.161  -4.364
  311   HH21  ARG  41          HH21      ARG  41   0.467  -2.781  -5.651
  312   HH22  ARG  41          HH22      ARG  41  -0.811  -1.843  -4.944
  313    H    CYS  42           HN       CYS  42  -2.158   1.952   0.329
  314    HA   CYS  42           HA       CYS  42  -4.874   1.081   0.516
  315    HB2  CYS  42           HB2      CYS  42  -3.364   3.373   1.496
  316    HB3  CYS  42           HB1      CYS  42  -4.931   3.890   0.888
  317    H    ILE  43           HN       ILE  43  -3.110   2.682  -1.982
  318    HA   ILE  43           HA       ILE  43  -5.096   3.881  -3.546
  319    HB   ILE  43           HB       ILE  43  -2.692   2.233  -4.500
  320   HG12  ILE  43          HG12      ILE  43  -2.910   5.245  -4.000
  321   HG13  ILE  43          HG11      ILE  43  -2.057   4.102  -2.971
  322   HG21  ILE  43          HG21      ILE  43  -4.304   4.317  -6.030
  323   HG22  ILE  43          HG22      ILE  43  -4.307   2.578  -6.325
  324   HG23  ILE  43          HG23      ILE  43  -2.843   3.513  -6.615
  325   HD11  ILE  43          HD11      ILE  43  -0.475   3.654  -4.781
  326   HD12  ILE  43          HD12      ILE  43  -0.523   5.361  -4.345
  327   HD13  ILE  43          HD13      ILE  43  -1.329   4.807  -5.811
  328    H    ASP  44           HN       ASP  44  -3.975   0.481  -3.474
  329    HA   ASP  44           HA       ASP  44  -5.829  -0.498  -5.425
  330    HB2  ASP  44           HB2      ASP  44  -4.443  -2.178  -3.296
  331    HB3  ASP  44           HB1      ASP  44  -4.986  -2.689  -4.891
  332    H    ILE  45           HN       ILE  45  -5.674  -0.670  -1.885
  333    HA   ILE  45           HA       ILE  45  -8.021  -2.144  -1.422
  334    HB   ILE  45           HB       ILE  45  -6.521  -0.194   0.387
  335   HG12  ILE  45          HG12      ILE  45  -6.528  -3.250   0.213
  336   HG13  ILE  45          HG11      ILE  45  -5.201  -2.175  -0.220
  337   HG21  ILE  45          HG21      ILE  45  -8.704  -2.135   1.222
  338   HG22  ILE  45          HG22      ILE  45  -8.849  -0.377   1.186
  339   HG23  ILE  45          HG23      ILE  45  -7.725  -1.141   2.307
  340   HD11  ILE  45          HD11      ILE  45  -5.014  -1.522   2.169
  341   HD12  ILE  45          HD12      ILE  45  -4.738  -3.237   1.883
  342   HD13  ILE  45          HD13      ILE  45  -6.276  -2.699   2.567
  343    H    GLU  46           HN       GLU  46  -7.555   1.285  -2.081
  344    HA   GLU  46           HA       GLU  46 -10.197   2.098  -1.232
  345    HB2  GLU  46           HB2      GLU  46  -8.132   3.579  -1.161
  346    HB3  GLU  46           HB1      GLU  46  -8.249   3.723  -2.909
  347    HG2  GLU  46           HG2      GLU  46 -10.294   4.909  -2.777
  348    HG3  GLU  46           HG1      GLU  46 -10.532   4.485  -1.081
  349    H    LEU  47           HN       LEU  47  -8.783   0.934  -4.217
  350    HA   LEU  47           HA       LEU  47 -10.909   1.477  -6.011
  351    HB2  LEU  47           HB2      LEU  47  -9.126  -0.982  -5.755
  352    HB3  LEU  47           HB1      LEU  47 -10.244  -0.757  -7.083
  353    HG   LEU  47           HG       LEU  47  -7.989   1.213  -6.535
  354   HD11  LEU  47          HD11      LEU  47  -7.891  -1.191  -8.409
  355   HD12  LEU  47          HD12      LEU  47  -6.978  -1.015  -6.908
  356   HD13  LEU  47          HD13      LEU  47  -6.660   0.069  -8.258
  357   HD21  LEU  47          HD21      LEU  47  -9.650   0.622  -9.004
  358   HD22  LEU  47          HD22      LEU  47  -8.377   1.844  -8.877
  359   HD23  LEU  47          HD23      LEU  47  -9.852   2.011  -7.930
  360    H    TYR  48           HN       TYR  48 -10.404  -1.026  -3.568
  361    HA   TYR  48           HA       TYR  48 -12.932  -2.373  -4.163
  362    HB2  TYR  48           HB2      TYR  48 -11.125  -3.161  -1.859
  363    HB3  TYR  48           HB1      TYR  48 -12.154  -4.182  -2.870
  364    HD1  TYR  48           HD1      TYR  48  -9.001  -4.227  -2.069
  365    HD2  TYR  48           HD2      TYR  48 -11.170  -3.281  -5.624
  366    HE1  TYR  48           HE1      TYR  48  -7.020  -4.760  -3.431
  367    HE2  TYR  48           HE2      TYR  48  -9.194  -3.787  -6.982
  368    HH   TYR  48           HH       TYR  48  -6.414  -5.345  -5.674
  369    H    THR  49           HN       THR  49 -11.873   0.108  -2.080
  370    HA   THR  49           HA       THR  49 -14.443   0.011  -0.576
  371    HB   THR  49           HB       THR  49 -13.374   1.314   1.224
  372    HG1  THR  49           HG1      THR  49 -10.802   1.010   0.173
  373   HG21  THR  49          HG21      THR  49 -11.608  -1.058   0.496
  374   HG22  THR  49          HG22      THR  49 -13.157  -1.162   1.335
  375   HG23  THR  49          HG23      THR  49 -11.800  -0.344   2.102
  376    H    ASP  50           HN       ASP  50 -14.593   0.810  -3.021
  377    HA   ASP  50           HA       ASP  50 -13.704   3.057  -4.175
  378    HB2  ASP  50           HB2      ASP  50 -14.983   1.520  -5.453
  379    HB3  ASP  50           HB1      ASP  50 -16.386   1.680  -4.405
  380    H    GLY  51           HN       GLY  51 -16.574   3.042  -2.067
  381    HA2  GLY  51           HA2      GLY  51 -16.176   5.899  -1.486
  382    HA3  GLY  51           HA1      GLY  51 -17.734   5.429  -2.162
  383    H    ARG  52           HN       ARG  52 -15.816   3.478   0.005
  384    HA   ARG  52           HA       ARG  52 -18.060   3.285   1.889
  385    HB2  ARG  52           HB2      ARG  52 -15.428   1.738   1.724
  386    HB3  ARG  52           HB1      ARG  52 -16.765   1.360   2.809
  387    HG2  ARG  52           HG2      ARG  52 -16.815   1.216  -0.221
  388    HG3  ARG  52           HG1      ARG  52 -16.728  -0.154   0.887
  389    HD2  ARG  52           HD2      ARG  52 -18.962   0.633   1.831
  390    HD3  ARG  52           HD1      ARG  52 -19.040   1.754   0.469
  391    HE   ARG  52           HE       ARG  52 -18.759  -0.387  -0.930
  392   HH11  ARG  52          HH11      ARG  52 -21.630  -1.482   1.672
  393   HH12  ARG  52          HH12      ARG  52 -20.550  -0.194   2.089
  394   HH21  ARG  52          HH21      ARG  52 -21.413  -2.560  -0.348
  395   HH22  ARG  52          HH22      ARG  52 -20.168  -2.088  -1.461
  396    H    VAL  53           HN       VAL  53 -14.559   3.808   1.939
  397    HA   VAL  53           HA       VAL  53 -14.671   5.703   4.114
  398    HB   VAL  53           HB       VAL  53 -14.712   3.583   5.381
  399   HG11  VAL  53          HG11      VAL  53 -12.913   1.912   5.241
  400   HG12  VAL  53          HG12      VAL  53 -12.158   2.816   3.925
  401   HG13  VAL  53          HG13      VAL  53 -13.749   2.085   3.698
  402   HG21  VAL  53          HG21      VAL  53 -13.438   5.441   6.379
  403   HG22  VAL  53          HG22      VAL  53 -11.966   4.893   5.573
  404   HG23  VAL  53          HG23      VAL  53 -12.720   3.892   6.816
  405    H    GLU  54           HN       GLU  54 -12.774   6.946   4.237
  406    HA   GLU  54           HA       GLU  54 -10.906   7.032   2.117
  407    HB2  GLU  54           HB2      GLU  54 -11.344   8.997   3.511
  408    HB3  GLU  54           HB1      GLU  54 -10.792   8.153   4.956
  409    HG2  GLU  54           HG2      GLU  54  -8.500   7.990   3.807
  410    HG3  GLU  54           HG1      GLU  54  -9.129   9.122   2.615
  411    H    CYS  55           HN       CYS  55  -9.557   5.335   1.698
  412    HA   CYS  55           HA       CYS  55  -8.260   3.827   3.820
  413    HB2  CYS  55           HB2      CYS  55  -8.927   2.940   1.463
  414    HB3  CYS  55           HB1      CYS  55  -7.465   3.741   0.888
  415    H    ARG  56           HN       ARG  56  -6.227   4.244   4.626
  416    HA   ARG  56           HA       ARG  56  -4.658   6.451   3.456
  417    HB2  ARG  56           HB2      ARG  56  -4.139   7.313   5.750
  418    HB3  ARG  56           HB1      ARG  56  -5.812   7.525   5.273
  419    HG2  ARG  56           HG2      ARG  56  -4.918   5.251   7.068
  420    HG3  ARG  56           HG1      ARG  56  -5.371   6.834   7.698
  421    HD2  ARG  56           HD2      ARG  56  -7.619   6.580   6.684
  422    HD3  ARG  56           HD1      ARG  56  -7.158   4.987   6.076
  423    HE   ARG  56           HE       ARG  56  -6.758   5.017   8.854
  424   HH11  ARG  56          HH11      ARG  56  -9.442   5.153   6.593
  425   HH12  ARG  56          HH12      ARG  56 -10.561   4.415   7.686
  426   HH21  ARG  56          HH21      ARG  56  -8.255   4.075  10.300
  427   HH22  ARG  56          HH22      ARG  56  -9.885   3.807   9.793
  428    H    GLU  57           HN       GLU  57  -2.640   5.988   3.172
  429    HA   GLU  57           HA       GLU  57  -1.468   3.518   4.324
  430    HB2  GLU  57           HB2      GLU  57   0.086   3.702   2.295
  431    HB3  GLU  57           HB1      GLU  57  -1.601   3.351   1.945
  432    HG2  GLU  57           HG2      GLU  57  -1.927   5.813   1.471
  433    HG3  GLU  57           HG1      GLU  57  -0.179   5.998   1.629
  434    H    LEU  58           HN       LEU  58   0.899   3.577   4.671
  435    HA   LEU  58           HA       LEU  58   1.630   6.039   6.090
  436    HB2  LEU  58           HB2      LEU  58   2.876   3.260   6.271
  437    HB3  LEU  58           HB1      LEU  58   3.301   4.643   7.271
  438    HG   LEU  58           HG       LEU  58   0.637   3.174   7.292
  439   HD11  LEU  58          HD11      LEU  58   1.307   2.388   9.519
  440   HD12  LEU  58          HD12      LEU  58   2.861   3.210   9.358
  441   HD13  LEU  58          HD13      LEU  58   2.455   1.868   8.285
  442   HD21  LEU  58          HD21      LEU  58   0.285   5.542   7.773
  443   HD22  LEU  58          HD22      LEU  58   1.536   5.503   9.017
  444   HD23  LEU  58          HD23      LEU  58   0.049   4.576   9.227
  445    H    ARG  59           HN       ARG  59   2.824   7.380   4.969
  446    HA   ARG  59           HA       ARG  59   3.862   7.123   2.481
  447    HB2  ARG  59           HB2      ARG  59   4.987   9.219   2.803
  448    HB3  ARG  59           HB1      ARG  59   3.507   9.274   3.765
  449    HG2  ARG  59           HG2      ARG  59   6.321   8.810   4.826
  450    HG3  ARG  59           HG1      ARG  59   5.397  10.302   4.969
  451    HD2  ARG  59           HD2      ARG  59   3.825   9.243   6.480
  452    HD3  ARG  59           HD1      ARG  59   4.542   7.658   6.194
  453    HE   ARG  59           HE       ARG  59   5.975   9.866   7.560
  454   HH11  ARG  59          HH11      ARG  59   6.123   6.008   8.704
  455   HH12  ARG  59          HH12      ARG  59   5.162   6.450   7.339
  456   HH21  ARG  59          HH21      ARG  59   7.275   7.611   9.873
  457   HH22  ARG  59          HH22      ARG  59   7.182   9.276   9.391
  458    HA   PRO  60           HA       PRO  60   7.552   4.739   2.413
  459    HB2  PRO  60           HB2      PRO  60   9.186   6.026   0.611
  460    HB3  PRO  60           HB1      PRO  60   7.672   5.231   0.133
  461    HG2  PRO  60           HG2      PRO  60   8.153   8.146   0.709
  462    HG3  PRO  60           HG1      PRO  60   7.319   7.396  -0.676
  463    HD2  PRO  60           HD2      PRO  60   5.915   8.398   1.400
  464    HD3  PRO  60           HD1      PRO  60   5.400   6.909   0.562
  465    H    ASP  61           HN       ASP  61   7.674   7.668   3.984
  466    HA   ASP  61           HA       ASP  61  10.492   7.775   4.601
  467    HB2  ASP  61           HB2      ASP  61   8.117   9.331   5.722
  468    HB3  ASP  61           HB1      ASP  61   9.809   9.661   6.095
  469    H    VAL  62           HN       VAL  62  10.059   5.361   5.230
  470    HA   VAL  62           HA       VAL  62   9.794   5.177   8.173
  471    HB   VAL  62           HB       VAL  62   9.462   2.723   7.834
  472   HG11  VAL  62          HG11      VAL  62   7.150   2.831   6.967
  473   HG12  VAL  62          HG12      VAL  62   7.464   4.435   6.300
  474   HG13  VAL  62          HG13      VAL  62   7.493   4.184   8.047
  475   HG21  VAL  62          HG21      VAL  62   9.425   3.376   4.852
  476   HG22  VAL  62          HG22      VAL  62   9.001   1.816   5.562
  477   HG23  VAL  62          HG23      VAL  62  10.649   2.422   5.695
  478    H    PHE  63           HN       PHE  63  12.062   5.832   6.068
  479    HA   PHE  63           HA       PHE  63  14.147   3.933   6.965
  480    HB2  PHE  63           HB2      PHE  63  14.046   5.690   4.469
  481    HB3  PHE  63           HB1      PHE  63  15.347   4.579   4.882
  482    HD1  PHE  63           HD1      PHE  63  12.342   4.927   3.036
  483    HD2  PHE  63           HD2      PHE  63  14.623   2.056   5.228
  484    HE1  PHE  63           HE1      PHE  63  11.199   3.105   1.848
  485    HE2  PHE  63           HE2      PHE  63  13.478   0.240   4.033
  486    HZ   PHE  63           HZ       PHE  63  11.762   0.759   2.342
  487    H    GLY  64           HN       GLY  64  16.418   5.358   6.315
  488    HA2  GLY  64           HA2      GLY  64  16.499   8.038   7.310
  489    HA3  GLY  64           HA1      GLY  64  17.014   6.883   8.540
  490    H    ALA  65           HN       ALA  65  19.086   6.157   8.481
  491    HA   ALA  65           HA       ALA  65  20.815   6.917   6.200
  492    HB1  ALA  65           HB1      ALA  65  22.705   6.657   7.778
  493    HB2  ALA  65           HB2      ALA  65  21.586   6.153   9.047
  494    HB3  ALA  65           HB3      ALA  65  21.503   7.790   8.401
  Start of MODEL    3
    1    H1   MET   1           HT1      MET   1 -15.126  -2.375  12.093
    2    H2   MET   1           HT2      MET   1 -14.723  -0.741  11.936
    3    H3   MET   1           HT3      MET   1 -13.505  -1.911  12.001
    4    HA   MET   1           HA       MET   1 -14.143  -2.827   9.929
    5    HB2  MET   1           HB2      MET   1 -16.588  -2.410  10.178
    6    HB3  MET   1           HB1      MET   1 -16.321  -0.690   9.941
    7    HG2  MET   1           HG2      MET   1 -15.493  -1.175   7.637
    8    HG3  MET   1           HG1      MET   1 -15.877  -2.876   7.893
    9    HE1  MET   1           HE1      MET   1 -18.384  -3.803   8.157
   10    HE2  MET   1           HE2      MET   1 -19.803  -2.758   8.188
   11    HE3  MET   1           HE3      MET   1 -18.648  -2.708   9.519
   12    H    ASN   2           HN       ASN   2 -12.201  -2.164   9.150
   13    HA   ASN   2           HA       ASN   2 -11.828   0.674   8.381
   14    HB2  ASN   2           HB2      ASN   2  -9.370   0.216   8.404
   15    HB3  ASN   2           HB1      ASN   2 -10.130   0.053   9.979
   16   HD21  ASN   2          HD21      ASN   2  -8.637  -1.267  10.874
   17   HD22  ASN   2          HD22      ASN   2  -8.331  -2.889  10.362
   18    H    ALA   3           HN       ALA   3 -10.400   0.932   6.471
   19    HA   ALA   3           HA       ALA   3 -11.608   0.049   4.160
   20    HB1  ALA   3           HB1      ALA   3 -10.200   2.053   4.304
   21    HB2  ALA   3           HB2      ALA   3  -9.693   1.009   2.971
   22    HB3  ALA   3           HB3      ALA   3  -8.768   1.039   4.476
   23    H    ILE   4           HN       ILE   4  -8.760  -1.317   5.765
   24    HA   ILE   4           HA       ILE   4  -7.927  -3.072   3.722
   25    HB   ILE   4           HB       ILE   4  -7.531  -3.548   6.706
   26   HG12  ILE   4          HG12      ILE   4  -5.178  -2.432   6.185
   27   HG13  ILE   4          HG11      ILE   4  -6.031  -1.669   4.852
   28   HG21  ILE   4          HG21      ILE   4  -5.524  -4.798   6.040
   29   HG22  ILE   4          HG22      ILE   4  -5.884  -4.479   4.343
   30   HG23  ILE   4          HG23      ILE   4  -6.978  -5.482   5.300
   31   HD11  ILE   4          HD11      ILE   4  -5.900  -0.190   6.754
   32   HD12  ILE   4          HD12      ILE   4  -6.663  -1.395   7.788
   33   HD13  ILE   4          HD13      ILE   4  -7.588  -0.645   6.484
   34    H    ASP   5           HN       ASP   5 -10.258  -3.388   6.361
   35    HA   ASP   5           HA       ASP   5 -10.864  -6.152   6.006
   36    HB2  ASP   5           HB2      ASP   5 -11.259  -4.939   8.161
   37    HB3  ASP   5           HB1      ASP   5 -12.557  -4.027   7.395
   38    H    ILE   6           HN       ILE   6 -12.415  -3.117   4.873
   39    HA   ILE   6           HA       ILE   6 -14.688  -4.315   3.689
   40    HB   ILE   6           HB       ILE   6 -13.322  -1.640   3.184
   41   HG12  ILE   6          HG12      ILE   6 -14.555  -1.950   5.334
   42   HG13  ILE   6          HG11      ILE   6 -15.288  -0.706   4.327
   43   HG21  ILE   6          HG21      ILE   6 -15.279  -0.946   1.798
   44   HG22  ILE   6          HG22      ILE   6 -15.869  -2.609   1.813
   45   HG23  ILE   6          HG23      ILE   6 -14.336  -2.226   1.030
   46   HD11  ILE   6          HD11      ILE   6 -16.968  -2.070   5.388
   47   HD12  ILE   6          HD12      ILE   6 -16.301  -3.534   4.674
   48   HD13  ILE   6          HD13      ILE   6 -17.034  -2.299   3.643
   49    H    ALA   7           HN       ALA   7 -11.443  -3.647   2.407
   50    HA   ALA   7           HA       ALA   7 -11.935  -4.352  -0.282
   51    HB1  ALA   7           HB1      ALA   7  -9.326  -4.559   1.244
   52    HB2  ALA   7           HB2      ALA   7  -9.944  -3.106   0.453
   53    HB3  ALA   7           HB3      ALA   7  -9.527  -4.521  -0.519
   54    H    ILE   8           HN       ILE   8 -11.052  -6.325   2.556
   55    HA   ILE   8           HA       ILE   8 -10.759  -8.852   1.387
   56    HB   ILE   8           HB       ILE   8 -12.210  -8.226   4.007
   57   HG12  ILE   8          HG12      ILE   8  -9.257  -8.897   3.625
   58   HG13  ILE   8          HG11      ILE   8  -9.895  -7.291   3.953
   59   HG21  ILE   8          HG21      ILE   8 -11.625 -10.535   4.681
   60   HG22  ILE   8          HG22      ILE   8 -10.960 -10.831   3.074
   61   HG23  ILE   8          HG23      ILE   8 -12.684 -10.504   3.267
   62   HD11  ILE   8          HD11      ILE   8  -8.995  -8.286   5.964
   63   HD12  ILE   8          HD12      ILE   8 -10.071  -9.671   5.799
   64   HD13  ILE   8          HD13      ILE   8 -10.737  -8.067   6.123
   65    H    ASN   9           HN       ASN   9 -13.723  -7.253   2.585
   66    HA   ASN   9           HA       ASN   9 -15.527  -9.334   1.908
   67    HB2  ASN   9           HB2      ASN   9 -16.124  -6.376   2.382
   68    HB3  ASN   9           HB1      ASN   9 -17.329  -7.657   2.338
   69   HD21  ASN   9          HD21      ASN   9 -14.985  -6.050   4.250
   70   HD22  ASN   9          HD22      ASN   9 -15.237  -6.935   5.706
   71    H    LYS  10           HN       LYS  10 -14.302  -6.590   0.127
   72    HA   LYS  10           HA       LYS  10 -16.395  -6.474  -1.823
   73    HB2  LYS  10           HB2      LYS  10 -14.852  -4.562  -1.006
   74    HB3  LYS  10           HB1      LYS  10 -13.628  -5.207  -2.092
   75    HG2  LYS  10           HG2      LYS  10 -16.389  -4.479  -3.103
   76    HG3  LYS  10           HG1      LYS  10 -15.150  -3.242  -2.894
   77    HD2  LYS  10           HD2      LYS  10 -13.681  -4.411  -4.485
   78    HD3  LYS  10           HD1      LYS  10 -14.876  -5.710  -4.659
   79    HE2  LYS  10           HE2      LYS  10 -16.508  -4.046  -5.547
   80    HE3  LYS  10           HE1      LYS  10 -15.257  -2.804  -5.459
   81    HZ1  LYS  10           HZ1      LYS  10 -13.929  -4.142  -7.010
   82    HZ2  LYS  10           HZ2      LYS  10 -15.407  -3.667  -7.669
   83    HZ3  LYS  10           HZ3      LYS  10 -15.198  -5.253  -7.133
   84    H    LEU  11           HN       LEU  11 -13.004  -7.660  -1.833
   85    HA   LEU  11           HA       LEU  11 -13.229  -8.764  -4.501
   86    HB2  LEU  11           HB2      LEU  11 -11.043  -9.310  -2.441
   87    HB3  LEU  11           HB1      LEU  11 -10.985  -9.672  -4.158
   88    HG   LEU  11           HG       LEU  11 -10.702  -7.002  -2.776
   89   HD11  LEU  11          HD11      LEU  11  -8.754  -6.779  -4.262
   90   HD12  LEU  11          HD12      LEU  11  -9.101  -8.362  -4.961
   91   HD13  LEU  11          HD13      LEU  11  -8.673  -8.219  -3.257
   92   HD21  LEU  11          HD21      LEU  11 -11.465  -7.280  -5.699
   93   HD22  LEU  11          HD22      LEU  11 -10.907  -5.803  -4.902
   94   HD23  LEU  11          HD23      LEU  11 -12.429  -6.537  -4.416
   95    H    GLY  12           HN       GLY  12 -13.939  -9.855  -1.310
   96    HA2  GLY  12           HA2      GLY  12 -15.540 -11.637  -1.124
   97    HA3  GLY  12           HA1      GLY  12 -14.680 -12.526  -2.369
   98    H    SER  13           HN       SER  13 -12.038 -11.784  -1.132
   99    HA   SER  13           HA       SER  13 -11.998 -13.164   1.418
  100    HB2  SER  13           HB2      SER  13 -10.587 -15.064   0.604
  101    HB3  SER  13           HB1      SER  13 -12.186 -15.080  -0.141
  102    HG   SER  13           HG       SER  13 -10.338 -15.399  -1.588
  103    H    VAL  14           HN       VAL  14  -9.818 -13.398   2.270
  104    HA   VAL  14           HA       VAL  14  -8.058 -11.182   1.729
  105    HB   VAL  14           HB       VAL  14  -7.869 -13.538   3.674
  106   HG11  VAL  14          HG11      VAL  14  -5.984 -11.164   3.499
  107   HG12  VAL  14          HG12      VAL  14  -5.578 -12.826   3.079
  108   HG13  VAL  14          HG13      VAL  14  -5.964 -12.411   4.749
  109   HG21  VAL  14          HG21      VAL  14  -8.271 -11.776   5.382
  110   HG22  VAL  14          HG22      VAL  14  -9.593 -11.904   4.219
  111   HG23  VAL  14          HG23      VAL  14  -8.421 -10.585   4.077
  112    H    SER  15           HN       SER  15  -8.269 -14.545   0.821
  113    HA   SER  15           HA       SER  15  -5.582 -14.898  -0.026
  114    HB2  SER  15           HB2      SER  15  -6.577 -16.877  -1.288
  115    HB3  SER  15           HB1      SER  15  -6.896 -16.845   0.449
  116    HG   SER  15           HG       SER  15  -8.697 -17.222  -1.218
  117    H    ALA  16           HN       ALA  16  -8.557 -13.834  -1.684
  118    HA   ALA  16           HA       ALA  16  -7.298 -13.359  -4.229
  119    HB1  ALA  16           HB1      ALA  16  -9.944 -12.318  -3.158
  120    HB2  ALA  16           HB2      ALA  16  -9.710 -13.808  -4.070
  121    HB3  ALA  16           HB3      ALA  16  -9.404 -12.252  -4.843
  122    H    LEU  17           HN       LEU  17  -8.012 -11.413  -1.347
  123    HA   LEU  17           HA       LEU  17  -7.461  -8.864  -2.423
  124    HB2  LEU  17           HB2      LEU  17  -8.709  -9.168  -0.316
  125    HB3  LEU  17           HB1      LEU  17  -7.269  -9.809   0.460
  126    HG   LEU  17           HG       LEU  17  -6.153  -7.638   0.292
  127   HD11  LEU  17          HD11      LEU  17  -7.324  -5.624  -0.502
  128   HD12  LEU  17          HD12      LEU  17  -8.687  -6.615  -1.031
  129   HD13  LEU  17          HD13      LEU  17  -7.104  -6.801  -1.794
  130   HD21  LEU  17          HD21      LEU  17  -8.901  -7.351   1.498
  131   HD22  LEU  17          HD22      LEU  17  -7.485  -6.357   1.861
  132   HD23  LEU  17          HD23      LEU  17  -7.486  -8.073   2.271
  133    H    ALA  18           HN       ALA  18  -5.432 -11.029  -0.494
  134    HA   ALA  18           HA       ALA  18  -3.120  -9.420  -0.428
  135    HB1  ALA  18           HB1      ALA  18  -3.617 -11.181   1.217
  136    HB2  ALA  18           HB2      ALA  18  -2.019 -11.388   0.499
  137    HB3  ALA  18           HB3      ALA  18  -3.361 -12.416  -0.016
  138    H    ALA  19           HN       ALA  19  -4.202 -11.991  -2.610
  139    HA   ALA  19           HA       ALA  19  -1.892 -12.326  -4.166
  140    HB1  ALA  19           HB1      ALA  19  -3.401 -13.180  -5.919
  141    HB2  ALA  19           HB2      ALA  19  -4.792 -12.514  -5.050
  142    HB3  ALA  19           HB3      ALA  19  -3.837 -13.812  -4.330
  143    H    ALA  20           HN       ALA  20  -4.563 -10.012  -4.449
  144    HA   ALA  20           HA       ALA  20  -3.674  -8.659  -6.791
  145    HB1  ALA  20           HB1      ALA  20  -5.509  -7.678  -4.565
  146    HB2  ALA  20           HB2      ALA  20  -6.013  -8.565  -6.004
  147    HB3  ALA  20           HB3      ALA  20  -5.339  -6.945  -6.170
  148    H    LEU  21           HN       LEU  21  -3.216  -8.098  -3.323
  149    HA   LEU  21           HA       LEU  21  -1.837  -5.576  -3.643
  150    HB2  LEU  21           HB2      LEU  21  -2.338  -7.351  -1.219
  151    HB3  LEU  21           HB1      LEU  21  -1.576  -5.766  -1.135
  152    HG   LEU  21           HG       LEU  21  -4.404  -6.247  -2.160
  153   HD11  LEU  21          HD11      LEU  21  -3.486  -5.265   0.554
  154   HD12  LEU  21          HD12      LEU  21  -4.375  -6.749   0.181
  155   HD13  LEU  21          HD13      LEU  21  -5.149  -5.180  -0.045
  156   HD21  LEU  21          HD21      LEU  21  -3.380  -4.270  -3.141
  157   HD22  LEU  21          HD22      LEU  21  -2.955  -3.661  -1.539
  158   HD23  LEU  21          HD23      LEU  21  -4.650  -3.816  -2.008
  159    H    GLY  22           HN       GLY  22  -0.835  -8.805  -3.851
  160    HA2  GLY  22           HA2      GLY  22   1.243  -9.671  -4.351
  161    HA3  GLY  22           HA1      GLY  22   1.913  -8.050  -4.248
  162    H    VAL  23           HN       VAL  23   0.128  -9.584  -1.668
  163    HA   VAL  23           HA       VAL  23   2.557 -10.154  -0.075
  164    HB   VAL  23           HB       VAL  23   1.395  -9.312   1.971
  165   HG11  VAL  23          HG11      VAL  23   2.942  -7.784   0.842
  166   HG12  VAL  23          HG12      VAL  23   1.592  -6.889   1.541
  167   HG13  VAL  23          HG13      VAL  23   1.640  -7.193  -0.196
  168   HG21  VAL  23          HG21      VAL  23  -0.758  -8.298   0.065
  169   HG22  VAL  23          HG22      VAL  23  -0.679  -7.944   1.796
  170   HG23  VAL  23          HG23      VAL  23  -0.946  -9.598   1.243
  171    H    ASN  24           HN       ASN  24   1.732 -11.393   2.027
  172    HA   ASN  24           HA       ASN  24   0.087 -13.665   1.149
  173    HB2  ASN  24           HB2      ASN  24   0.883 -14.785   3.202
  174    HB3  ASN  24           HB1      ASN  24   2.227 -14.209   2.236
  175   HD21  ASN  24          HD21      ASN  24   2.011 -14.838   5.130
  176   HD22  ASN  24          HD22      ASN  24   2.582 -13.418   5.936
  177    H    GLN  25           HN       GLN  25  -1.359 -14.591   2.908
  178    HA   GLN  25           HA       GLN  25  -3.515 -12.816   3.329
  179    HB2  GLN  25           HB2      GLN  25  -3.018 -15.640   4.373
  180    HB3  GLN  25           HB1      GLN  25  -4.499 -14.760   4.715
  181    HG2  GLN  25           HG2      GLN  25  -4.876 -16.312   2.903
  182    HG3  GLN  25           HG1      GLN  25  -5.009 -14.659   2.317
  183   HE21  GLN  25          HE21      GLN  25  -3.572 -13.950   0.749
  184   HE22  GLN  25          HE22      GLN  25  -2.443 -14.990  -0.035
  185    H    SER  26           HN       SER  26  -0.989 -14.017   5.480
  186    HA   SER  26           HA       SER  26  -1.969 -13.154   7.958
  187    HB2  SER  26           HB2      SER  26   0.943 -13.416   7.088
  188    HB3  SER  26           HB1      SER  26   0.353 -13.423   8.753
  189    HG   SER  26           HG       SER  26  -0.283 -15.434   8.531
  190    H    ALA  27           HN       ALA  27  -0.022 -11.452   5.504
  191    HA   ALA  27           HA       ALA  27   0.706  -9.168   6.965
  192    HB1  ALA  27           HB1      ALA  27   1.738  -9.754   4.813
  193    HB2  ALA  27           HB2      ALA  27   1.131  -8.095   4.796
  194    HB3  ALA  27           HB3      ALA  27   0.235  -9.381   3.973
  195    H    ILE  28           HN       ILE  28  -2.205  -9.903   5.107
  196    HA   ILE  28           HA       ILE  28  -3.349  -7.321   5.034
  197    HB   ILE  28           HB       ILE  28  -4.760 -10.030   4.995
  198   HG12  ILE  28          HG12      ILE  28  -3.034  -9.889   3.234
  199   HG13  ILE  28          HG11      ILE  28  -4.642  -9.853   2.518
  200   HG21  ILE  28          HG21      ILE  28  -5.725  -7.331   3.988
  201   HG22  ILE  28          HG22      ILE  28  -6.344  -8.194   5.400
  202   HG23  ILE  28          HG23      ILE  28  -6.571  -8.866   3.784
  203   HD11  ILE  28          HD11      ILE  28  -4.456  -7.421   2.261
  204   HD12  ILE  28          HD12      ILE  28  -3.181  -8.302   1.426
  205   HD13  ILE  28          HD13      ILE  28  -2.826  -7.488   2.946
  206    H    SER  29           HN       SER  29  -3.773 -10.052   7.278
  207    HA   SER  29           HA       SER  29  -5.664  -8.848   9.010
  208    HB2  SER  29           HB2      SER  29  -3.630 -11.041   9.572
  209    HB3  SER  29           HB1      SER  29  -5.039 -10.669  10.572
  210    HG   SER  29           HG       SER  29  -4.880 -11.970   8.130
  211    H    GLN  30           HN       GLN  30  -2.161  -8.678   8.844
  212    HA   GLN  30           HA       GLN  30  -1.674  -7.413  11.361
  213    HB2  GLN  30           HB2      GLN  30  -0.023  -7.489   8.798
  214    HB3  GLN  30           HB1      GLN  30   0.562  -6.843  10.328
  215    HG2  GLN  30           HG2      GLN  30  -0.391  -9.705  10.038
  216    HG3  GLN  30           HG1      GLN  30   1.270  -9.222   9.720
  217   HE21  GLN  30          HE21      GLN  30   1.958 -10.635  11.372
  218   HE22  GLN  30          HE22      GLN  30   1.801 -10.227  13.040
  219    H    TRP  31           HN       TRP  31  -2.234  -6.228   8.053
  220    HA   TRP  31           HA       TRP  31  -1.816  -3.446   8.587
  221    HB2  TRP  31           HB2      TRP  31  -3.356  -4.819   6.337
  222    HB3  TRP  31           HB1      TRP  31  -2.925  -3.108   6.361
  223    HD1  TRP  31           HD1      TRP  31   0.114  -4.446   7.638
  224    HE1  TRP  31           HE1      TRP  31   1.802  -4.994   5.785
  225    HE3  TRP  31           HE3      TRP  31  -3.032  -4.453   3.597
  226    HZ2  TRP  31           HZ2      TRP  31   1.818  -5.356   3.013
  227    HZ3  TRP  31           HZ3      TRP  31  -2.090  -4.893   1.375
  228    HH2  TRP  31           HH2      TRP  31   0.286  -5.336   1.093
  229    H    ARG  32           HN       ARG  32  -4.549  -5.597   8.653
  230    HA   ARG  32           HA       ARG  32  -6.589  -3.621   8.997
  231    HB2  ARG  32           HB2      ARG  32  -6.984  -5.859   7.977
  232    HB3  ARG  32           HB1      ARG  32  -6.620  -6.627   9.520
  233    HG2  ARG  32           HG2      ARG  32  -8.588  -5.521  10.530
  234    HG3  ARG  32           HG1      ARG  32  -8.940  -4.745   8.982
  235    HD2  ARG  32           HD2      ARG  32 -10.358  -6.705   9.312
  236    HD3  ARG  32           HD1      ARG  32  -9.270  -6.950   7.943
  237    HE   ARG  32           HE       ARG  32  -7.952  -8.066  10.075
  238   HH11  ARG  32          HH11      ARG  32 -11.191 -10.247   9.058
  239   HH12  ARG  32          HH12      ARG  32 -11.126  -8.569   8.612
  240   HH21  ARG  32          HH21      ARG  32  -8.053 -10.263  10.644
  241   HH22  ARG  32          HH22      ARG  32  -9.440 -11.207  10.213
  242    H    ALA  33           HN       ALA  33  -4.560  -5.614  11.112
  243    HA   ALA  33           HA       ALA  33  -5.890  -4.856  13.544
  244    HB1  ALA  33           HB1      ALA  33  -4.612  -6.965  13.396
  245    HB2  ALA  33           HB2      ALA  33  -3.969  -5.936  14.675
  246    HB3  ALA  33           HB3      ALA  33  -3.119  -6.064  13.130
  247    H    ARG  34           HN       ARG  34  -3.212  -3.638  11.642
  248    HA   ARG  34           HA       ARG  34  -2.259  -1.655  13.463
  249    HB2  ARG  34           HB2      ARG  34  -1.036  -2.738  11.501
  250    HB3  ARG  34           HB1      ARG  34  -2.004  -1.737  10.426
  251    HG2  ARG  34           HG2      ARG  34  -0.586   0.007  10.703
  252    HG3  ARG  34           HG1      ARG  34  -0.820  -0.027  12.447
  253    HD2  ARG  34           HD2      ARG  34   1.489  -0.323  12.220
  254    HD3  ARG  34           HD1      ARG  34   0.914  -1.969  12.442
  255    HE   ARG  34           HE       ARG  34   1.935  -0.762   9.962
  256   HH11  ARG  34          HH11      ARG  34   1.321  -4.733  10.320
  257   HH12  ARG  34          HH12      ARG  34   0.740  -3.675  11.566
  258   HH21  ARG  34          HH21      ARG  34   2.456  -3.859   8.515
  259   HH22  ARG  34          HH22      ARG  34   2.739  -2.154   8.386
  260    H    GLY  35           HN       GLY  35  -4.772  -1.864  11.038
  261    HA2  GLY  35           HA2      GLY  35  -6.602  -0.489  10.642
  262    HA3  GLY  35           HA1      GLY  35  -5.935   0.704  11.749
  263    H    ARG  36           HN       ARG  36  -3.583  -0.281   9.571
  264    HA   ARG  36           HA       ARG  36  -4.080   1.593   7.442
  265    HB2  ARG  36           HB2      ARG  36  -3.412   3.126   9.281
  266    HB3  ARG  36           HB1      ARG  36  -1.932   2.217   9.532
  267    HG2  ARG  36           HG2      ARG  36  -0.983   2.986   7.480
  268    HG3  ARG  36           HG1      ARG  36  -2.543   3.553   6.874
  269    HD2  ARG  36           HD2      ARG  36  -1.064   4.761   9.244
  270    HD3  ARG  36           HD1      ARG  36  -1.066   5.419   7.601
  271    HE   ARG  36           HE       ARG  36  -3.717   5.043   8.501
  272   HH11  ARG  36          HH11      ARG  36  -2.056   8.566   9.482
  273   HH12  ARG  36          HH12      ARG  36  -1.025   7.248   9.021
  274   HH21  ARG  36          HH21      ARG  36  -5.034   6.749   9.122
  275   HH22  ARG  36          HH22      ARG  36  -4.331   8.279   9.537
  276    H    VAL  37           HN       VAL  37  -2.750   1.164   5.703
  277    HA   VAL  37           HA       VAL  37  -1.027  -1.206   5.887
  278    HB   VAL  37           HB       VAL  37  -1.090  -1.273   3.446
  279   HG11  VAL  37          HG11      VAL  37  -3.855  -0.712   4.575
  280   HG12  VAL  37          HG12      VAL  37  -2.997  -2.254   4.618
  281   HG13  VAL  37          HG13      VAL  37  -3.506  -1.576   3.075
  282   HG21  VAL  37          HG21      VAL  37  -0.969   1.130   2.934
  283   HG22  VAL  37          HG22      VAL  37  -2.614   1.364   3.528
  284   HG23  VAL  37          HG23      VAL  37  -2.327   0.386   2.086
  285    HA   PRO  38           HA       PRO  38   2.947   1.026   5.367
  286    HB2  PRO  38           HB2      PRO  38   3.429  -1.193   3.354
  287    HB3  PRO  38           HB1      PRO  38   4.491  -0.598   4.654
  288    HG2  PRO  38           HG2      PRO  38   3.189  -2.867   4.997
  289    HG3  PRO  38           HG1      PRO  38   3.273  -1.696   6.339
  290    HD2  PRO  38           HD2      PRO  38   0.986  -2.241   4.450
  291    HD3  PRO  38           HD1      PRO  38   0.956  -1.957   6.206
  292    H    ALA  39           HN       ALA  39   4.205   2.000   3.616
  293    HA   ALA  39           HA       ALA  39   2.578   3.720   2.136
  294    HB1  ALA  39           HB1      ALA  39   4.795   4.341   2.972
  295    HB2  ALA  39           HB2      ALA  39   4.685   4.641   1.234
  296    HB3  ALA  39           HB3      ALA  39   5.565   3.232   1.836
  297    H    GLY  40           HN       GLY  40   1.986   3.830  -0.011
  298    HA2  GLY  40           HA2      GLY  40   1.776   3.425  -2.249
  299    HA3  GLY  40           HA1      GLY  40   3.269   2.509  -2.185
  300    H    ARG  41           HN       ARG  41   0.075   1.959  -0.621
  301    HA   ARG  41           HA       ARG  41  -0.352  -0.433  -2.276
  302    HB2  ARG  41           HB2      ARG  41   1.032  -1.112  -0.235
  303    HB3  ARG  41           HB1      ARG  41  -0.346  -0.669   0.763
  304    HG2  ARG  41           HG2      ARG  41  -0.483  -3.019   0.512
  305    HG3  ARG  41           HG1      ARG  41  -1.708  -2.377  -0.583
  306    HD2  ARG  41           HD2      ARG  41   1.068  -3.315  -1.379
  307    HD3  ARG  41           HD1      ARG  41  -0.417  -4.241  -1.574
  308    HE   ARG  41           HE       ARG  41  -0.956  -1.995  -3.001
  309   HH11  ARG  41          HH11      ARG  41   2.115  -3.969  -4.730
  310   HH12  ARG  41          HH12      ARG  41   1.764  -4.247  -3.056
  311   HH21  ARG  41          HH21      ARG  41  -0.429  -1.628  -5.205
  312   HH22  ARG  41          HH22      ARG  41   0.882  -2.498  -5.935
  313    H    CYS  42           HN       CYS  42  -1.546   1.947  -0.029
  314    HA   CYS  42           HA       CYS  42  -4.226   1.095   0.238
  315    HB2  CYS  42           HB2      CYS  42  -3.336   2.738   1.739
  316    HB3  CYS  42           HB1      CYS  42  -2.970   3.839   0.417
  317    H    ILE  43           HN       ILE  43  -2.544   2.606  -2.383
  318    HA   ILE  43           HA       ILE  43  -4.451   3.805  -3.960
  319    HB   ILE  43           HB       ILE  43  -2.338   1.788  -4.894
  320   HG12  ILE  43          HG12      ILE  43  -2.053   4.819  -4.603
  321   HG13  ILE  43          HG11      ILE  43  -1.395   3.636  -3.476
  322   HG21  ILE  43          HG21      ILE  43  -3.679   4.021  -6.465
  323   HG22  ILE  43          HG22      ILE  43  -3.971   2.292  -6.671
  324   HG23  ILE  43          HG23      ILE  43  -2.391   2.973  -7.062
  325   HD11  ILE  43          HD11      ILE  43  -0.605   3.958  -6.370
  326   HD12  ILE  43          HD12      ILE  43   0.027   2.737  -5.259
  327   HD13  ILE  43          HD13      ILE  43   0.323   4.447  -4.953
  328    H    ASP  44           HN       ASP  44  -3.674   0.361  -3.720
  329    HA   ASP  44           HA       ASP  44  -5.656  -0.535  -5.576
  330    HB2  ASP  44           HB2      ASP  44  -4.131  -2.209  -3.552
  331    HB3  ASP  44           HB1      ASP  44  -4.884  -2.775  -5.038
  332    H    ILE  45           HN       ILE  45  -5.343  -0.759  -1.997
  333    HA   ILE  45           HA       ILE  45  -7.771  -2.110  -1.525
  334    HB   ILE  45           HB       ILE  45  -6.123  -0.310   0.303
  335   HG12  ILE  45          HG12      ILE  45  -6.528  -3.326   0.080
  336   HG13  ILE  45          HG11      ILE  45  -5.040  -2.420  -0.168
  337   HG21  ILE  45          HG21      ILE  45  -8.476  -0.137   1.072
  338   HG22  ILE  45          HG22      ILE  45  -7.478  -1.021   2.226
  339   HG23  ILE  45          HG23      ILE  45  -8.570  -1.900   1.156
  340   HD11  ILE  45          HD11      ILE  45  -5.027  -1.889   2.258
  341   HD12  ILE  45          HD12      ILE  45  -4.908  -3.605   1.896
  342   HD13  ILE  45          HD13      ILE  45  -6.438  -2.935   2.468
  343    H    GLU  46           HN       GLU  46  -7.121   1.335  -1.979
  344    HA   GLU  46           HA       GLU  46  -9.634   2.354  -1.109
  345    HB2  GLU  46           HB2      GLU  46  -7.524   3.691  -1.311
  346    HB3  GLU  46           HB1      GLU  46  -7.690   3.650  -3.065
  347    HG2  GLU  46           HG2      GLU  46  -9.767   4.921  -2.945
  348    HG3  GLU  46           HG1      GLU  46  -9.761   4.838  -1.181
  349    H    LEU  47           HN       LEU  47  -8.454   1.141  -4.198
  350    HA   LEU  47           HA       LEU  47 -10.604   1.777  -5.894
  351    HB2  LEU  47           HB2      LEU  47  -8.850  -0.693  -5.760
  352    HB3  LEU  47           HB1      LEU  47 -10.021  -0.455  -7.040
  353    HG   LEU  47           HG       LEU  47  -7.745   1.508  -6.544
  354   HD11  LEU  47          HD11      LEU  47  -6.522   0.389  -8.344
  355   HD12  LEU  47          HD12      LEU  47  -7.775  -0.850  -8.462
  356   HD13  LEU  47          HD13      LEU  47  -6.793  -0.721  -7.000
  357   HD21  LEU  47          HD21      LEU  47  -9.659   2.356  -7.841
  358   HD22  LEU  47          HD22      LEU  47  -9.518   0.984  -8.948
  359   HD23  LEU  47          HD23      LEU  47  -8.223   2.183  -8.854
  360    H    TYR  48           HN       TYR  48 -10.150  -0.842  -3.560
  361    HA   TYR  48           HA       TYR  48 -12.727  -2.079  -4.203
  362    HB2  TYR  48           HB2      TYR  48 -10.989  -3.029  -1.907
  363    HB3  TYR  48           HB1      TYR  48 -12.007  -3.971  -3.004
  364    HD1  TYR  48           HD1      TYR  48  -8.921  -4.221  -2.105
  365    HD2  TYR  48           HD2      TYR  48 -10.888  -2.903  -5.656
  366    HE1  TYR  48           HE1      TYR  48  -6.924  -4.785  -3.417
  367    HE2  TYR  48           HE2      TYR  48  -8.898  -3.439  -6.975
  368    HH   TYR  48           HH       TYR  48  -6.459  -3.739  -6.602
  369    H    THR  49           HN       THR  49 -11.708   0.412  -2.176
  370    HA   THR  49           HA       THR  49 -14.094   0.135  -0.419
  371    HB   THR  49           HB       THR  49 -12.905   1.276   1.364
  372    HG1  THR  49           HG1      THR  49 -11.539   2.686   0.448
  373   HG21  THR  49          HG21      THR  49 -11.126  -0.905   0.228
  374   HG22  THR  49          HG22      THR  49 -12.516  -1.147   1.283
  375   HG23  THR  49          HG23      THR  49 -11.088  -0.311   1.887
  376    H    ASP  50           HN       ASP  50 -14.040   1.258  -3.008
  377    HA   ASP  50           HA       ASP  50 -13.844   4.147  -2.869
  378    HB2  ASP  50           HB2      ASP  50 -13.150   2.799  -4.874
  379    HB3  ASP  50           HB1      ASP  50 -14.830   2.344  -5.128
  380    H    GLY  51           HN       GLY  51 -15.678   3.406  -0.985
  381    HA2  GLY  51           HA2      GLY  51 -17.894   5.007  -1.543
  382    HA3  GLY  51           HA1      GLY  51 -18.379   3.327  -1.770
  383    H    ARG  52           HN       ARG  52 -17.105   1.968   0.148
  384    HA   ARG  52           HA       ARG  52 -18.886   2.387   2.314
  385    HB2  ARG  52           HB2      ARG  52 -16.502   0.517   2.009
  386    HB3  ARG  52           HB1      ARG  52 -17.591   0.466   3.392
  387    HG2  ARG  52           HG2      ARG  52 -18.440   0.034   0.509
  388    HG3  ARG  52           HG1      ARG  52 -18.099  -1.257   1.663
  389    HD2  ARG  52           HD2      ARG  52 -19.944  -0.499   3.090
  390    HD3  ARG  52           HD1      ARG  52 -20.255   0.860   2.007
  391    HE   ARG  52           HE       ARG  52 -20.434  -1.531   0.546
  392   HH11  ARG  52          HH11      ARG  52 -23.724  -0.500   2.635
  393   HH12  ARG  52          HH12      ARG  52 -22.191   0.178   3.075
  394   HH21  ARG  52          HH21      ARG  52 -22.463  -2.391  -0.035
  395   HH22  ARG  52          HH22      ARG  52 -23.880  -1.954   0.870
  396    H    VAL  53           HN       VAL  53 -15.303   2.595   2.226
  397    HA   VAL  53           HA       VAL  53 -15.296   4.749   4.181
  398    HB   VAL  53           HB       VAL  53 -15.334   2.791   5.688
  399   HG11  VAL  53          HG11      VAL  53 -14.457   1.093   4.167
  400   HG12  VAL  53          HG12      VAL  53 -13.581   1.082   5.699
  401   HG13  VAL  53          HG13      VAL  53 -12.847   1.814   4.269
  402   HG21  VAL  53          HG21      VAL  53 -14.005   4.737   6.405
  403   HG22  VAL  53          HG22      VAL  53 -12.568   4.053   5.644
  404   HG23  VAL  53          HG23      VAL  53 -13.309   3.237   7.024
  405    H    GLU  54           HN       GLU  54 -13.509   6.044   3.930
  406    HA   GLU  54           HA       GLU  54 -11.910   5.748   1.578
  407    HB2  GLU  54           HB2      GLU  54 -11.701   7.725   3.884
  408    HB3  GLU  54           HB1      GLU  54 -10.794   7.847   2.375
  409    HG2  GLU  54           HG2      GLU  54 -12.939   8.060   1.131
  410    HG3  GLU  54           HG1      GLU  54 -13.809   7.992   2.667
  411    H    CYS  55           HN       CYS  55  -9.825   5.086   1.376
  412    HA   CYS  55           HA       CYS  55  -8.652   3.561   3.577
  413    HB2  CYS  55           HB2      CYS  55  -8.817   2.340   1.530
  414    HB3  CYS  55           HB1      CYS  55  -8.128   3.663   0.595
  415    H    ARG  56           HN       ARG  56  -6.664   3.958   4.482
  416    HA   ARG  56           HA       ARG  56  -5.091   6.316   3.597
  417    HB2  ARG  56           HB2      ARG  56  -5.989   5.627   6.427
  418    HB3  ARG  56           HB1      ARG  56  -4.514   6.547   6.168
  419    HG2  ARG  56           HG2      ARG  56  -6.206   8.146   6.629
  420    HG3  ARG  56           HG1      ARG  56  -5.906   8.253   4.897
  421    HD2  ARG  56           HD2      ARG  56  -7.949   6.778   4.554
  422    HD3  ARG  56           HD1      ARG  56  -8.277   6.933   6.275
  423    HE   ARG  56           HE       ARG  56  -8.828   9.186   5.967
  424   HH11  ARG  56          HH11      ARG  56  -8.710   8.977   1.951
  425   HH12  ARG  56          HH12      ARG  56  -7.983   7.710   2.886
  426   HH21  ARG  56          HH21      ARG  56  -9.839  10.775   4.733
  427   HH22  ARG  56          HH22      ARG  56  -9.764  10.713   3.003
  428    H    GLU  57           HN       GLU  57  -2.933   6.002   3.481
  429    HA   GLU  57           HA       GLU  57  -1.682   3.571   4.624
  430    HB2  GLU  57           HB2      GLU  57   0.028   3.727   2.783
  431    HB3  GLU  57           HB1      GLU  57  -1.586   3.321   2.228
  432    HG2  GLU  57           HG2      GLU  57  -1.943   5.572   1.406
  433    HG3  GLU  57           HG1      GLU  57  -0.423   6.112   2.112
  434    H    LEU  58           HN       LEU  58   0.619   3.795   5.056
  435    HA   LEU  58           HA       LEU  58   1.323   6.169   6.463
  436    HB2  LEU  58           HB2      LEU  58   2.873   3.673   5.705
  437    HB3  LEU  58           HB1      LEU  58   3.540   4.942   6.725
  438    HG   LEU  58           HG       LEU  58   0.928   3.616   7.518
  439   HD11  LEU  58          HD11      LEU  58   2.071   1.942   8.835
  440   HD12  LEU  58          HD12      LEU  58   3.638   2.460   8.199
  441   HD13  LEU  58          HD13      LEU  58   2.435   1.742   7.121
  442   HD21  LEU  58          HD21      LEU  58   1.654   4.218   9.781
  443   HD22  LEU  58          HD22      LEU  58   1.589   5.625   8.723
  444   HD23  LEU  58          HD23      LEU  58   3.148   4.900   9.132
  445    H    ARG  59           HN       ARG  59   2.159   7.977   5.578
  446    HA   ARG  59           HA       ARG  59   2.631   8.121   2.769
  447    HB2  ARG  59           HB2      ARG  59   3.245  10.215   4.902
  448    HB3  ARG  59           HB1      ARG  59   3.237  10.479   3.145
  449    HG2  ARG  59           HG2      ARG  59   0.838   9.983   3.056
  450    HG3  ARG  59           HG1      ARG  59   0.807   9.647   4.790
  451    HD2  ARG  59           HD2      ARG  59   1.488  12.325   3.517
  452    HD3  ARG  59           HD1      ARG  59  -0.058  11.911   4.258
  453    HE   ARG  59           HE       ARG  59   1.093  11.731   6.402
  454   HH11  ARG  59          HH11      ARG  59   3.830  14.338   4.988
  455   HH12  ARG  59          HH12      ARG  59   2.834  13.458   3.874
  456   HH21  ARG  59          HH21      ARG  59   3.621  13.990   7.236
  457   HH22  ARG  59          HH22      ARG  59   2.469  12.851   7.854
  458    HA   PRO  60           HA       PRO  60   6.762   6.891   2.251
  459    HB2  PRO  60           HB2      PRO  60   7.790   8.704   0.404
  460    HB3  PRO  60           HB1      PRO  60   6.654   7.402   0.005
  461    HG2  PRO  60           HG2      PRO  60   6.086  10.298   0.507
  462    HG3  PRO  60           HG1      PRO  60   5.444   9.213  -0.733
  463    HD2  PRO  60           HD2      PRO  60   4.003   9.844   1.478
  464    HD3  PRO  60           HD1      PRO  60   3.894   8.232   0.708
  465    H    ASP  61           HN       ASP  61   8.203   7.007   3.676
  466    HA   ASP  61           HA       ASP  61   9.036   9.498   5.020
  467    HB2  ASP  61           HB2      ASP  61   7.873   7.878   6.464
  468    HB3  ASP  61           HB1      ASP  61   8.983   6.602   5.992
  469    H    VAL  62           HN       VAL  62  10.615   6.261   4.798
  470    HA   VAL  62           HA       VAL  62  13.235   7.366   4.451
  471    HB   VAL  62           HB       VAL  62  12.277   4.486   4.037
  472   HG11  VAL  62          HG11      VAL  62  15.120   5.532   4.348
  473   HG12  VAL  62          HG12      VAL  62  14.412   4.880   2.867
  474   HG13  VAL  62          HG13      VAL  62  14.652   3.831   4.265
  475   HG21  VAL  62          HG21      VAL  62  13.604   5.770   6.463
  476   HG22  VAL  62          HG22      VAL  62  13.161   4.067   6.307
  477   HG23  VAL  62          HG23      VAL  62  11.904   5.306   6.343
  478    H    PHE  63           HN       PHE  63  10.770   6.128   2.292
  479    HA   PHE  63           HA       PHE  63  12.428   6.578  -0.105
  480    HB2  PHE  63           HB2      PHE  63  11.157   4.378   0.247
  481    HB3  PHE  63           HB1      PHE  63   9.661   5.286   0.101
  482    HD1  PHE  63           HD1      PHE  63  12.758   4.311  -1.746
  483    HD2  PHE  63           HD2      PHE  63   8.743   5.755  -2.073
  484    HE1  PHE  63           HE1      PHE  63  12.819   3.966  -4.183
  485    HE2  PHE  63           HE2      PHE  63   8.816   5.414  -4.503
  486    HZ   PHE  63           HZ       PHE  63  10.852   4.518  -5.561
  487    H    GLY  64           HN       GLY  64  11.963   8.907   1.055
  488    HA2  GLY  64           HA2      GLY  64   9.523  10.234   0.194
  489    HA3  GLY  64           HA1      GLY  64  10.931  10.978   0.941
  490    H    ALA  65           HN       ALA  65   9.899   9.461  -2.095
  491    HA   ALA  65           HA       ALA  65  12.077  10.389  -3.684
  492    HB1  ALA  65           HB1      ALA  65   9.399   9.211  -4.509
  493    HB2  ALA  65           HB2      ALA  65  10.875   8.303  -4.180
  494    HB3  ALA  65           HB3      ALA  65  10.809   9.401  -5.560
  Start of MODEL    4
    1    H1   MET   1           HT1      MET   1 -14.770  -2.411  12.040
    2    H2   MET   1           HT2      MET   1 -14.038  -0.914  12.317
    3    H3   MET   1           HT3      MET   1 -13.085  -2.263  11.965
    4    HA   MET   1           HA       MET   1 -14.020  -2.415   9.759
    5    HB2  MET   1           HB2      MET   1 -15.530   0.122  10.552
    6    HB3  MET   1           HB1      MET   1 -15.442  -0.508   8.912
    7    HG2  MET   1           HG2      MET   1 -17.569  -1.083   9.897
    8    HG3  MET   1           HG1      MET   1 -16.619  -2.554   9.662
    9    HE1  MET   1           HE1      MET   1 -19.208  -2.442  11.485
   10    HE2  MET   1           HE2      MET   1 -18.699  -3.282  12.947
   11    HE3  MET   1           HE3      MET   1 -18.251  -3.919  11.363
   12    H    ASN   2           HN       ASN   2 -12.416  -1.870   8.456
   13    HA   ASN   2           HA       ASN   2 -11.323   0.837   8.296
   14    HB2  ASN   2           HB2      ASN   2  -8.940  -0.050   8.308
   15    HB3  ASN   2           HB1      ASN   2  -9.733  -0.050   9.873
   16   HD21  ASN   2          HD21      ASN   2 -10.146  -2.023  10.867
   17   HD22  ASN   2          HD22      ASN   2  -9.469  -3.503  10.297
   18    H    ALA   3           HN       ALA   3 -10.010   1.081   6.373
   19    HA   ALA   3           HA       ALA   3 -11.104   0.385   4.018
   20    HB1  ALA   3           HB1      ALA   3  -9.387   2.106   4.313
   21    HB2  ALA   3           HB2      ALA   3  -9.005   1.054   2.951
   22    HB3  ALA   3           HB3      ALA   3  -8.148   0.858   4.484
   23    H    ILE   4           HN       ILE   4  -8.594  -1.473   5.671
   24    HA   ILE   4           HA       ILE   4  -7.963  -3.225   3.495
   25    HB   ILE   4           HB       ILE   4  -7.392  -3.710   6.451
   26   HG12  ILE   4          HG12      ILE   4  -5.031  -2.763   5.826
   27   HG13  ILE   4          HG11      ILE   4  -5.838  -2.008   4.463
   28   HG21  ILE   4          HG21      ILE   4  -5.530  -5.114   5.660
   29   HG22  ILE   4          HG22      ILE   4  -5.990  -4.794   3.987
   30   HG23  ILE   4          HG23      ILE   4  -7.077  -5.696   5.046
   31   HD11  ILE   4          HD11      ILE   4  -6.366  -1.499   7.395
   32   HD12  ILE   4          HD12      ILE   4  -7.276  -0.761   6.074
   33   HD13  ILE   4          HD13      ILE   4  -5.552  -0.428   6.255
   34    H    ASP   5           HN       ASP   5  -9.794  -3.486   6.506
   35    HA   ASP   5           HA       ASP   5 -10.851  -6.048   6.393
   36    HB2  ASP   5           HB2      ASP   5 -11.072  -4.713   8.396
   37    HB3  ASP   5           HB1      ASP   5 -11.964  -3.457   7.548
   38    H    ILE   6           HN       ILE   6 -12.128  -3.039   5.012
   39    HA   ILE   6           HA       ILE   6 -14.587  -4.116   4.069
   40    HB   ILE   6           HB       ILE   6 -13.111  -1.566   3.264
   41   HG12  ILE   6          HG12      ILE   6 -13.760  -1.559   5.624
   42   HG13  ILE   6          HG11      ILE   6 -14.773  -0.430   4.741
   43   HG21  ILE   6          HG21      ILE   6 -14.646  -2.174   1.449
   44   HG22  ILE   6          HG22      ILE   6 -15.260  -0.768   2.311
   45   HG23  ILE   6          HG23      ILE   6 -15.981  -2.354   2.592
   46   HD11  ILE   6          HD11      ILE   6 -16.059  -1.641   6.394
   47   HD12  ILE   6          HD12      ILE   6 -15.579  -3.183   5.688
   48   HD13  ILE   6          HD13      ILE   6 -16.604  -2.074   4.774
   49    H    ALA   7           HN       ALA   7 -11.407  -3.614   2.567
   50    HA   ALA   7           HA       ALA   7 -12.091  -4.342  -0.084
   51    HB1  ALA   7           HB1      ALA   7  -9.396  -4.617   1.280
   52    HB2  ALA   7           HB2      ALA   7 -10.003  -3.162   0.487
   53    HB3  ALA   7           HB3      ALA   7  -9.695  -4.622  -0.462
   54    H    ILE   8           HN       ILE   8 -11.236  -6.237   2.737
   55    HA   ILE   8           HA       ILE   8 -10.935  -8.809   1.548
   56    HB   ILE   8           HB       ILE   8 -11.807  -8.005   4.366
   57   HG12  ILE   8          HG12      ILE   8  -9.075  -8.961   3.405
   58   HG13  ILE   8          HG11      ILE   8  -9.509  -7.267   3.560
   59   HG21  ILE   8          HG21      ILE   8 -11.209 -10.306   5.073
   60   HG22  ILE   8          HG22      ILE   8 -10.933 -10.752   3.387
   61   HG23  ILE   8          HG23      ILE   8 -12.550 -10.302   3.929
   62   HD11  ILE   8          HD11      ILE   8  -9.342  -9.275   5.785
   63   HD12  ILE   8          HD12      ILE   8  -9.837  -7.589   5.962
   64   HD13  ILE   8          HD13      ILE   8  -8.203  -7.979   5.427
   65    H    ASN   9           HN       ASN   9 -13.715  -7.204   3.128
   66    HA   ASN   9           HA       ASN   9 -15.637  -9.233   2.602
   67    HB2  ASN   9           HB2      ASN   9 -15.998  -6.258   3.167
   68    HB3  ASN   9           HB1      ASN   9 -17.343  -7.384   3.049
   69   HD21  ASN   9          HD21      ASN   9 -14.836  -6.170   5.075
   70   HD22  ASN   9          HD22      ASN   9 -15.192  -7.120   6.468
   71    H    LYS  10           HN       LYS  10 -14.358  -6.621   0.668
   72    HA   LYS  10           HA       LYS  10 -16.530  -6.467  -1.206
   73    HB2  LYS  10           HB2      LYS  10 -14.630  -4.673  -0.533
   74    HB3  LYS  10           HB1      LYS  10 -13.790  -5.354  -1.914
   75    HG2  LYS  10           HG2      LYS  10 -16.604  -4.674  -2.551
   76    HG3  LYS  10           HG1      LYS  10 -15.710  -3.291  -1.941
   77    HD2  LYS  10           HD2      LYS  10 -15.497  -3.227  -4.307
   78    HD3  LYS  10           HD1      LYS  10 -13.938  -3.770  -3.688
   79    HE2  LYS  10           HE2      LYS  10 -14.494  -6.080  -4.273
   80    HE3  LYS  10           HE1      LYS  10 -16.090  -5.575  -4.832
   81    HZ1  LYS  10           HZ1      LYS  10 -15.079  -4.310  -6.579
   82    HZ2  LYS  10           HZ2      LYS  10 -14.468  -5.887  -6.630
   83    HZ3  LYS  10           HZ3      LYS  10 -13.523  -4.635  -5.998
   84    H    LEU  11           HN       LEU  11 -13.243  -7.875  -1.271
   85    HA   LEU  11           HA       LEU  11 -13.658  -9.065  -3.897
   86    HB2  LEU  11           HB2      LEU  11 -11.361  -9.565  -1.968
   87    HB3  LEU  11           HB1      LEU  11 -11.427 -10.029  -3.658
   88    HG   LEU  11           HG       LEU  11 -10.992  -7.280  -2.471
   89   HD11  LEU  11          HD11      LEU  11  -9.055  -7.246  -3.983
   90   HD12  LEU  11          HD12      LEU  11  -9.496  -8.841  -4.597
   91   HD13  LEU  11          HD13      LEU  11  -9.017  -8.644  -2.911
   92   HD21  LEU  11          HD21      LEU  11 -12.764  -6.932  -4.130
   93   HD22  LEU  11          HD22      LEU  11 -11.793  -7.749  -5.359
   94   HD23  LEU  11          HD23      LEU  11 -11.239  -6.224  -4.654
   95    H    GLY  12           HN       GLY  12 -14.270  -9.928  -0.635
   96    HA2  GLY  12           HA2      GLY  12 -15.718 -11.734  -0.083
   97    HA3  GLY  12           HA1      GLY  12 -15.100 -12.646  -1.453
   98    H    SER  13           HN       SER  13 -12.262 -11.924  -0.728
   99    HA   SER  13           HA       SER  13 -11.808 -13.407   1.745
  100    HB2  SER  13           HB2      SER  13 -10.458 -15.176   0.612
  101    HB3  SER  13           HB1      SER  13 -12.145 -15.216   0.118
  102    HG   SER  13           HG       SER  13 -11.555 -14.075  -1.778
  103    H    VAL  14           HN       VAL  14  -9.619 -13.534   2.372
  104    HA   VAL  14           HA       VAL  14  -7.980 -11.245   1.696
  105    HB   VAL  14           HB       VAL  14  -7.711 -13.524   3.707
  106   HG11  VAL  14          HG11      VAL  14  -5.703 -12.401   4.634
  107   HG12  VAL  14          HG12      VAL  14  -5.693 -11.297   3.259
  108   HG13  VAL  14          HG13      VAL  14  -5.420 -13.019   3.008
  109   HG21  VAL  14          HG21      VAL  14  -9.319 -11.777   4.261
  110   HG22  VAL  14          HG22      VAL  14  -8.085 -10.531   4.013
  111   HG23  VAL  14          HG23      VAL  14  -7.931 -11.686   5.348
  112    H    SER  15           HN       SER  15  -8.073 -14.659   0.891
  113    HA   SER  15           HA       SER  15  -5.418 -14.988   0.014
  114    HB2  SER  15           HB2      SER  15  -6.449 -16.927  -1.339
  115    HB3  SER  15           HB1      SER  15  -6.689 -16.957   0.410
  116    HG   SER  15           HG       SER  15  -8.556 -17.187  -1.305
  117    H    ALA  16           HN       ALA  16  -8.361 -13.991  -1.724
  118    HA   ALA  16           HA       ALA  16  -7.113 -13.473  -4.245
  119    HB1  ALA  16           HB1      ALA  16  -9.183 -12.245  -4.782
  120    HB2  ALA  16           HB2      ALA  16  -9.679 -12.321  -3.089
  121    HB3  ALA  16           HB3      ALA  16  -9.541 -13.803  -4.035
  122    H    LEU  17           HN       LEU  17  -7.844 -11.446  -1.399
  123    HA   LEU  17           HA       LEU  17  -7.178  -8.940  -2.504
  124    HB2  LEU  17           HB2      LEU  17  -8.503  -9.224  -0.419
  125    HB3  LEU  17           HB1      LEU  17  -7.063  -9.795   0.417
  126    HG   LEU  17           HG       LEU  17  -5.992  -7.595   0.092
  127   HD11  LEU  17          HD11      LEU  17  -7.080  -6.854  -1.965
  128   HD12  LEU  17          HD12      LEU  17  -7.270  -5.647  -0.700
  129   HD13  LEU  17          HD13      LEU  17  -8.625  -6.698  -1.122
  130   HD21  LEU  17          HD21      LEU  17  -8.681  -7.361   1.438
  131   HD22  LEU  17          HD22      LEU  17  -7.277  -6.321   1.700
  132   HD23  LEU  17          HD23      LEU  17  -7.206  -8.023   2.148
  133    H    ALA  18           HN       ALA  18  -5.232 -11.226  -0.674
  134    HA   ALA  18           HA       ALA  18  -2.901  -9.633  -0.379
  135    HB1  ALA  18           HB1      ALA  18  -3.475 -11.476   1.154
  136    HB2  ALA  18           HB2      ALA  18  -1.868 -11.695   0.460
  137    HB3  ALA  18           HB3      ALA  18  -3.228 -12.647  -0.146
  138    H    ALA  19           HN       ALA  19  -3.950 -12.111  -2.685
  139    HA   ALA  19           HA       ALA  19  -1.564 -12.300  -4.220
  140    HB1  ALA  19           HB1      ALA  19  -3.005 -13.327  -5.937
  141    HB2  ALA  19           HB2      ALA  19  -4.443 -12.786  -5.065
  142    HB3  ALA  19           HB3      ALA  19  -3.360 -13.971  -4.333
  143    H    ALA  20           HN       ALA  20  -4.312 -10.095  -4.282
  144    HA   ALA  20           HA       ALA  20  -3.638  -8.743  -6.741
  145    HB1  ALA  20           HB1      ALA  20  -5.965  -8.868  -5.952
  146    HB2  ALA  20           HB2      ALA  20  -5.455  -7.187  -6.111
  147    HB3  ALA  20           HB3      ALA  20  -5.544  -7.937  -4.513
  148    H    LEU  21           HN       LEU  21  -2.848  -8.374  -3.368
  149    HA   LEU  21           HA       LEU  21  -1.678  -5.692  -3.716
  150    HB2  LEU  21           HB2      LEU  21  -2.247  -7.341  -1.226
  151    HB3  LEU  21           HB1      LEU  21  -1.522  -5.738  -1.208
  152    HG   LEU  21           HG       LEU  21  -4.321  -6.393  -2.209
  153   HD11  LEU  21          HD11      LEU  21  -3.426  -5.057   0.349
  154   HD12  LEU  21          HD12      LEU  21  -4.279  -6.595   0.165
  155   HD13  LEU  21          HD13      LEU  21  -5.094  -5.087  -0.242
  156   HD21  LEU  21          HD21      LEU  21  -3.386  -4.528  -3.450
  157   HD22  LEU  21          HD22      LEU  21  -2.961  -3.705  -1.948
  158   HD23  LEU  21          HD23      LEU  21  -4.657  -3.968  -2.367
  159    H    GLY  22           HN       GLY  22  -0.678  -8.861  -3.926
  160    HA2  GLY  22           HA2      GLY  22   1.409  -9.745  -4.359
  161    HA3  GLY  22           HA1      GLY  22   2.047  -8.108  -4.323
  162    H    VAL  23           HN       VAL  23   0.356  -9.690  -1.674
  163    HA   VAL  23           HA       VAL  23   2.809  -9.939  -0.051
  164    HB   VAL  23           HB       VAL  23   1.624  -8.966   1.910
  165   HG11  VAL  23          HG11      VAL  23   3.015  -7.447   0.567
  166   HG12  VAL  23          HG12      VAL  23   1.639  -6.590   1.263
  167   HG13  VAL  23          HG13      VAL  23   1.624  -7.040  -0.445
  168   HG21  VAL  23          HG21      VAL  23  -0.656  -8.337  -0.016
  169   HG22  VAL  23          HG22      VAL  23  -0.548  -7.781   1.655
  170   HG23  VAL  23          HG23      VAL  23  -0.705  -9.501   1.312
  171    H    ASN  24           HN       ASN  24   2.155 -11.106   2.108
  172    HA   ASN  24           HA       ASN  24   0.748 -13.569   1.574
  173    HB2  ASN  24           HB2      ASN  24   2.207 -12.430   3.979
  174    HB3  ASN  24           HB1      ASN  24   1.206 -13.863   4.164
  175   HD21  ASN  24          HD21      ASN  24   1.913 -15.800   3.375
  176   HD22  ASN  24          HD22      ASN  24   3.493 -16.045   2.714
  177    H    GLN  25           HN       GLN  25  -0.803 -14.371   3.162
  178    HA   GLN  25           HA       GLN  25  -3.112 -12.656   3.418
  179    HB2  GLN  25           HB2      GLN  25  -2.646 -15.581   4.219
  180    HB3  GLN  25           HB1      GLN  25  -4.190 -14.756   4.386
  181    HG2  GLN  25           HG2      GLN  25  -4.230 -16.119   2.388
  182    HG3  GLN  25           HG1      GLN  25  -4.281 -14.417   1.931
  183   HE21  GLN  25          HE21      GLN  25  -3.404 -14.574  -0.103
  184   HE22  GLN  25          HE22      GLN  25  -1.799 -15.122  -0.426
  185    H    SER  26           HN       SER  26  -0.540 -13.850   5.420
  186    HA   SER  26           HA       SER  26  -1.543 -13.082   7.988
  187    HB2  SER  26           HB2      SER  26   1.337 -13.470   7.051
  188    HB3  SER  26           HB1      SER  26   0.793 -13.427   8.730
  189    HG   SER  26           HG       SER  26  -0.333 -15.324   8.394
  190    H    ALA  27           HN       ALA  27   0.233 -11.447   5.416
  191    HA   ALA  27           HA       ALA  27   0.964  -9.078   6.813
  192    HB1  ALA  27           HB1      ALA  27   2.020  -9.703   4.679
  193    HB2  ALA  27           HB2      ALA  27   1.332  -8.083   4.588
  194    HB3  ALA  27           HB3      ALA  27   0.495  -9.440   3.829
  195    H    ILE  28           HN       ILE  28  -1.831  -9.937   4.806
  196    HA   ILE  28           HA       ILE  28  -3.235  -7.472   4.971
  197    HB   ILE  28           HB       ILE  28  -4.396 -10.274   4.617
  198   HG12  ILE  28          HG12      ILE  28  -2.659  -9.756   2.912
  199   HG13  ILE  28          HG11      ILE  28  -4.264  -9.908   2.207
  200   HG21  ILE  28          HG21      ILE  28  -5.580  -7.571   3.886
  201   HG22  ILE  28          HG22      ILE  28  -6.136  -8.641   5.178
  202   HG23  ILE  28          HG23      ILE  28  -6.283  -9.143   3.496
  203   HD11  ILE  28          HD11      ILE  28  -4.436  -7.468   2.103
  204   HD12  ILE  28          HD12      ILE  28  -3.052  -8.088   1.207
  205   HD13  ILE  28          HD13      ILE  28  -2.812  -7.336   2.783
  206    H    SER  29           HN       SER  29  -3.354 -10.443   6.912
  207    HA   SER  29           HA       SER  29  -5.417  -9.832   8.693
  208    HB2  SER  29           HB2      SER  29  -4.392 -12.073   8.508
  209    HB3  SER  29           HB1      SER  29  -2.892 -11.465   9.211
  210    HG   SER  29           HG       SER  29  -4.281 -12.529  10.733
  211    H    GLN  30           HN       GLN  30  -1.975  -9.053   8.798
  212    HA   GLN  30           HA       GLN  30  -1.907  -7.742  11.309
  213    HB2  GLN  30           HB2      GLN  30   0.142  -8.563  10.174
  214    HB3  GLN  30           HB1      GLN  30  -0.096  -7.394   8.876
  215    HG2  GLN  30           HG2      GLN  30   0.206  -5.547  10.514
  216    HG3  GLN  30           HG1      GLN  30   0.490  -6.742  11.784
  217   HE21  GLN  30          HE21      GLN  30   2.586  -5.963  12.186
  218   HE22  GLN  30          HE22      GLN  30   3.898  -6.206  11.091
  219    H    TRP  31           HN       TRP  31  -2.235  -6.515   7.956
  220    HA   TRP  31           HA       TRP  31  -2.329  -3.756   8.556
  221    HB2  TRP  31           HB2      TRP  31  -3.478  -5.251   6.168
  222    HB3  TRP  31           HB1      TRP  31  -3.341  -3.500   6.273
  223    HD1  TRP  31           HD1      TRP  31  -0.183  -4.265   7.694
  224    HE1  TRP  31           HE1      TRP  31   1.668  -4.460   5.917
  225    HE3  TRP  31           HE3      TRP  31  -3.077  -4.853   3.502
  226    HZ2  TRP  31           HZ2      TRP  31   1.881  -4.812   3.129
  227    HZ3  TRP  31           HZ3      TRP  31  -1.974  -5.092   1.330
  228    HH2  TRP  31           HH2      TRP  31   0.453  -5.073   1.143
  229    H    ARG  32           HN       ARG  32  -4.795  -6.204   8.558
  230    HA   ARG  32           HA       ARG  32  -7.106  -4.514   8.486
  231    HB2  ARG  32           HB2      ARG  32  -7.001  -6.977   7.827
  232    HB3  ARG  32           HB1      ARG  32  -6.864  -7.376   9.532
  233    HG2  ARG  32           HG2      ARG  32  -9.090  -6.244   9.873
  234    HG3  ARG  32           HG1      ARG  32  -9.217  -6.101   8.119
  235    HD2  ARG  32           HD2      ARG  32  -8.851  -8.664   8.062
  236    HD3  ARG  32           HD1      ARG  32  -9.170  -8.622   9.799
  237    HE   ARG  32           HE       ARG  32 -11.286  -7.321   8.822
  238   HH11  ARG  32          HH11      ARG  32 -11.388 -11.057   7.316
  239   HH12  ARG  32          HH12      ARG  32  -9.882 -10.388   7.853
  240   HH21  ARG  32          HH21      ARG  32 -13.282  -8.197   8.091
  241   HH22  ARG  32          HH22      ARG  32 -13.319  -9.813   7.452
  242    H    ALA  33           HN       ALA  33  -5.231  -6.171  10.982
  243    HA   ALA  33           HA       ALA  33  -6.769  -5.181  13.202
  244    HB1  ALA  33           HB1      ALA  33  -5.616  -7.345  13.316
  245    HB2  ALA  33           HB2      ALA  33  -5.024  -6.266  14.579
  246    HB3  ALA  33           HB3      ALA  33  -4.054  -6.543  13.130
  247    H    ARG  34           HN       ARG  34  -4.129  -4.036  11.311
  248    HA   ARG  34           HA       ARG  34  -3.017  -2.108  13.152
  249    HB2  ARG  34           HB2      ARG  34  -1.716  -3.215  11.342
  250    HB3  ARG  34           HB1      ARG  34  -2.775  -2.510  10.131
  251    HG2  ARG  34           HG2      ARG  34  -0.827  -1.244  10.044
  252    HG3  ARG  34           HG1      ARG  34  -1.947  -0.235  10.945
  253    HD2  ARG  34           HD2      ARG  34  -0.840  -0.669  13.006
  254    HD3  ARG  34           HD1      ARG  34   0.055  -2.035  12.332
  255    HE   ARG  34           HE       ARG  34   0.964  -0.034  10.818
  256   HH11  ARG  34          HH11      ARG  34   0.687  -0.242  14.319
  257   HH12  ARG  34          HH12      ARG  34   2.030   0.815  14.596
  258   HH21  ARG  34          HH21      ARG  34   2.731   1.307  11.196
  259   HH22  ARG  34          HH22      ARG  34   3.201   1.698  12.816
  260    H    GLY  35           HN       GLY  35  -5.401  -2.223  10.603
  261    HA2  GLY  35           HA2      GLY  35  -7.137  -0.845  10.020
  262    HA3  GLY  35           HA1      GLY  35  -6.688   0.245  11.323
  263    H    ARG  36           HN       ARG  36  -4.110  -0.542   9.248
  264    HA   ARG  36           HA       ARG  36  -4.452   1.544   7.284
  265    HB2  ARG  36           HB2      ARG  36  -3.785   2.864   9.319
  266    HB3  ARG  36           HB1      ARG  36  -2.316   1.915   9.448
  267    HG2  ARG  36           HG2      ARG  36  -1.491   2.812   7.348
  268    HG3  ARG  36           HG1      ARG  36  -3.016   3.656   7.063
  269    HD2  ARG  36           HD2      ARG  36  -1.123   4.216   9.371
  270    HD3  ARG  36           HD1      ARG  36  -1.209   5.153   7.880
  271    HE   ARG  36           HE       ARG  36  -3.368   4.960   9.902
  272   HH11  ARG  36          HH11      ARG  36  -1.782   6.761   7.318
  273   HH12  ARG  36          HH12      ARG  36  -2.778   8.162   7.532
  274   HH21  ARG  36          HH21      ARG  36  -4.671   6.795  10.145
  275   HH22  ARG  36          HH22      ARG  36  -4.415   8.180   9.133
  276    H    VAL  37           HN       VAL  37  -3.065   1.238   5.564
  277    HA   VAL  37           HA       VAL  37  -1.293  -1.111   5.594
  278    HB   VAL  37           HB       VAL  37  -1.152  -0.780   3.115
  279   HG11  VAL  37          HG11      VAL  37  -2.863  -2.255   4.048
  280   HG12  VAL  37          HG12      VAL  37  -3.444  -1.458   2.586
  281   HG13  VAL  37          HG13      VAL  37  -3.990  -0.900   4.170
  282   HG21  VAL  37          HG21      VAL  37  -3.131   1.497   3.548
  283   HG22  VAL  37          HG22      VAL  37  -2.647   0.840   1.983
  284   HG23  VAL  37          HG23      VAL  37  -1.463   1.661   2.997
  285    HA   PRO  38           HA       PRO  38   2.629   1.323   5.176
  286    HB2  PRO  38           HB2      PRO  38   3.104  -0.707   2.961
  287    HB3  PRO  38           HB1      PRO  38   4.191  -0.183   4.267
  288    HG2  PRO  38           HG2      PRO  38   3.002  -2.520   4.451
  289    HG3  PRO  38           HG1      PRO  38   3.099  -1.466   5.886
  290    HD2  PRO  38           HD2      PRO  38   0.753  -1.946   4.052
  291    HD3  PRO  38           HD1      PRO  38   0.795  -1.825   5.825
  292    H    ALA  39           HN       ALA  39   3.802   2.427   3.366
  293    HA   ALA  39           HA       ALA  39   2.062   4.138   2.009
  294    HB1  ALA  39           HB1      ALA  39   4.318   4.780   2.697
  295    HB2  ALA  39           HB2      ALA  39   4.089   5.073   0.974
  296    HB3  ALA  39           HB3      ALA  39   5.024   3.676   1.511
  297    H    GLY  40           HN       GLY  40   1.384   4.271  -0.156
  298    HA2  GLY  40           HA2      GLY  40   1.440   3.924  -2.468
  299    HA3  GLY  40           HA1      GLY  40   2.551   2.585  -2.247
  300    H    ARG  41           HN       ARG  41   0.827   1.232  -0.268
  301    HA   ARG  41           HA       ARG  41  -0.490  -0.413  -2.225
  302    HB2  ARG  41           HB2      ARG  41   0.824  -1.191  -0.146
  303    HB3  ARG  41           HB1      ARG  41  -0.594  -0.763   0.800
  304    HG2  ARG  41           HG2      ARG  41  -0.777  -3.078   0.451
  305    HG3  ARG  41           HG1      ARG  41  -1.909  -2.382  -0.703
  306    HD2  ARG  41           HD2      ARG  41   0.912  -3.273  -1.401
  307    HD3  ARG  41           HD1      ARG  41  -0.519  -4.280  -1.590
  308    HE   ARG  41           HE       ARG  41  -1.052  -1.954  -3.034
  309   HH11  ARG  41          HH11      ARG  41   1.561  -4.433  -4.870
  310   HH12  ARG  41          HH12      ARG  41   1.317  -4.575  -3.161
  311   HH21  ARG  41          HH21      ARG  41  -0.642  -1.779  -5.310
  312   HH22  ARG  41          HH22      ARG  41   0.470  -2.871  -6.068
  313    H    CYS  42           HN       CYS  42  -1.532   2.153  -0.234
  314    HA   CYS  42           HA       CYS  42  -4.205   1.503   0.342
  315    HB2  CYS  42           HB2      CYS  42  -3.119   3.403   1.377
  316    HB3  CYS  42           HB1      CYS  42  -2.954   4.214  -0.179
  317    H    ILE  43           HN       ILE  43  -2.699   2.699  -2.570
  318    HA   ILE  43           HA       ILE  43  -4.743   3.811  -4.061
  319    HB   ILE  43           HB       ILE  43  -2.365   2.097  -4.927
  320   HG12  ILE  43          HG12      ILE  43  -2.719   5.139  -4.896
  321   HG13  ILE  43          HG11      ILE  43  -1.829   4.216  -3.692
  322   HG21  ILE  43          HG21      ILE  43  -4.109   3.836  -6.712
  323   HG22  ILE  43          HG22      ILE  43  -3.995   2.075  -6.755
  324   HG23  ILE  43          HG23      ILE  43  -2.600   3.053  -7.199
  325   HD11  ILE  43          HD11      ILE  43  -0.324   5.289  -5.231
  326   HD12  ILE  43          HD12      ILE  43  -1.114   4.517  -6.603
  327   HD13  ILE  43          HD13      ILE  43  -0.226   3.538  -5.431
  328    H    ASP  44           HN       ASP  44  -3.854   0.392  -3.750
  329    HA   ASP  44           HA       ASP  44  -5.753  -0.554  -5.712
  330    HB2  ASP  44           HB2      ASP  44  -4.270  -2.266  -3.689
  331    HB3  ASP  44           HB1      ASP  44  -4.836  -2.727  -5.289
  332    H    ILE  45           HN       ILE  45  -5.453  -0.706  -2.161
  333    HA   ILE  45           HA       ILE  45  -7.926  -2.016  -1.672
  334    HB   ILE  45           HB       ILE  45  -6.163  -0.308   0.132
  335   HG12  ILE  45          HG12      ILE  45  -6.644  -3.309  -0.173
  336   HG13  ILE  45          HG11      ILE  45  -5.136  -2.432  -0.399
  337   HG21  ILE  45          HG21      ILE  45  -8.633  -1.852   0.992
  338   HG22  ILE  45          HG22      ILE  45  -8.485  -0.094   0.953
  339   HG23  ILE  45          HG23      ILE  45  -7.495  -1.033   2.068
  340   HD11  ILE  45          HD11      ILE  45  -5.124  -1.975   2.058
  341   HD12  ILE  45          HD12      ILE  45  -5.006  -3.678   1.627
  342   HD13  ILE  45          HD13      ILE  45  -6.536  -3.025   2.213
  343    H    GLU  46           HN       GLU  46  -7.171   1.289  -2.427
  344    HA   GLU  46           HA       GLU  46  -9.566   2.549  -1.490
  345    HB2  GLU  46           HB2      GLU  46  -7.445   3.790  -1.904
  346    HB3  GLU  46           HB1      GLU  46  -7.596   3.479  -3.631
  347    HG2  GLU  46           HG2      GLU  46  -9.684   4.791  -3.670
  348    HG3  GLU  46           HG1      GLU  46  -9.514   5.106  -1.941
  349    H    LEU  47           HN       LEU  47  -8.551   1.040  -4.521
  350    HA   LEU  47           HA       LEU  47 -10.791   1.509  -6.155
  351    HB2  LEU  47           HB2      LEU  47  -8.938  -0.889  -5.899
  352    HB3  LEU  47           HB1      LEU  47 -10.195  -0.832  -7.115
  353    HG   LEU  47           HG       LEU  47  -8.120   1.381  -7.004
  354   HD11  LEU  47          HD11      LEU  47  -7.740  -1.270  -8.455
  355   HD12  LEU  47          HD12      LEU  47  -6.813  -0.708  -7.065
  356   HD13  LEU  47          HD13      LEU  47  -6.702   0.154  -8.595
  357   HD21  LEU  47          HD21      LEU  47  -9.769   0.173  -9.250
  358   HD22  LEU  47          HD22      LEU  47  -8.646   1.532  -9.411
  359   HD23  LEU  47          HD23      LEU  47 -10.095   1.702  -8.424
  360    H    TYR  48           HN       TYR  48 -10.206  -0.905  -3.621
  361    HA   TYR  48           HA       TYR  48 -12.825  -2.164  -4.011
  362    HB2  TYR  48           HB2      TYR  48 -10.917  -2.868  -1.763
  363    HB3  TYR  48           HB1      TYR  48 -12.094  -3.907  -2.579
  364    HD1  TYR  48           HD1      TYR  48  -8.909  -4.153  -2.045
  365    HD2  TYR  48           HD2      TYR  48 -11.284  -3.258  -5.487
  366    HE1  TYR  48           HE1      TYR  48  -7.102  -4.939  -3.504
  367    HE2  TYR  48           HE2      TYR  48  -9.468  -4.028  -6.943
  368    HH   TYR  48           HH       TYR  48  -7.059  -4.390  -6.867
  369    H    THR  49           HN       THR  49 -11.625   0.423  -2.164
  370    HA   THR  49           HA       THR  49 -14.058   0.417  -0.442
  371    HB   THR  49           HB       THR  49 -12.832   1.891   1.134
  372    HG1  THR  49           HG1      THR  49 -10.354   1.426  -0.069
  373   HG21  THR  49          HG21      THR  49 -12.675  -0.539   1.499
  374   HG22  THR  49          HG22      THR  49 -11.196   0.276   2.003
  375   HG23  THR  49          HG23      THR  49 -11.236  -0.608   0.478
  376    H    ASP  50           HN       ASP  50 -14.126   1.104  -3.078
  377    HA   ASP  50           HA       ASP  50 -13.633   3.395  -4.292
  378    HB2  ASP  50           HB2      ASP  50 -15.042   1.613  -5.230
  379    HB3  ASP  50           HB1      ASP  50 -16.360   2.054  -4.158
  380    H    GLY  51           HN       GLY  51 -16.480   3.154  -2.172
  381    HA2  GLY  51           HA2      GLY  51 -16.080   5.863  -1.134
  382    HA3  GLY  51           HA1      GLY  51 -17.583   5.585  -2.019
  383    H    ARG  52           HN       ARG  52 -15.913   3.214  -0.020
  384    HA   ARG  52           HA       ARG  52 -18.291   2.871   1.671
  385    HB2  ARG  52           HB2      ARG  52 -15.689   1.282   1.509
  386    HB3  ARG  52           HB1      ARG  52 -17.079   0.842   2.494
  387    HG2  ARG  52           HG2      ARG  52 -17.081   1.007  -0.536
  388    HG3  ARG  52           HG1      ARG  52 -16.908  -0.478   0.404
  389    HD2  ARG  52           HD2      ARG  52 -19.324   1.365   0.435
  390    HD3  ARG  52           HD1      ARG  52 -19.213  -0.177  -0.412
  391    HE   ARG  52           HE       ARG  52 -18.877  -0.095   2.516
  392   HH11  ARG  52          HH11      ARG  52 -20.765  -1.163  -0.250
  393   HH12  ARG  52          HH12      ARG  52 -21.745  -2.243   0.684
  394   HH21  ARG  52          HH21      ARG  52 -20.201  -1.492   3.745
  395   HH22  ARG  52          HH22      ARG  52 -21.423  -2.430   2.953
  396    H    VAL  53           HN       VAL  53 -14.798   3.252   2.066
  397    HA   VAL  53           HA       VAL  53 -15.040   5.040   4.336
  398    HB   VAL  53           HB       VAL  53 -15.031   2.798   5.457
  399   HG11  VAL  53          HG11      VAL  53 -13.896   1.474   3.747
  400   HG12  VAL  53          HG12      VAL  53 -13.102   1.279   5.308
  401   HG13  VAL  53          HG13      VAL  53 -12.375   2.310   4.073
  402   HG21  VAL  53          HG21      VAL  53 -13.952   4.680   6.630
  403   HG22  VAL  53          HG22      VAL  53 -12.409   4.295   5.866
  404   HG23  VAL  53          HG23      VAL  53 -13.136   3.162   7.008
  405    H    GLU  54           HN       GLU  54 -13.110   6.288   4.564
  406    HA   GLU  54           HA       GLU  54 -11.519   6.615   2.240
  407    HB2  GLU  54           HB2      GLU  54 -10.826   7.622   5.035
  408    HB3  GLU  54           HB1      GLU  54 -10.197   8.224   3.509
  409    HG2  GLU  54           HG2      GLU  54 -11.742   9.865   4.082
  410    HG3  GLU  54           HG1      GLU  54 -12.673   8.851   2.983
  411    H    CYS  55           HN       CYS  55  -9.736   5.538   1.630
  412    HA   CYS  55           HA       CYS  55  -8.509   3.550   3.352
  413    HB2  CYS  55           HB2      CYS  55  -8.790   2.904   1.064
  414    HB3  CYS  55           HB1      CYS  55  -8.052   4.392   0.479
  415    H    ARG  56           HN       ARG  56  -6.783   3.922   4.608
  416    HA   ARG  56           HA       ARG  56  -5.134   6.339   4.117
  417    HB2  ARG  56           HB2      ARG  56  -5.568   4.986   6.817
  418    HB3  ARG  56           HB1      ARG  56  -4.614   6.428   6.506
  419    HG2  ARG  56           HG2      ARG  56  -6.531   7.403   7.337
  420    HG3  ARG  56           HG1      ARG  56  -6.923   7.401   5.618
  421    HD2  ARG  56           HD2      ARG  56  -8.181   5.259   5.959
  422    HD3  ARG  56           HD1      ARG  56  -7.858   5.386   7.692
  423    HE   ARG  56           HE       ARG  56  -9.159   7.704   6.576
  424   HH11  ARG  56          HH11      ARG  56 -11.348   4.879   8.419
  425   HH12  ARG  56          HH12      ARG  56  -9.728   4.520   7.938
  426   HH21  ARG  56          HH21      ARG  56 -11.292   8.156   7.164
  427   HH22  ARG  56          HH22      ARG  56 -12.238   6.958   7.978
  428    H    GLU  57           HN       GLU  57  -3.011   6.114   3.978
  429    HA   GLU  57           HA       GLU  57  -1.725   3.506   4.515
  430    HB2  GLU  57           HB2      GLU  57  -0.061   4.095   2.741
  431    HB3  GLU  57           HB1      GLU  57  -1.685   3.853   2.117
  432    HG2  GLU  57           HG2      GLU  57  -2.017   6.208   1.819
  433    HG3  GLU  57           HG1      GLU  57  -0.536   6.592   2.694
  434    H    LEU  58           HN       LEU  58   0.537   3.658   5.011
  435    HA   LEU  58           HA       LEU  58   1.265   5.813   6.789
  436    HB2  LEU  58           HB2      LEU  58   2.642   3.237   5.944
  437    HB3  LEU  58           HB1      LEU  58   3.380   4.376   7.060
  438    HG   LEU  58           HG       LEU  58   0.647   3.193   7.650
  439   HD11  LEU  58          HD11      LEU  58   1.666   1.429   8.986
  440   HD12  LEU  58          HD12      LEU  58   3.275   1.914   8.438
  441   HD13  LEU  58          HD13      LEU  58   2.104   1.271   7.285
  442   HD21  LEU  58          HD21      LEU  58   2.809   4.311   9.462
  443   HD22  LEU  58          HD22      LEU  58   1.246   3.676   9.985
  444   HD23  LEU  58          HD23      LEU  58   1.314   5.124   8.986
  445    H    ARG  59           HN       ARG  59   3.299   6.998   6.505
  446    HA   ARG  59           HA       ARG  59   3.766   7.797   3.761
  447    HB2  ARG  59           HB2      ARG  59   5.173   8.680   6.322
  448    HB3  ARG  59           HB1      ARG  59   5.378   9.401   4.708
  449    HG2  ARG  59           HG2      ARG  59   2.969  10.043   4.718
  450    HG3  ARG  59           HG1      ARG  59   2.806   9.367   6.341
  451    HD2  ARG  59           HD2      ARG  59   4.350  11.000   7.240
  452    HD3  ARG  59           HD1      ARG  59   4.717  11.610   5.625
  453    HE   ARG  59           HE       ARG  59   1.970  11.809   6.680
  454   HH11  ARG  59          HH11      ARG  59   4.909  13.463   5.644
  455   HH12  ARG  59          HH12      ARG  59   4.155  15.021   5.599
  456   HH21  ARG  59          HH21      ARG  59   1.933  15.251   6.133
  457   HH22  ARG  59          HH22      ARG  59   0.990  13.861   6.585
  458    HA   PRO  60           HA       PRO  60   7.143   5.054   2.888
  459    HB2  PRO  60           HB2      PRO  60   8.679   6.493   1.158
  460    HB3  PRO  60           HB1      PRO  60   7.030   5.990   0.727
  461    HG2  PRO  60           HG2      PRO  60   7.960   8.650   1.779
  462    HG3  PRO  60           HG1      PRO  60   6.897   8.291   0.404
  463    HD2  PRO  60           HD2      PRO  60   5.901   9.003   2.849
  464    HD3  PRO  60           HD1      PRO  60   5.048   7.877   1.752
  465    H    ASP  61           HN       ASP  61   9.247   4.554   3.481
  466    HA   ASP  61           HA       ASP  61  10.664   6.297   5.350
  467    HB2  ASP  61           HB2      ASP  61  10.416   3.847   5.808
  468    HB3  ASP  61           HB1      ASP  61  11.326   3.490   4.343
  469    H    VAL  62           HN       VAL  62  12.716   7.216   4.855
  470    HA   VAL  62           HA       VAL  62  13.034   8.211   2.261
  471    HB   VAL  62           HB       VAL  62  15.105   8.157   4.512
  472   HG11  VAL  62          HG11      VAL  62  16.197  10.073   3.357
  473   HG12  VAL  62          HG12      VAL  62  15.077   9.884   2.003
  474   HG13  VAL  62          HG13      VAL  62  16.228   8.604   2.378
  475   HG21  VAL  62          HG21      VAL  62  13.036   9.302   5.183
  476   HG22  VAL  62          HG22      VAL  62  13.102  10.324   3.749
  477   HG23  VAL  62          HG23      VAL  62  14.340  10.475   4.998
  478    H    PHE  63           HN       PHE  63  13.200   6.634   0.697
  479    HA   PHE  63           HA       PHE  63  15.546   4.838   0.674
  480    HB2  PHE  63           HB2      PHE  63  14.345   3.610  -1.140
  481    HB3  PHE  63           HB1      PHE  63  13.411   3.687   0.344
  482    HD1  PHE  63           HD1      PHE  63  13.636   4.975  -3.151
  483    HD2  PHE  63           HD2      PHE  63  11.217   4.764   0.373
  484    HE1  PHE  63           HE1      PHE  63  11.697   5.797  -4.420
  485    HE2  PHE  63           HE2      PHE  63   9.288   5.595  -0.906
  486    HZ   PHE  63           HZ       PHE  63   9.525   6.113  -3.302
  487    H    GLY  64           HN       GLY  64  15.553   7.763   0.176
  488    HA2  GLY  64           HA2      GLY  64  17.101   8.960  -1.140
  489    HA3  GLY  64           HA1      GLY  64  16.887   7.803  -2.449
  490    H    ALA  65           HN       ALA  65  16.598  10.821  -2.151
  491    HA   ALA  65           HA       ALA  65  15.405  12.548  -2.919
  492    HB1  ALA  65           HB1      ALA  65  13.987  12.225  -4.899
  493    HB2  ALA  65           HB2      ALA  65  13.980  10.480  -4.628
  494    HB3  ALA  65           HB3      ALA  65  15.480  11.306  -5.043
  Start of MODEL    5
    1    H1   MET   1           HT1      MET   1 -15.256  -1.411  11.740
    2    H2   MET   1           HT2      MET   1 -15.088   0.061  10.926
    3    H3   MET   1           HT3      MET   1 -13.729  -0.697  11.592
    4    HA   MET   1           HA       MET   1 -13.883  -2.500  10.071
    5    HB2  MET   1           HB2      MET   1 -16.397  -2.453   9.932
    6    HB3  MET   1           HB1      MET   1 -16.293  -1.046   8.887
    7    HG2  MET   1           HG2      MET   1 -15.297  -2.322   7.134
    8    HG3  MET   1           HG1      MET   1 -15.027  -3.703   8.194
    9    HE1  MET   1           HE1      MET   1 -16.385  -4.020   5.317
   10    HE2  MET   1           HE2      MET   1 -17.715  -5.107   5.705
   11    HE3  MET   1           HE3      MET   1 -16.127  -5.365   6.427
   12    H    ASN   2           HN       ASN   2 -11.928  -1.792   9.411
   13    HA   ASN   2           HA       ASN   2 -11.497   0.830   8.260
   14    HB2  ASN   2           HB2      ASN   2  -9.073   0.193   8.314
   15    HB3  ASN   2           HB1      ASN   2  -9.876   0.070   9.872
   16   HD21  ASN   2          HD21      ASN   2  -8.657  -1.430  10.842
   17   HD22  ASN   2          HD22      ASN   2  -8.391  -3.037  10.268
   18    H    ALA   3           HN       ALA   3 -10.051   1.046   6.388
   19    HA   ALA   3           HA       ALA   3 -11.238   0.349   4.032
   20    HB1  ALA   3           HB1      ALA   3  -9.612   2.193   4.274
   21    HB2  ALA   3           HB2      ALA   3  -9.203   1.150   2.908
   22    HB3  ALA   3           HB3      ALA   3  -8.303   1.019   4.420
   23    H    ILE   4           HN       ILE   4  -8.637  -1.339   5.684
   24    HA   ILE   4           HA       ILE   4  -7.867  -3.100   3.597
   25    HB   ILE   4           HB       ILE   4  -7.567  -3.591   6.591
   26   HG12  ILE   4          HG12      ILE   4  -5.142  -2.684   6.150
   27   HG13  ILE   4          HG11      ILE   4  -5.844  -1.913   4.738
   28   HG21  ILE   4          HG21      ILE   4  -5.688  -5.037   5.986
   29   HG22  ILE   4          HG22      ILE   4  -5.954  -4.704   4.276
   30   HG23  ILE   4          HG23      ILE   4  -7.170  -5.588   5.203
   31   HD11  ILE   4          HD11      ILE   4  -5.682  -0.349   6.567
   32   HD12  ILE   4          HD12      ILE   4  -6.587  -1.427   7.626
   33   HD13  ILE   4          HD13      ILE   4  -7.390  -0.673   6.247
   34    H    ASP   5           HN       ASP   5 -10.018  -3.348   6.371
   35    HA   ASP   5           HA       ASP   5 -10.709  -6.079   6.106
   36    HB2  ASP   5           HB2      ASP   5 -10.865  -4.862   8.268
   37    HB3  ASP   5           HB1      ASP   5 -12.182  -3.877   7.629
   38    H    ILE   6           HN       ILE   6 -12.299  -3.065   5.106
   39    HA   ILE   6           HA       ILE   6 -14.667  -4.159   4.054
   40    HB   ILE   6           HB       ILE   6 -13.166  -1.616   3.247
   41   HG12  ILE   6          HG12      ILE   6 -15.603  -2.048   5.035
   42   HG13  ILE   6          HG11      ILE   6 -13.989  -1.624   5.580
   43   HG21  ILE   6          HG21      ILE   6 -15.261  -0.878   2.130
   44   HG22  ILE   6          HG22      ILE   6 -15.986  -2.455   2.439
   45   HG23  ILE   6          HG23      ILE   6 -14.596  -2.319   1.361
   46   HD11  ILE   6          HD11      ILE   6 -15.440   0.284   5.656
   47   HD12  ILE   6          HD12      ILE   6 -15.832   0.110   3.947
   48   HD13  ILE   6          HD13      ILE   6 -14.192   0.537   4.439
   49    H    ALA   7           HN       ALA   7 -11.450  -3.621   2.626
   50    HA   ALA   7           HA       ALA   7 -12.059  -4.488  -0.007
   51    HB1  ALA   7           HB1      ALA   7  -9.366  -4.525   1.398
   52    HB2  ALA   7           HB2      ALA   7 -10.071  -3.141   0.558
   53    HB3  ALA   7           HB3      ALA   7  -9.652  -4.595  -0.350
   54    H    ILE   8           HN       ILE   8 -11.052  -6.260   2.890
   55    HA   ILE   8           HA       ILE   8 -10.595  -8.828   1.823
   56    HB   ILE   8           HB       ILE   8 -11.741  -8.011   4.542
   57   HG12  ILE   8          HG12      ILE   8  -8.906  -8.880   3.822
   58   HG13  ILE   8          HG11      ILE   8  -9.412  -7.206   3.967
   59   HG21  ILE   8          HG21      ILE   8 -11.119 -10.278   5.350
   60   HG22  ILE   8          HG22      ILE   8 -10.734 -10.749   3.694
   61   HG23  ILE   8          HG23      ILE   8 -12.392 -10.325   4.126
   62   HD11  ILE   8          HD11      ILE   8  -9.307  -9.252   6.168
   63   HD12  ILE   8          HD12      ILE   8  -9.931  -7.612   6.347
   64   HD13  ILE   8          HD13      ILE   8  -8.238  -7.869   5.932
   65    H    ASN   9           HN       ASN   9 -13.583  -7.367   3.114
   66    HA   ASN   9           HA       ASN   9 -15.268  -9.594   2.485
   67    HB2  ASN   9           HB2      ASN   9 -16.013  -6.707   3.149
   68    HB3  ASN   9           HB1      ASN   9 -17.148  -8.046   3.077
   69   HD21  ASN   9          HD21      ASN   9 -14.753  -6.471   4.980
   70   HD22  ASN   9          HD22      ASN   9 -14.911  -7.446   6.390
   71    H    LYS  10           HN       LYS  10 -14.263  -6.733   0.751
   72    HA   LYS  10           HA       LYS  10 -16.440  -6.564  -1.097
   73    HB2  LYS  10           HB2      LYS  10 -14.806  -4.698  -0.336
   74    HB3  LYS  10           HB1      LYS  10 -13.652  -5.335  -1.498
   75    HG2  LYS  10           HG2      LYS  10 -16.439  -4.478  -2.340
   76    HG3  LYS  10           HG1      LYS  10 -15.134  -3.308  -2.164
   77    HD2  LYS  10           HD2      LYS  10 -13.794  -4.578  -3.838
   78    HD3  LYS  10           HD1      LYS  10 -15.144  -5.703  -4.039
   79    HE2  LYS  10           HE2      LYS  10 -16.572  -3.811  -4.798
   80    HE3  LYS  10           HE1      LYS  10 -15.183  -2.730  -4.672
   81    HZ1  LYS  10           HZ1      LYS  10 -15.427  -5.078  -6.483
   82    HZ2  LYS  10           HZ2      LYS  10 -14.041  -4.126  -6.321
   83    HZ3  LYS  10           HZ3      LYS  10 -15.459  -3.447  -6.936
   84    H    LEU  11           HN       LEU  11 -13.154  -7.916  -1.238
   85    HA   LEU  11           HA       LEU  11 -13.570  -9.029  -3.893
   86    HB2  LEU  11           HB2      LEU  11 -11.287  -9.551  -1.944
   87    HB3  LEU  11           HB1      LEU  11 -11.346 -10.046  -3.625
   88    HG   LEU  11           HG       LEU  11 -10.779  -7.329  -2.459
   89   HD11  LEU  11          HD11      LEU  11  -9.050  -7.263  -4.212
   90   HD12  LEU  11          HD12      LEU  11  -9.603  -8.825  -4.821
   91   HD13  LEU  11          HD13      LEU  11  -8.913  -8.702  -3.204
   92   HD21  LEU  11          HD21      LEU  11 -12.704  -6.799  -3.849
   93   HD22  LEU  11          HD22      LEU  11 -11.979  -7.629  -5.229
   94   HD23  LEU  11          HD23      LEU  11 -11.228  -6.171  -4.574
   95    H    GLY  12           HN       GLY  12 -13.917 -10.041  -0.565
   96    HA2  GLY  12           HA2      GLY  12 -15.573 -11.759  -0.120
   97    HA3  GLY  12           HA1      GLY  12 -14.936 -12.687  -1.471
   98    H    SER  13           HN       SER  13 -12.115 -12.175  -0.778
   99    HA   SER  13           HA       SER  13 -11.770 -13.557   1.794
  100    HB2  SER  13           HB2      SER  13 -10.330 -15.312   0.733
  101    HB3  SER  13           HB1      SER  13 -11.992 -15.386   0.151
  102    HG   SER  13           HG       SER  13 -10.563 -15.526  -1.583
  103    H    VAL  14           HN       VAL  14  -9.611 -13.626   2.534
  104    HA   VAL  14           HA       VAL  14  -7.960 -11.337   1.959
  105    HB   VAL  14           HB       VAL  14  -7.829 -13.649   3.940
  106   HG11  VAL  14          HG11      VAL  14  -5.617 -11.602   3.599
  107   HG12  VAL  14          HG12      VAL  14  -5.482 -13.333   3.303
  108   HG13  VAL  14          HG13      VAL  14  -5.763 -12.740   4.939
  109   HG21  VAL  14          HG21      VAL  14  -7.976 -10.636   4.247
  110   HG22  VAL  14          HG22      VAL  14  -7.905 -11.789   5.595
  111   HG23  VAL  14          HG23      VAL  14  -9.290 -11.793   4.503
  112    H    SER  15           HN       SER  15  -8.063 -14.703   1.046
  113    HA   SER  15           HA       SER  15  -5.391 -15.015   0.162
  114    HB2  SER  15           HB2      SER  15  -6.327 -16.998  -1.078
  115    HB3  SER  15           HB1      SER  15  -6.785 -16.948   0.627
  116    HG   SER  15           HG       SER  15  -8.365 -16.902  -1.575
  117    H    ALA  16           HN       ALA  16  -8.400 -14.112  -1.545
  118    HA   ALA  16           HA       ALA  16  -7.174 -13.613  -4.093
  119    HB1  ALA  16           HB1      ALA  16  -9.570 -14.151  -3.882
  120    HB2  ALA  16           HB2      ALA  16  -9.335 -12.607  -4.705
  121    HB3  ALA  16           HB3      ALA  16  -9.843 -12.638  -3.014
  122    H    LEU  17           HN       LEU  17  -7.891 -11.643  -1.233
  123    HA   LEU  17           HA       LEU  17  -7.456  -9.094  -2.392
  124    HB2  LEU  17           HB2      LEU  17  -8.660  -9.401  -0.237
  125    HB3  LEU  17           HB1      LEU  17  -7.163  -9.925   0.523
  126    HG   LEU  17           HG       LEU  17  -6.173  -7.695   0.120
  127   HD11  LEU  17          HD11      LEU  17  -7.558  -5.796  -0.591
  128   HD12  LEU  17          HD12      LEU  17  -8.906  -6.887  -0.918
  129   HD13  LEU  17          HD13      LEU  17  -7.420  -7.005  -1.866
  130   HD21  LEU  17          HD21      LEU  17  -8.772  -7.537   1.630
  131   HD22  LEU  17          HD22      LEU  17  -7.389  -6.446   1.791
  132   HD23  LEU  17          HD23      LEU  17  -7.232  -8.143   2.249
  133    H    ALA  18           HN       ALA  18  -5.330 -11.257  -0.568
  134    HA   ALA  18           HA       ALA  18  -3.071  -9.567  -0.418
  135    HB1  ALA  18           HB1      ALA  18  -1.887 -11.586   0.310
  136    HB2  ALA  18           HB2      ALA  18  -3.225 -12.596  -0.252
  137    HB3  ALA  18           HB3      ALA  18  -3.467 -11.465   1.084
  138    H    ALA  19           HN       ALA  19  -4.095 -11.992  -2.777
  139    HA   ALA  19           HA       ALA  19  -1.825 -12.018  -4.460
  140    HB1  ALA  19           HB1      ALA  19  -3.355 -12.880  -6.181
  141    HB2  ALA  19           HB2      ALA  19  -4.747 -12.391  -5.206
  142    HB3  ALA  19           HB3      ALA  19  -3.657 -13.651  -4.625
  143    H    ALA  20           HN       ALA  20  -4.724  -9.987  -4.430
  144    HA   ALA  20           HA       ALA  20  -4.138  -8.454  -6.765
  145    HB1  ALA  20           HB1      ALA  20  -6.031  -7.838  -4.466
  146    HB2  ALA  20           HB2      ALA  20  -6.427  -8.766  -5.911
  147    HB3  ALA  20           HB3      ALA  20  -6.033  -7.056  -6.054
  148    H    LEU  21           HN       LEU  21  -3.223  -8.159  -3.412
  149    HA   LEU  21           HA       LEU  21  -2.217  -5.405  -3.730
  150    HB2  LEU  21           HB2      LEU  21  -2.441  -7.197  -1.270
  151    HB3  LEU  21           HB1      LEU  21  -1.863  -5.535  -1.252
  152    HG   LEU  21           HG       LEU  21  -4.673  -6.396  -2.050
  153   HD11  LEU  21          HD11      LEU  21  -3.694  -5.082   0.495
  154   HD12  LEU  21          HD12      LEU  21  -4.439  -6.675   0.309
  155   HD13  LEU  21          HD13      LEU  21  -5.393  -5.223   0.020
  156   HD21  LEU  21          HD21      LEU  21  -3.507  -3.622  -1.774
  157   HD22  LEU  21          HD22      LEU  21  -5.210  -4.004  -2.063
  158   HD23  LEU  21          HD23      LEU  21  -3.997  -4.421  -3.269
  159    H    GLY  22           HN       GLY  22  -1.097  -8.578  -4.001
  160    HA2  GLY  22           HA2      GLY  22   0.971  -9.391  -4.589
  161    HA3  GLY  22           HA1      GLY  22   1.594  -7.754  -4.555
  162    H    VAL  23           HN       VAL  23   0.023  -9.053  -1.758
  163    HA   VAL  23           HA       VAL  23   2.601  -9.517  -0.356
  164    HB   VAL  23           HB       VAL  23   1.469  -8.824   1.748
  165   HG11  VAL  23          HG11      VAL  23   2.736  -7.120   0.512
  166   HG12  VAL  23          HG12      VAL  23   1.349  -6.397   1.327
  167   HG13  VAL  23          HG13      VAL  23   1.294  -6.690  -0.414
  168   HG21  VAL  23          HG21      VAL  23  -0.906  -8.095  -0.017
  169   HG22  VAL  23          HG22      VAL  23  -0.756  -7.717   1.701
  170   HG23  VAL  23          HG23      VAL  23  -0.858  -9.396   1.175
  171    H    ASN  24           HN       ASN  24   2.101 -10.928   1.739
  172    HA   ASN  24           HA       ASN  24   0.616 -13.307   0.905
  173    HB2  ASN  24           HB2      ASN  24   1.583 -14.422   2.857
  174    HB3  ASN  24           HB1      ASN  24   2.842 -13.647   1.920
  175   HD21  ASN  24          HD21      ASN  24   2.966 -14.493   4.660
  176   HD22  ASN  24          HD22      ASN  24   3.292 -13.082   5.602
  177    H    GLN  25           HN       GLN  25  -0.754 -14.359   2.572
  178    HA   GLN  25           HA       GLN  25  -2.967 -12.706   3.191
  179    HB2  GLN  25           HB2      GLN  25  -2.324 -15.593   3.925
  180    HB3  GLN  25           HB1      GLN  25  -3.814 -14.816   4.448
  181    HG2  GLN  25           HG2      GLN  25  -4.240 -16.142   2.478
  182    HG3  GLN  25           HG1      GLN  25  -4.451 -14.440   2.102
  183   HE21  GLN  25          HE21      GLN  25  -1.393 -16.224   2.273
  184   HE22  GLN  25          HE22      GLN  25  -0.988 -16.023   0.607
  185    H    SER  26           HN       SER  26  -0.315 -13.969   5.116
  186    HA   SER  26           HA       SER  26  -1.186 -13.296   7.694
  187    HB2  SER  26           HB2      SER  26   1.687 -13.403   6.688
  188    HB3  SER  26           HB1      SER  26   1.157 -13.576   8.360
  189    HG   SER  26           HG       SER  26  -0.077 -15.450   7.554
  190    H    ALA  27           HN       ALA  27   0.368 -11.311   5.189
  191    HA   ALA  27           HA       ALA  27   0.938  -9.021   6.780
  192    HB1  ALA  27           HB1      ALA  27   1.109  -7.785   4.660
  193    HB2  ALA  27           HB2      ALA  27   0.366  -9.136   3.795
  194    HB3  ALA  27           HB3      ALA  27   1.943  -9.335   4.560
  195    H    ILE  28           HN       ILE  28  -1.918 -10.009   4.921
  196    HA   ILE  28           HA       ILE  28  -3.372  -7.579   5.115
  197    HB   ILE  28           HB       ILE  28  -4.469 -10.407   4.754
  198   HG12  ILE  28          HG12      ILE  28  -2.755  -9.828   3.034
  199   HG13  ILE  28          HG11      ILE  28  -4.360 -10.023   2.340
  200   HG21  ILE  28          HG21      ILE  28  -6.383  -9.302   3.641
  201   HG22  ILE  28          HG22      ILE  28  -5.712  -7.723   4.052
  202   HG23  ILE  28          HG23      ILE  28  -6.242  -8.817   5.333
  203   HD11  ILE  28          HD11      ILE  28  -4.609  -7.582   2.260
  204   HD12  ILE  28          HD12      ILE  28  -3.221  -8.161   1.345
  205   HD13  ILE  28          HD13      ILE  28  -2.979  -7.410   2.919
  206    H    SER  29           HN       SER  29  -3.387 -10.536   7.101
  207    HA   SER  29           HA       SER  29  -5.465  -9.755   8.864
  208    HB2  SER  29           HB2      SER  29  -4.348 -11.564  10.359
  209    HB3  SER  29           HB1      SER  29  -4.989 -12.056   8.790
  210    HG   SER  29           HG       SER  29  -2.281 -11.531   9.457
  211    H    GLN  30           HN       GLN  30  -1.984  -9.146   8.865
  212    HA   GLN  30           HA       GLN  30  -1.845  -7.837  11.402
  213    HB2  GLN  30           HB2      GLN  30  -0.104  -7.549   8.916
  214    HB3  GLN  30           HB1      GLN  30   0.262  -6.781  10.457
  215    HG2  GLN  30           HG2      GLN  30   0.554  -8.957  11.526
  216    HG3  GLN  30           HG1      GLN  30   0.052  -9.781  10.049
  217   HE21  GLN  30          HE21      GLN  30   1.499  -9.828   8.283
  218   HE22  GLN  30          HE22      GLN  30   3.181  -9.494   8.466
  219    H    TRP  31           HN       TRP  31  -2.531  -6.734   8.091
  220    HA   TRP  31           HA       TRP  31  -2.491  -3.936   8.623
  221    HB2  TRP  31           HB2      TRP  31  -3.700  -5.549   6.338
  222    HB3  TRP  31           HB1      TRP  31  -3.698  -3.790   6.377
  223    HD1  TRP  31           HD1      TRP  31  -0.433  -4.553   7.726
  224    HE1  TRP  31           HE1      TRP  31   1.369  -4.558   5.896
  225    HE3  TRP  31           HE3      TRP  31  -3.426  -4.828   3.573
  226    HZ2  TRP  31           HZ2      TRP  31   1.520  -4.651   3.106
  227    HZ3  TRP  31           HZ3      TRP  31  -2.362  -4.855   1.364
  228    HH2  TRP  31           HH2      TRP  31   0.059  -4.771   1.136
  229    H    ARG  32           HN       ARG  32  -5.059  -6.355   8.694
  230    HA   ARG  32           HA       ARG  32  -7.286  -4.604   9.017
  231    HB2  ARG  32           HB2      ARG  32  -7.639  -6.946   8.338
  232    HB3  ARG  32           HB1      ARG  32  -6.890  -7.530   9.819
  233    HG2  ARG  32           HG2      ARG  32  -8.816  -6.272  11.044
  234    HG3  ARG  32           HG1      ARG  32  -9.597  -6.213   9.467
  235    HD2  ARG  32           HD2      ARG  32  -8.658  -8.811  10.702
  236    HD3  ARG  32           HD1      ARG  32 -10.239  -8.128  11.067
  237    HE   ARG  32           HE       ARG  32 -10.534  -8.218   8.516
  238   HH11  ARG  32          HH11      ARG  32  -9.070 -11.902   9.223
  239   HH12  ARG  32          HH12      ARG  32  -8.722 -10.620  10.343
  240   HH21  ARG  32          HH21      ARG  32 -11.046  -9.920   7.104
  241   HH22  ARG  32          HH22      ARG  32 -10.386 -11.498   7.391
  242    H    ALA  33           HN       ALA  33  -5.070  -6.289  11.223
  243    HA   ALA  33           HA       ALA  33  -6.438  -5.350  13.585
  244    HB1  ALA  33           HB1      ALA  33  -5.379  -7.571  13.550
  245    HB2  ALA  33           HB2      ALA  33  -4.675  -6.568  14.817
  246    HB3  ALA  33           HB3      ALA  33  -3.791  -6.837  13.312
  247    H    ARG  34           HN       ARG  34  -4.026  -4.090  11.529
  248    HA   ARG  34           HA       ARG  34  -2.751  -2.288  13.436
  249    HB2  ARG  34           HB2      ARG  34  -1.529  -3.293  11.521
  250    HB3  ARG  34           HB1      ARG  34  -2.658  -2.566  10.388
  251    HG2  ARG  34           HG2      ARG  34  -0.696  -1.274  10.285
  252    HG3  ARG  34           HG1      ARG  34  -1.843  -0.304  11.196
  253    HD2  ARG  34           HD2      ARG  34  -0.738  -0.859  13.286
  254    HD3  ARG  34           HD1      ARG  34   0.316  -2.020  12.473
  255    HE   ARG  34           HE       ARG  34   0.463   0.764  11.604
  256   HH11  ARG  34          HH11      ARG  34   3.484  -0.982  13.619
  257   HH12  ARG  34          HH12      ARG  34   1.950  -1.782  13.521
  258   HH21  ARG  34          HH21      ARG  34   2.493   1.788  11.709
  259   HH22  ARG  34          HH22      ARG  34   3.787   1.048  12.588
  260    H    GLY  35           HN       GLY  35  -5.223  -2.278  10.949
  261    HA2  GLY  35           HA2      GLY  35  -6.993  -0.826  10.590
  262    HA3  GLY  35           HA1      GLY  35  -6.342   0.272  11.797
  263    H    ARG  36           HN       ARG  36  -4.013  -0.711   9.496
  264    HA   ARG  36           HA       ARG  36  -4.435   1.325   7.515
  265    HB2  ARG  36           HB2      ARG  36  -3.693   2.622   9.595
  266    HB3  ARG  36           HB1      ARG  36  -2.133   1.830   9.463
  267    HG2  ARG  36           HG2      ARG  36  -1.491   3.078   7.611
  268    HG3  ARG  36           HG1      ARG  36  -3.152   3.299   7.035
  269    HD2  ARG  36           HD2      ARG  36  -1.824   4.737   9.364
  270    HD3  ARG  36           HD1      ARG  36  -2.308   5.432   7.810
  271    HE   ARG  36           HE       ARG  36  -4.473   4.226   9.338
  272   HH11  ARG  36          HH11      ARG  36  -2.748   7.249   8.755
  273   HH12  ARG  36          HH12      ARG  36  -4.047   8.235   9.345
  274   HH21  ARG  36          HH21      ARG  36  -6.145   5.532  10.142
  275   HH22  ARG  36          HH22      ARG  36  -5.976   7.251  10.129
  276    H    VAL  37           HN       VAL  37  -2.854   1.241   5.829
  277    HA   VAL  37           HA       VAL  37  -1.143  -1.173   5.831
  278    HB   VAL  37           HB       VAL  37  -1.110  -1.002   3.369
  279   HG11  VAL  37          HG11      VAL  37  -3.445  -1.576   2.928
  280   HG12  VAL  37          HG12      VAL  37  -3.936  -0.865   4.468
  281   HG13  VAL  37          HG13      VAL  37  -2.897  -2.293   4.442
  282   HG21  VAL  37          HG21      VAL  37  -2.944   1.413   3.673
  283   HG22  VAL  37          HG22      VAL  37  -2.541   0.611   2.150
  284   HG23  VAL  37          HG23      VAL  37  -1.283   1.430   3.074
  285    HA   PRO  38           HA       PRO  38   2.735   1.238   5.540
  286    HB2  PRO  38           HB2      PRO  38   3.426  -0.874   3.473
  287    HB3  PRO  38           HB1      PRO  38   4.366  -0.316   4.877
  288    HG2  PRO  38           HG2      PRO  38   3.133  -2.642   4.986
  289    HG3  PRO  38           HG1      PRO  38   3.089  -1.559   6.400
  290    HD2  PRO  38           HD2      PRO  38   0.948  -2.046   4.328
  291    HD3  PRO  38           HD1      PRO  38   0.801  -1.903   6.094
  292    H    ALA  39           HN       ALA  39   4.101   2.221   3.795
  293    HA   ALA  39           HA       ALA  39   2.500   3.910   2.224
  294    HB1  ALA  39           HB1      ALA  39   4.635   4.607   3.164
  295    HB2  ALA  39           HB2      ALA  39   4.636   4.842   1.414
  296    HB3  ALA  39           HB3      ALA  39   5.504   3.475   2.121
  297    H    GLY  40           HN       GLY  40   1.824   3.795   0.122
  298    HA2  GLY  40           HA2      GLY  40   1.795   3.346  -2.139
  299    HA3  GLY  40           HA1      GLY  40   3.275   2.421  -1.976
  300    H    ARG  41           HN       ARG  41  -0.115   2.153  -0.817
  301    HA   ARG  41           HA       ARG  41  -0.556  -0.251  -2.329
  302    HB2  ARG  41           HB2      ARG  41   0.702  -0.999  -0.180
  303    HB3  ARG  41           HB1      ARG  41  -0.757  -0.567   0.700
  304    HG2  ARG  41           HG2      ARG  41  -0.890  -2.905   0.344
  305    HG3  ARG  41           HG1      ARG  41  -2.014  -2.198  -0.818
  306    HD2  ARG  41           HD2      ARG  41   0.808  -3.144  -1.426
  307    HD3  ARG  41           HD1      ARG  41  -0.671  -4.030  -1.793
  308    HE   ARG  41           HE       ARG  41  -1.195  -1.908  -3.208
  309   HH11  ARG  41          HH11      ARG  41   2.004  -3.383  -2.862
  310   HH12  ARG  41          HH12      ARG  41   2.554  -2.829  -4.413
  311   HH21  ARG  41          HH21      ARG  41   1.181  -1.591  -5.750
  312   HH22  ARG  41          HH22      ARG  41  -0.427  -1.187  -5.241
  313    H    CYS  42           HN       CYS  42  -1.683   2.295  -0.302
  314    HA   CYS  42           HA       CYS  42  -4.319   1.527   0.214
  315    HB2  CYS  42           HB2      CYS  42  -3.363   3.362   1.406
  316    HB3  CYS  42           HB1      CYS  42  -3.087   4.269  -0.075
  317    H    ILE  43           HN       ILE  43  -2.913   2.938  -2.713
  318    HA   ILE  43           HA       ILE  43  -5.134   3.817  -4.130
  319    HB   ILE  43           HB       ILE  43  -2.564   2.438  -5.028
  320   HG12  ILE  43          HG12      ILE  43  -3.562   5.305  -5.383
  321   HG13  ILE  43          HG11      ILE  43  -2.423   4.770  -4.156
  322   HG21  ILE  43          HG21      ILE  43  -4.707   3.476  -6.922
  323   HG22  ILE  43          HG22      ILE  43  -4.179   1.802  -6.749
  324   HG23  ILE  43          HG23      ILE  43  -3.073   3.009  -7.399
  325   HD11  ILE  43          HD11      ILE  43  -1.967   4.790  -7.137
  326   HD12  ILE  43          HD12      ILE  43  -0.828   4.170  -5.938
  327   HD13  ILE  43          HD13      ILE  43  -1.265   5.877  -5.939
  328    H    ASP  44           HN       ASP  44  -3.925   0.499  -3.760
  329    HA   ASP  44           HA       ASP  44  -5.773  -0.668  -5.627
  330    HB2  ASP  44           HB2      ASP  44  -4.111  -2.109  -3.534
  331    HB3  ASP  44           HB1      ASP  44  -4.784  -2.791  -5.013
  332    H    ILE  45           HN       ILE  45  -5.492  -0.690  -2.077
  333    HA   ILE  45           HA       ILE  45  -7.914  -2.078  -1.559
  334    HB   ILE  45           HB       ILE  45  -6.185  -0.269   0.185
  335   HG12  ILE  45          HG12      ILE  45  -6.691  -3.278   0.072
  336   HG13  ILE  45          HG11      ILE  45  -5.184  -2.431  -0.255
  337   HG21  ILE  45          HG21      ILE  45  -8.657  -1.756   1.127
  338   HG22  ILE  45          HG22      ILE  45  -8.503  -0.000   0.996
  339   HG23  ILE  45          HG23      ILE  45  -7.512  -0.889   2.152
  340   HD11  ILE  45          HD11      ILE  45  -5.019  -3.546   1.844
  341   HD12  ILE  45          HD12      ILE  45  -6.513  -2.815   2.431
  342   HD13  ILE  45          HD13      ILE  45  -5.084  -1.813   2.153
  343    H    GLU  46           HN       GLU  46  -7.237   1.258  -2.363
  344    HA   GLU  46           HA       GLU  46  -9.733   2.413  -1.541
  345    HB2  GLU  46           HB2      GLU  46  -7.574   3.706  -2.014
  346    HB3  GLU  46           HB1      GLU  46  -7.870   3.452  -3.730
  347    HG2  GLU  46           HG2      GLU  46 -10.138   4.611  -3.339
  348    HG3  GLU  46           HG1      GLU  46  -9.494   5.095  -1.769
  349    H    LEU  47           HN       LEU  47  -8.552   0.846  -4.496
  350    HA   LEU  47           HA       LEU  47 -10.748   1.205  -6.204
  351    HB2  LEU  47           HB2      LEU  47  -9.030  -1.283  -5.814
  352    HB3  LEU  47           HB1      LEU  47 -10.118  -1.048  -7.167
  353    HG   LEU  47           HG       LEU  47  -7.763   0.814  -6.641
  354   HD11  LEU  47          HD11      LEU  47  -7.807  -1.617  -8.472
  355   HD12  LEU  47          HD12      LEU  47  -6.892  -1.475  -6.970
  356   HD13  LEU  47          HD13      LEU  47  -6.504  -0.432  -8.333
  357   HD21  LEU  47          HD21      LEU  47  -9.436   0.274  -9.103
  358   HD22  LEU  47          HD22      LEU  47  -8.078   1.401  -8.997
  359   HD23  LEU  47          HD23      LEU  47  -9.544   1.703  -8.069
  360    H    TYR  48           HN       TYR  48 -10.189  -1.075  -3.558
  361    HA   TYR  48           HA       TYR  48 -12.831  -2.336  -3.880
  362    HB2  TYR  48           HB2      TYR  48 -10.861  -3.124  -1.724
  363    HB3  TYR  48           HB1      TYR  48 -12.032  -4.132  -2.585
  364    HD1  TYR  48           HD1      TYR  48  -8.828  -4.332  -2.046
  365    HD2  TYR  48           HD2      TYR  48 -11.242  -3.425  -5.458
  366    HE1  TYR  48           HE1      TYR  48  -7.016  -5.073  -3.531
  367    HE2  TYR  48           HE2      TYR  48  -9.426  -4.141  -6.940
  368    HH   TYR  48           HH       TYR  48  -7.029  -4.448  -6.888
  369    H    THR  49           HN       THR  49 -11.860   0.411  -2.408
  370    HA   THR  49           HA       THR  49 -14.174   0.338  -0.552
  371    HB   THR  49           HB       THR  49 -12.994   1.803   1.064
  372    HG1  THR  49           HG1      THR  49 -10.546   1.332  -0.259
  373   HG21  THR  49          HG21      THR  49 -11.398   0.205   2.022
  374   HG22  THR  49          HG22      THR  49 -11.363  -0.695   0.507
  375   HG23  THR  49          HG23      THR  49 -12.846  -0.628   1.458
  376    H    ASP  50           HN       ASP  50 -14.223   1.120  -3.208
  377    HA   ASP  50           HA       ASP  50 -13.152   3.603  -3.892
  378    HB2  ASP  50           HB2      ASP  50 -14.474   3.494  -5.952
  379    HB3  ASP  50           HB1      ASP  50 -13.816   1.911  -5.564
  380    H    GLY  51           HN       GLY  51 -16.231   2.938  -2.375
  381    HA2  GLY  51           HA2      GLY  51 -16.549   5.801  -1.782
  382    HA3  GLY  51           HA1      GLY  51 -17.891   4.996  -2.592
  383    H    ARG  52           HN       ARG  52 -15.879   3.267  -0.362
  384    HA   ARG  52           HA       ARG  52 -18.128   2.882   1.491
  385    HB2  ARG  52           HB2      ARG  52 -15.460   1.417   1.306
  386    HB3  ARG  52           HB1      ARG  52 -16.794   0.979   2.366
  387    HG2  ARG  52           HG2      ARG  52 -16.888   0.935  -0.665
  388    HG3  ARG  52           HG1      ARG  52 -16.617  -0.470   0.360
  389    HD2  ARG  52           HD2      ARG  52 -18.912  -0.505  -0.315
  390    HD3  ARG  52           HD1      ARG  52 -18.886  -0.050   1.390
  391    HE   ARG  52           HE       ARG  52 -19.050   2.053  -0.676
  392   HH11  ARG  52          HH11      ARG  52 -21.947   1.479   2.068
  393   HH12  ARG  52          HH12      ARG  52 -20.666   0.316   1.925
  394   HH21  ARG  52          HH21      ARG  52 -20.704   3.626  -0.410
  395   HH22  ARG  52          HH22      ARG  52 -21.964   3.345   0.749
  396    H    VAL  53           HN       VAL  53 -14.656   3.642   1.577
  397    HA   VAL  53           HA       VAL  53 -14.978   5.469   3.829
  398    HB   VAL  53           HB       VAL  53 -14.615   3.192   4.895
  399   HG11  VAL  53          HG11      VAL  53 -13.194   2.175   3.177
  400   HG12  VAL  53          HG12      VAL  53 -12.425   2.098   4.761
  401   HG13  VAL  53          HG13      VAL  53 -11.884   3.290   3.577
  402   HG21  VAL  53          HG21      VAL  53 -13.954   5.211   6.118
  403   HG22  VAL  53          HG22      VAL  53 -12.362   5.180   5.359
  404   HG23  VAL  53          HG23      VAL  53 -12.836   3.889   6.467
  405    H    GLU  54           HN       GLU  54 -13.170   6.933   3.954
  406    HA   GLU  54           HA       GLU  54 -11.485   7.210   1.662
  407    HB2  GLU  54           HB2      GLU  54 -12.192   9.136   3.064
  408    HB3  GLU  54           HB1      GLU  54 -11.267   8.495   4.415
  409    HG2  GLU  54           HG2      GLU  54 -10.083  10.334   3.338
  410    HG3  GLU  54           HG1      GLU  54  -9.179   8.833   3.180
  411    H    CYS  55           HN       CYS  55 -10.107   5.576   1.286
  412    HA   CYS  55           HA       CYS  55  -8.823   3.937   3.181
  413    HB2  CYS  55           HB2      CYS  55  -9.035   3.085   0.964
  414    HB3  CYS  55           HB1      CYS  55  -8.242   4.487   0.257
  415    H    ARG  56           HN       ARG  56  -6.688   3.913   3.987
  416    HA   ARG  56           HA       ARG  56  -5.168   6.441   3.823
  417    HB2  ARG  56           HB2      ARG  56  -6.179   5.195   6.429
  418    HB3  ARG  56           HB1      ARG  56  -5.032   6.530   6.331
  419    HG2  ARG  56           HG2      ARG  56  -6.671   8.009   5.402
  420    HG3  ARG  56           HG1      ARG  56  -7.803   6.688   5.120
  421    HD2  ARG  56           HD2      ARG  56  -8.007   6.386   7.589
  422    HD3  ARG  56           HD1      ARG  56  -6.955   7.794   7.813
  423    HE   ARG  56           HE       ARG  56  -8.911   8.746   6.193
  424   HH11  ARG  56          HH11      ARG  56 -10.485   7.879   9.796
  425   HH12  ARG  56          HH12      ARG  56  -9.017   7.103   9.305
  426   HH21  ARG  56          HH21      ARG  56 -10.854   9.728   6.849
  427   HH22  ARG  56          HH22      ARG  56 -11.518   9.358   8.408
  428    H    GLU  57           HN       GLU  57  -3.017   6.204   3.974
  429    HA   GLU  57           HA       GLU  57  -1.840   3.656   4.897
  430    HB2  GLU  57           HB2      GLU  57  -0.244   3.651   3.025
  431    HB3  GLU  57           HB1      GLU  57  -1.895   3.554   2.426
  432    HG2  GLU  57           HG2      GLU  57  -1.857   5.874   1.740
  433    HG3  GLU  57           HG1      GLU  57  -0.291   6.122   2.521
  434    H    LEU  58           HN       LEU  58   0.480   3.834   5.295
  435    HA   LEU  58           HA       LEU  58   1.236   6.284   6.602
  436    HB2  LEU  58           HB2      LEU  58   2.748   3.691   6.116
  437    HB3  LEU  58           HB1      LEU  58   3.309   4.998   7.155
  438    HG   LEU  58           HG       LEU  58   0.721   3.466   7.624
  439   HD11  LEU  58          HD11      LEU  58   1.822   2.257   9.407
  440   HD12  LEU  58          HD12      LEU  58   3.363   3.047   9.045
  441   HD13  LEU  58          HD13      LEU  58   2.631   1.948   7.871
  442   HD21  LEU  58          HD21      LEU  58   2.212   5.434   9.384
  443   HD22  LEU  58          HD22      LEU  58   0.790   4.508   9.863
  444   HD23  LEU  58          HD23      LEU  58   0.664   5.698   8.574
  445    H    ARG  59           HN       ARG  59   2.862   7.714   5.906
  446    HA   ARG  59           HA       ARG  59   3.459   7.611   3.034
  447    HB2  ARG  59           HB2      ARG  59   4.025   9.787   5.098
  448    HB3  ARG  59           HB1      ARG  59   4.388   9.889   3.362
  449    HG2  ARG  59           HG2      ARG  59   1.982   9.702   2.842
  450    HG3  ARG  59           HG1      ARG  59   1.604   9.583   4.563
  451    HD2  ARG  59           HD2      ARG  59   2.912  11.972   3.213
  452    HD3  ARG  59           HD1      ARG  59   1.216  11.860   3.697
  453    HE   ARG  59           HE       ARG  59   3.177  11.448   5.813
  454   HH11  ARG  59          HH11      ARG  59   1.076  14.879   5.603
  455   HH12  ARG  59          HH12      ARG  59   1.059  13.798   4.247
  456   HH21  ARG  59          HH21      ARG  59   3.190  12.875   7.563
  457   HH22  ARG  59          HH22      ARG  59   2.285  14.355   7.480
  458    HA   PRO  60           HA       PRO  60   7.493   5.935   3.405
  459    HB2  PRO  60           HB2      PRO  60   8.864   7.093   1.355
  460    HB3  PRO  60           HB1      PRO  60   7.486   6.009   1.071
  461    HG2  PRO  60           HG2      PRO  60   7.524   9.013   1.087
  462    HG3  PRO  60           HG1      PRO  60   6.799   7.900  -0.088
  463    HD2  PRO  60           HD2      PRO  60   5.316   9.084   1.878
  464    HD3  PRO  60           HD1      PRO  60   4.957   7.450   1.251
  465    H    ASP  61           HN       ASP  61   9.351   6.207   4.466
  466    HA   ASP  61           HA       ASP  61   9.722   8.633   5.988
  467    HB2  ASP  61           HB2      ASP  61  11.238   7.351   7.361
  468    HB3  ASP  61           HB1      ASP  61   9.869   6.320   6.980
  469    H    VAL  62           HN       VAL  62  11.631   6.833   3.592
  470    HA   VAL  62           HA       VAL  62  13.257   9.233   3.046
  471    HB   VAL  62           HB       VAL  62  14.442   7.678   4.695
  472   HG11  VAL  62          HG11      VAL  62  15.506   5.633   3.859
  473   HG12  VAL  62          HG12      VAL  62  14.672   5.815   2.315
  474   HG13  VAL  62          HG13      VAL  62  13.746   5.521   3.788
  475   HG21  VAL  62          HG21      VAL  62  15.864   8.207   2.063
  476   HG22  VAL  62          HG22      VAL  62  16.649   7.857   3.606
  477   HG23  VAL  62          HG23      VAL  62  15.702   9.332   3.415
  478    H    PHE  63           HN       PHE  63  11.131   7.178   1.830
  479    HA   PHE  63           HA       PHE  63  12.389   6.875  -0.845
  480    HB2  PHE  63           HB2      PHE  63   9.862   5.499   0.207
  481    HB3  PHE  63           HB1      PHE  63  10.736   5.128  -1.276
  482    HD1  PHE  63           HD1      PHE  63  10.328   4.211   2.136
  483    HD2  PHE  63           HD2      PHE  63  13.264   4.399  -0.970
  484    HE1  PHE  63           HE1      PHE  63  11.725   2.587   3.352
  485    HE2  PHE  63           HE2      PHE  63  14.645   2.770   0.246
  486    HZ   PHE  63           HZ       PHE  63  13.883   1.860   2.404
  487    H    GLY  64           HN       GLY  64  10.765   7.180  -2.693
  488    HA2  GLY  64           HA2      GLY  64   8.862   8.241  -3.626
  489    HA3  GLY  64           HA1      GLY  64   8.671   9.207  -2.168
  490    H    ALA  65           HN       ALA  65   9.085   9.776  -5.188
  491    HA   ALA  65           HA       ALA  65  11.241  11.793  -4.979
  492    HB1  ALA  65           HB1      ALA  65  10.840   9.841  -7.286
  493    HB2  ALA  65           HB2      ALA  65  12.144   9.777  -6.099
  494    HB3  ALA  65           HB3      ALA  65  12.043  11.133  -7.222
  Start of MODEL    6
    1    H1   MET   1           HT1      MET   1 -15.532  -2.670  11.421
    2    H2   MET   1           HT2      MET   1 -15.109  -1.033  11.447
    3    H3   MET   1           HT3      MET   1 -13.963  -2.206  11.845
    4    HA   MET   1           HA       MET   1 -13.905  -3.038   9.660
    5    HB2  MET   1           HB2      MET   1 -15.246  -1.962   7.829
    6    HB3  MET   1           HB1      MET   1 -16.226  -2.812   9.012
    7    HG2  MET   1           HG2      MET   1 -16.834  -0.663  10.058
    8    HG3  MET   1           HG1      MET   1 -15.847   0.189   8.865
    9    HE1  MET   1           HE1      MET   1 -18.933   0.847   9.423
   10    HE2  MET   1           HE2      MET   1 -19.593   0.991   7.795
   11    HE3  MET   1           HE3      MET   1 -18.031   1.715   8.181
   12    H    ASN   2           HN       ASN   2 -12.118  -2.334   8.634
   13    HA   ASN   2           HA       ASN   2 -11.580   0.566   8.335
   14    HB2  ASN   2           HB2      ASN   2  -9.125   0.015   8.443
   15    HB3  ASN   2           HB1      ASN   2  -9.964  -0.241   9.961
   16   HD21  ASN   2          HD21      ASN   2  -8.425  -1.627  10.737
   17   HD22  ASN   2          HD22      ASN   2  -8.207  -3.229  10.146
   18    H    ALA   3           HN       ALA   3  -9.895   0.825   6.484
   19    HA   ALA   3           HA       ALA   3 -11.121   0.285   4.083
   20    HB1  ALA   3           HB1      ALA   3  -9.449   2.054   4.399
   21    HB2  ALA   3           HB2      ALA   3  -9.061   1.059   2.998
   22    HB3  ALA   3           HB3      ALA   3  -8.168   0.841   4.507
   23    H    ILE   4           HN       ILE   4  -8.601  -1.545   5.681
   24    HA   ILE   4           HA       ILE   4  -7.905  -3.281   3.528
   25    HB   ILE   4           HB       ILE   4  -7.534  -3.920   6.484
   26   HG12  ILE   4          HG12      ILE   4  -5.124  -2.918   6.049
   27   HG13  ILE   4          HG11      ILE   4  -5.910  -2.022   4.763
   28   HG21  ILE   4          HG21      ILE   4  -5.594  -5.253   5.742
   29   HG22  ILE   4          HG22      ILE   4  -5.939  -4.826   4.063
   30   HG23  ILE   4          HG23      ILE   4  -7.086  -5.804   4.983
   31   HD11  ILE   4          HD11      ILE   4  -6.519  -1.860   7.722
   32   HD12  ILE   4          HD12      ILE   4  -7.411  -0.989   6.470
   33   HD13  ILE   4          HD13      ILE   4  -5.696  -0.654   6.732
   34    H    ASP   5           HN       ASP   5 -10.093  -3.467   6.283
   35    HA   ASP   5           HA       ASP   5 -10.970  -6.146   6.006
   36    HB2  ASP   5           HB2      ASP   5 -11.167  -4.991   8.143
   37    HB3  ASP   5           HB1      ASP   5 -12.240  -3.782   7.443
   38    H    ILE   6           HN       ILE   6 -12.221  -3.074   4.840
   39    HA   ILE   6           HA       ILE   6 -14.677  -3.978   3.758
   40    HB   ILE   6           HB       ILE   6 -12.925  -1.582   3.046
   41   HG12  ILE   6          HG12      ILE   6 -13.881  -1.507   5.317
   42   HG13  ILE   6          HG11      ILE   6 -14.594  -0.264   4.303
   43   HG21  ILE   6          HG21      ILE   6 -15.746  -2.148   2.034
   44   HG22  ILE   6          HG22      ILE   6 -14.273  -2.107   1.064
   45   HG23  ILE   6          HG23      ILE   6 -14.862  -0.630   1.818
   46   HD11  ILE   6          HD11      ILE   6 -16.250  -1.279   5.753
   47   HD12  ILE   6          HD12      ILE   6 -15.898  -2.872   5.087
   48   HD13  ILE   6          HD13      ILE   6 -16.619  -1.626   4.065
   49    H    ALA   7           HN       ALA   7 -11.410  -3.681   2.423
   50    HA   ALA   7           HA       ALA   7 -12.026  -4.440  -0.252
   51    HB1  ALA   7           HB1      ALA   7  -9.357  -4.626   1.175
   52    HB2  ALA   7           HB2      ALA   7  -9.989  -3.188   0.367
   53    HB3  ALA   7           HB3      ALA   7  -9.624  -4.643  -0.572
   54    H    ILE   8           HN       ILE   8 -11.343  -6.307   2.648
   55    HA   ILE   8           HA       ILE   8 -10.961  -8.884   1.508
   56    HB   ILE   8           HB       ILE   8 -12.299  -8.194   4.177
   57   HG12  ILE   8          HG12      ILE   8  -9.365  -8.876   3.649
   58   HG13  ILE   8          HG11      ILE   8  -9.979  -7.257   3.943
   59   HG21  ILE   8          HG21      ILE   8 -11.691 -10.480   4.897
   60   HG22  ILE   8          HG22      ILE   8 -11.038 -10.825   3.293
   61   HG23  ILE   8          HG23      ILE   8 -12.762 -10.519   3.499
   62   HD11  ILE   8          HD11      ILE   8 -10.040  -9.547   5.894
   63   HD12  ILE   8          HD12      ILE   8 -10.658  -7.919   6.193
   64   HD13  ILE   8          HD13      ILE   8  -8.936  -8.174   5.912
   65    H    ASN   9           HN       ASN   9 -13.882  -7.161   2.612
   66    HA   ASN   9           HA       ASN   9 -15.755  -9.210   1.899
   67    HB2  ASN   9           HB2      ASN   9 -16.176  -6.247   2.482
   68    HB3  ASN   9           HB1      ASN   9 -17.494  -7.390   2.241
   69   HD21  ASN   9          HD21      ASN   9 -15.143  -6.185   4.452
   70   HD22  ASN   9          HD22      ASN   9 -15.590  -7.149   5.815
   71    H    LYS  10           HN       LYS  10 -14.350  -6.484   0.179
   72    HA   LYS  10           HA       LYS  10 -16.300  -6.341  -1.917
   73    HB2  LYS  10           HB2      LYS  10 -14.860  -4.404  -1.187
   74    HB3  LYS  10           HB1      LYS  10 -13.460  -5.178  -1.913
   75    HG2  LYS  10           HG2      LYS  10 -15.898  -4.551  -3.612
   76    HG3  LYS  10           HG1      LYS  10 -14.758  -3.272  -3.197
   77    HD2  LYS  10           HD2      LYS  10 -12.916  -4.647  -4.197
   78    HD3  LYS  10           HD1      LYS  10 -14.117  -5.834  -4.707
   79    HE2  LYS  10           HE2      LYS  10 -14.064  -2.929  -5.600
   80    HE3  LYS  10           HE1      LYS  10 -13.418  -4.280  -6.530
   81    HZ1  LYS  10           HZ1      LYS  10 -16.250  -3.960  -5.714
   82    HZ2  LYS  10           HZ2      LYS  10 -15.617  -5.226  -6.637
   83    HZ3  LYS  10           HZ3      LYS  10 -15.626  -3.653  -7.254
   84    H    LEU  11           HN       LEU  11 -12.995  -7.705  -1.703
   85    HA   LEU  11           HA       LEU  11 -13.202  -8.907  -4.336
   86    HB2  LEU  11           HB2      LEU  11 -11.061  -9.355  -2.228
   87    HB3  LEU  11           HB1      LEU  11 -10.993  -9.882  -3.902
   88    HG   LEU  11           HG       LEU  11 -10.702  -7.074  -2.794
   89   HD11  LEU  11          HD11      LEU  11  -8.646  -7.063  -4.163
   90   HD12  LEU  11          HD12      LEU  11  -8.995  -8.710  -4.696
   91   HD13  LEU  11          HD13      LEU  11  -8.664  -8.380  -2.997
   92   HD21  LEU  11          HD21      LEU  11 -10.777  -6.122  -5.036
   93   HD22  LEU  11          HD22      LEU  11 -12.321  -6.858  -4.627
   94   HD23  LEU  11          HD23      LEU  11 -11.220  -7.694  -5.722
   95    H    GLY  12           HN       GLY  12 -14.059  -9.823  -1.136
   96    HA2  GLY  12           HA2      GLY  12 -15.596 -11.596  -0.743
   97    HA3  GLY  12           HA1      GLY  12 -14.920 -12.477  -2.105
   98    H    SER  13           HN       SER  13 -12.129 -11.623  -0.845
   99    HA   SER  13           HA       SER  13 -11.961 -13.226   1.541
  100    HB2  SER  13           HB2      SER  13 -10.501 -15.011   0.576
  101    HB3  SER  13           HB1      SER  13 -12.119 -15.036  -0.117
  102    HG   SER  13           HG       SER  13 -11.254 -13.813  -1.893
  103    H    VAL  14           HN       VAL  14  -9.810 -13.406   2.398
  104    HA   VAL  14           HA       VAL  14  -8.101 -11.121   1.952
  105    HB   VAL  14           HB       VAL  14  -8.027 -13.495   3.863
  106   HG11  VAL  14          HG11      VAL  14  -5.867 -11.362   3.663
  107   HG12  VAL  14          HG12      VAL  14  -5.669 -13.082   3.339
  108   HG13  VAL  14          HG13      VAL  14  -6.028 -12.536   4.974
  109   HG21  VAL  14          HG21      VAL  14  -8.236 -11.701   5.571
  110   HG22  VAL  14          HG22      VAL  14  -9.568 -11.705   4.419
  111   HG23  VAL  14          HG23      VAL  14  -8.281 -10.499   4.267
  112    H    SER  15           HN       SER  15  -8.141 -14.512   1.058
  113    HA   SER  15           HA       SER  15  -5.430 -14.806   0.329
  114    HB2  SER  15           HB2      SER  15  -6.277 -16.839  -0.930
  115    HB3  SER  15           HB1      SER  15  -6.765 -16.771   0.765
  116    HG   SER  15           HG       SER  15  -8.296 -16.570  -1.537
  117    H    ALA  16           HN       ALA  16  -8.335 -13.889  -1.522
  118    HA   ALA  16           HA       ALA  16  -6.983 -13.426  -4.027
  119    HB1  ALA  16           HB1      ALA  16  -9.663 -12.351  -3.067
  120    HB2  ALA  16           HB2      ALA  16  -9.413 -13.866  -3.937
  121    HB3  ALA  16           HB3      ALA  16  -9.075 -12.326  -4.729
  122    H    LEU  17           HN       LEU  17  -7.849 -11.421  -1.231
  123    HA   LEU  17           HA       LEU  17  -7.221  -8.884  -2.308
  124    HB2  LEU  17           HB2      LEU  17  -8.585  -9.209  -0.259
  125    HB3  LEU  17           HB1      LEU  17  -7.163  -9.786   0.599
  126    HG   LEU  17           HG       LEU  17  -6.108  -7.582   0.383
  127   HD11  LEU  17          HD11      LEU  17  -7.340  -5.620  -0.457
  128   HD12  LEU  17          HD12      LEU  17  -8.665  -6.665  -0.976
  129   HD13  LEU  17          HD13      LEU  17  -7.073  -6.812  -1.725
  130   HD21  LEU  17          HD21      LEU  17  -8.873  -7.406   1.591
  131   HD22  LEU  17          HD22      LEU  17  -7.509  -6.333   1.938
  132   HD23  LEU  17          HD23      LEU  17  -7.416  -8.044   2.364
  133    H    ALA  18           HN       ALA  18  -5.295 -11.290  -0.700
  134    HA   ALA  18           HA       ALA  18  -2.993  -9.679  -0.178
  135    HB1  ALA  18           HB1      ALA  18  -3.618 -11.607   1.214
  136    HB2  ALA  18           HB2      ALA  18  -1.985 -11.789   0.563
  137    HB3  ALA  18           HB3      ALA  18  -3.324 -12.698  -0.149
  138    H    ALA  19           HN       ALA  19  -3.879 -12.137  -2.598
  139    HA   ALA  19           HA       ALA  19  -1.517 -12.176  -4.133
  140    HB1  ALA  19           HB1      ALA  19  -2.941 -13.061  -5.954
  141    HB2  ALA  19           HB2      ALA  19  -4.389 -12.571  -5.069
  142    HB3  ALA  19           HB3      ALA  19  -3.335 -13.819  -4.407
  143    H    ALA  20           HN       ALA  20  -4.338 -10.051  -4.209
  144    HA   ALA  20           HA       ALA  20  -3.679  -8.504  -6.509
  145    HB1  ALA  20           HB1      ALA  20  -5.501  -7.803  -4.185
  146    HB2  ALA  20           HB2      ALA  20  -5.977  -8.680  -5.641
  147    HB3  ALA  20           HB3      ALA  20  -5.468  -6.991  -5.749
  148    H    LEU  21           HN       LEU  21  -2.851  -8.237  -3.102
  149    HA   LEU  21           HA       LEU  21  -1.625  -5.576  -3.440
  150    HB2  LEU  21           HB2      LEU  21  -2.306  -7.232  -0.989
  151    HB3  LEU  21           HB1      LEU  21  -1.453  -5.694  -0.901
  152    HG   LEU  21           HG       LEU  21  -4.222  -5.999  -2.137
  153   HD11  LEU  21          HD11      LEU  21  -3.542  -5.133   0.678
  154   HD12  LEU  21          HD12      LEU  21  -4.444  -6.570   0.181
  155   HD13  LEU  21          HD13      LEU  21  -5.131  -4.968  -0.089
  156   HD21  LEU  21          HD21      LEU  21  -2.704  -3.528  -1.275
  157   HD22  LEU  21          HD22      LEU  21  -4.339  -3.565  -1.943
  158   HD23  LEU  21          HD23      LEU  21  -2.971  -4.062  -2.935
  159    H    GLY  22           HN       GLY  22  -0.674  -8.691  -3.812
  160    HA2  GLY  22           HA2      GLY  22   1.402  -9.536  -4.384
  161    HA3  GLY  22           HA1      GLY  22   2.101  -7.961  -4.044
  162    H    VAL  23           HN       VAL  23   0.256  -9.342  -1.517
  163    HA   VAL  23           HA       VAL  23   2.661 -10.153   0.008
  164    HB   VAL  23           HB       VAL  23   1.502  -9.299   2.045
  165   HG11  VAL  23          HG11      VAL  23   3.129  -7.836   0.947
  166   HG12  VAL  23          HG12      VAL  23   1.816  -6.883   1.642
  167   HG13  VAL  23          HG13      VAL  23   1.865  -7.172  -0.098
  168   HG21  VAL  23          HG21      VAL  23  -0.593  -8.187   0.127
  169   HG22  VAL  23          HG22      VAL  23  -0.500  -7.852   1.856
  170   HG23  VAL  23          HG23      VAL  23  -0.846  -9.486   1.299
  171    H    ASN  24           HN       ASN  24   1.800 -11.439   2.111
  172    HA   ASN  24           HA       ASN  24   0.020 -13.585   1.147
  173    HB2  ASN  24           HB2      ASN  24   0.908 -14.979   2.893
  174    HB3  ASN  24           HB1      ASN  24   2.260 -14.201   2.094
  175   HD21  ASN  24          HD21      ASN  24   2.159 -15.420   4.701
  176   HD22  ASN  24          HD22      ASN  24   2.611 -14.200   5.838
  177    H    GLN  25           HN       GLN  25  -1.254 -14.622   3.072
  178    HA   GLN  25           HA       GLN  25  -3.386 -12.821   3.632
  179    HB2  GLN  25           HB2      GLN  25  -2.894 -15.639   4.701
  180    HB3  GLN  25           HB1      GLN  25  -4.372 -14.733   4.960
  181    HG2  GLN  25           HG2      GLN  25  -4.797 -16.298   3.232
  182    HG3  GLN  25           HG1      GLN  25  -4.728 -14.705   2.479
  183   HE21  GLN  25          HE21      GLN  25  -3.035 -14.254   1.051
  184   HE22  GLN  25          HE22      GLN  25  -1.988 -15.471   0.426
  185    H    SER  26           HN       SER  26  -0.632 -13.880   5.502
  186    HA   SER  26           HA       SER  26  -1.475 -13.115   8.108
  187    HB2  SER  26           HB2      SER  26   1.392 -13.211   7.077
  188    HB3  SER  26           HB1      SER  26   0.841 -13.442   8.739
  189    HG   SER  26           HG       SER  26  -0.424 -15.269   7.629
  190    H    ALA  27           HN       ALA  27   0.249 -11.431   5.509
  191    HA   ALA  27           HA       ALA  27   0.925  -9.059   6.924
  192    HB1  ALA  27           HB1      ALA  27   0.551  -9.443   3.932
  193    HB2  ALA  27           HB2      ALA  27   2.046  -9.717   4.833
  194    HB3  ALA  27           HB3      ALA  27   1.374  -8.090   4.705
  195    H    ILE  28           HN       ILE  28  -1.814  -9.919   4.822
  196    HA   ILE  28           HA       ILE  28  -3.228  -7.473   4.874
  197    HB   ILE  28           HB       ILE  28  -4.367 -10.303   4.677
  198   HG12  ILE  28          HG12      ILE  28  -2.699  -9.802   2.913
  199   HG13  ILE  28          HG11      ILE  28  -4.317  -9.992   2.248
  200   HG21  ILE  28          HG21      ILE  28  -6.330  -9.262   3.579
  201   HG22  ILE  28          HG22      ILE  28  -5.667  -7.659   3.910
  202   HG23  ILE  28          HG23      ILE  28  -6.147  -8.714   5.243
  203   HD11  ILE  28          HD11      ILE  28  -4.524  -7.555   2.097
  204   HD12  ILE  28          HD12      ILE  28  -3.155  -8.176   1.180
  205   HD13  ILE  28          HD13      ILE  28  -2.886  -7.389   2.734
  206    H    SER  29           HN       SER  29  -3.504 -10.350   6.912
  207    HA   SER  29           HA       SER  29  -5.588  -9.541   8.604
  208    HB2  SER  29           HB2      SER  29  -4.782 -11.876   8.413
  209    HB3  SER  29           HB1      SER  29  -3.264 -11.429   9.196
  210    HG   SER  29           HG       SER  29  -4.932 -12.384  10.589
  211    H    GLN  30           HN       GLN  30  -2.126  -8.984   8.716
  212    HA   GLN  30           HA       GLN  30  -1.993  -7.850  11.340
  213    HB2  GLN  30           HB2      GLN  30  -0.032  -8.896  10.235
  214    HB3  GLN  30           HB1      GLN  30  -0.034  -7.639   9.001
  215    HG2  GLN  30           HG2      GLN  30   0.467  -5.953  10.714
  216    HG3  GLN  30           HG1      GLN  30   0.449  -7.197  11.964
  217   HE21  GLN  30          HE21      GLN  30   2.592  -5.396  11.201
  218   HE22  GLN  30          HE22      GLN  30   3.936  -6.384  10.755
  219    H    TRP  31           HN       TRP  31  -2.205  -6.482   8.043
  220    HA   TRP  31           HA       TRP  31  -2.075  -3.735   8.776
  221    HB2  TRP  31           HB2      TRP  31  -3.351  -5.021   6.331
  222    HB3  TRP  31           HB1      TRP  31  -3.064  -3.293   6.520
  223    HD1  TRP  31           HD1      TRP  31   0.031  -4.166   7.838
  224    HE1  TRP  31           HE1      TRP  31   1.849  -4.551   6.061
  225    HE3  TRP  31           HE3      TRP  31  -2.942  -4.852   3.720
  226    HZ2  TRP  31           HZ2      TRP  31   2.007  -5.055   3.294
  227    HZ3  TRP  31           HZ3      TRP  31  -1.882  -5.259   1.554
  228    HH2  TRP  31           HH2      TRP  31   0.542  -5.361   1.343
  229    H    ARG  32           HN       ARG  32  -4.646  -6.060   8.569
  230    HA   ARG  32           HA       ARG  32  -6.885  -4.293   8.886
  231    HB2  ARG  32           HB2      ARG  32  -6.993  -6.588   7.837
  232    HB3  ARG  32           HB1      ARG  32  -6.663  -7.297   9.412
  233    HG2  ARG  32           HG2      ARG  32  -8.816  -6.086  10.178
  234    HG3  ARG  32           HG1      ARG  32  -9.148  -5.862   8.459
  235    HD2  ARG  32           HD2      ARG  32  -8.937  -8.352   8.172
  236    HD3  ARG  32           HD1      ARG  32  -8.796  -8.498   9.928
  237    HE   ARG  32           HE       ARG  32 -11.152  -7.469   8.480
  238   HH11  ARG  32          HH11      ARG  32  -9.808  -9.078  11.288
  239   HH12  ARG  32          HH12      ARG  32 -11.357  -9.419  11.987
  240   HH21  ARG  32          HH21      ARG  32 -13.184  -7.935   9.383
  241   HH22  ARG  32          HH22      ARG  32 -13.282  -8.766  10.902
  242    H    ALA  33           HN       ALA  33  -4.806  -6.213  11.004
  243    HA   ALA  33           HA       ALA  33  -6.235  -5.570  13.422
  244    HB1  ALA  33           HB1      ALA  33  -4.966  -7.675  13.226
  245    HB2  ALA  33           HB2      ALA  33  -4.367  -6.707  14.570
  246    HB3  ALA  33           HB3      ALA  33  -3.456  -6.773  13.056
  247    H    ARG  34           HN       ARG  34  -3.975  -3.984  11.462
  248    HA   ARG  34           HA       ARG  34  -2.759  -2.285  13.501
  249    HB2  ARG  34           HB2      ARG  34  -1.559  -3.285  11.505
  250    HB3  ARG  34           HB1      ARG  34  -2.471  -2.181  10.477
  251    HG2  ARG  34           HG2      ARG  34  -1.352  -0.319  11.233
  252    HG3  ARG  34           HG1      ARG  34  -0.968  -1.041  12.790
  253    HD2  ARG  34           HD2      ARG  34   1.064  -0.941  11.683
  254    HD3  ARG  34           HD1      ARG  34   0.600  -2.619  11.480
  255    HE   ARG  34           HE       ARG  34  -0.337  -1.239   9.260
  256   HH11  ARG  34          HH11      ARG  34   2.799  -2.066  10.630
  257   HH12  ARG  34          HH12      ARG  34   3.596  -2.060   9.093
  258   HH21  ARG  34          HH21      ARG  34   0.726  -1.195   7.280
  259   HH22  ARG  34          HH22      ARG  34   2.418  -1.565   7.186
  260    H    GLY  35           HN       GLY  35  -5.187  -2.192  10.990
  261    HA2  GLY  35           HA2      GLY  35  -6.953  -0.713  10.668
  262    HA3  GLY  35           HA1      GLY  35  -6.245   0.394  11.835
  263    H    ARG  36           HN       ARG  36  -3.729  -0.382   9.853
  264    HA   ARG  36           HA       ARG  36  -4.337   1.401   7.625
  265    HB2  ARG  36           HB2      ARG  36  -2.497   2.961   8.056
  266    HB3  ARG  36           HB1      ARG  36  -3.609   2.966   9.414
  267    HG2  ARG  36           HG2      ARG  36  -2.001   1.433  10.634
  268    HG3  ARG  36           HG1      ARG  36  -0.866   1.676   9.305
  269    HD2  ARG  36           HD2      ARG  36  -0.955   4.148   9.766
  270    HD3  ARG  36           HD1      ARG  36  -1.955   3.803  11.181
  271    HE   ARG  36           HE       ARG  36   0.525   2.348  11.182
  272   HH11  ARG  36          HH11      ARG  36  -0.882   5.461  12.041
  273   HH12  ARG  36          HH12      ARG  36   0.357   5.827  13.198
  274   HH21  ARG  36          HH21      ARG  36   2.069   4.380  13.553
  275   HH22  ARG  36          HH22      ARG  36   2.162   2.892  12.673
  276    H    VAL  37           HN       VAL  37  -2.797   1.335   5.948
  277    HA   VAL  37           HA       VAL  37  -1.099  -1.091   5.842
  278    HB   VAL  37           HB       VAL  37  -1.231  -0.835   3.344
  279   HG11  VAL  37          HG11      VAL  37  -3.553  -1.577   3.084
  280   HG12  VAL  37          HG12      VAL  37  -3.940  -0.978   4.698
  281   HG13  VAL  37          HG13      VAL  37  -2.805  -2.314   4.501
  282   HG21  VAL  37          HG21      VAL  37  -2.870   0.724   2.329
  283   HG22  VAL  37          HG22      VAL  37  -1.603   1.596   3.192
  284   HG23  VAL  37          HG23      VAL  37  -3.200   1.418   3.920
  285    HA   PRO  38           HA       PRO  38   2.633   1.439   5.220
  286    HB2  PRO  38           HB2      PRO  38   4.085  -0.083   3.461
  287    HB3  PRO  38           HB1      PRO  38   3.855  -0.557   5.156
  288    HG2  PRO  38           HG2      PRO  38   2.385  -1.524   2.724
  289    HG3  PRO  38           HG1      PRO  38   3.051  -2.454   4.088
  290    HD2  PRO  38           HD2      PRO  38   0.422  -1.802   3.951
  291    HD3  PRO  38           HD1      PRO  38   1.288  -1.931   5.494
  292    H    ALA  39           HN       ALA  39   3.925   2.459   3.435
  293    HA   ALA  39           HA       ALA  39   2.316   4.034   1.785
  294    HB1  ALA  39           HB1      ALA  39   4.529   4.720   2.578
  295    HB2  ALA  39           HB2      ALA  39   4.452   4.825   0.817
  296    HB3  ALA  39           HB3      ALA  39   5.300   3.479   1.583
  297    H    GLY  40           HN       GLY  40   1.860   3.995  -0.424
  298    HA2  GLY  40           HA2      GLY  40   1.516   3.287  -2.566
  299    HA3  GLY  40           HA1      GLY  40   3.023   2.390  -2.427
  300    H    ARG  41           HN       ARG  41  -0.115   2.010  -0.690
  301    HA   ARG  41           HA       ARG  41  -0.546  -0.587  -1.978
  302    HB2  ARG  41           HB2      ARG  41   0.961  -0.875   0.113
  303    HB3  ARG  41           HB1      ARG  41  -0.465  -0.481   1.064
  304    HG2  ARG  41           HG2      ARG  41  -0.361  -2.841   1.040
  305    HG3  ARG  41           HG1      ARG  41  -1.632  -2.431  -0.112
  306    HD2  ARG  41           HD2      ARG  41   1.233  -3.159  -0.840
  307    HD3  ARG  41           HD1      ARG  41  -0.146  -4.255  -0.912
  308    HE   ARG  41           HE       ARG  41  -0.923  -2.209  -2.558
  309   HH11  ARG  41          HH11      ARG  41   1.971  -4.250  -2.474
  310   HH12  ARG  41          HH12      ARG  41   2.247  -4.134  -4.181
  311   HH21  ARG  41          HH21      ARG  41   0.856  -2.903  -5.491
  312   HH22  ARG  41          HH22      ARG  41  -0.494  -2.062  -4.803
  313    H    CYS  42           HN       CYS  42  -1.740   1.972   0.113
  314    HA   CYS  42           HA       CYS  42  -4.453   1.143   0.296
  315    HB2  CYS  42           HB2      CYS  42  -3.775   2.920   1.734
  316    HB3  CYS  42           HB1      CYS  42  -3.176   3.887   0.390
  317    H    ILE  43           HN       ILE  43  -2.592   2.518  -2.292
  318    HA   ILE  43           HA       ILE  43  -4.365   3.665  -4.048
  319    HB   ILE  43           HB       ILE  43  -2.164   1.656  -4.765
  320   HG12  ILE  43          HG12      ILE  43  -2.006   4.701  -4.490
  321   HG13  ILE  43          HG11      ILE  43  -1.342   3.543  -3.344
  322   HG21  ILE  43          HG21      ILE  43  -3.443   3.805  -6.504
  323   HG22  ILE  43          HG22      ILE  43  -3.653   2.065  -6.684
  324   HG23  ILE  43          HG23      ILE  43  -2.074   2.790  -6.976
  325   HD11  ILE  43          HD11      ILE  43   0.392   4.488  -4.724
  326   HD12  ILE  43          HD12      ILE  43  -0.438   3.967  -6.189
  327   HD13  ILE  43          HD13      ILE  43   0.225   2.767  -5.076
  328    H    ASP  44           HN       ASP  44  -3.698   0.191  -3.644
  329    HA   ASP  44           HA       ASP  44  -5.599  -0.657  -5.647
  330    HB2  ASP  44           HB2      ASP  44  -4.430  -2.516  -3.559
  331    HB3  ASP  44           HB1      ASP  44  -4.839  -2.851  -5.236
  332    H    ILE  45           HN       ILE  45  -5.421  -0.756  -2.093
  333    HA   ILE  45           HA       ILE  45  -7.928  -1.966  -1.617
  334    HB   ILE  45           HB       ILE  45  -6.176  -0.217   0.163
  335   HG12  ILE  45          HG12      ILE  45  -6.697  -3.234   0.047
  336   HG13  ILE  45          HG11      ILE  45  -5.194  -2.399  -0.343
  337   HG21  ILE  45          HG21      ILE  45  -8.501   0.027   0.948
  338   HG22  ILE  45          HG22      ILE  45  -7.525  -0.881   2.101
  339   HG23  ILE  45          HG23      ILE  45  -8.656  -1.730   1.045
  340   HD11  ILE  45          HD11      ILE  45  -4.967  -3.481   1.775
  341   HD12  ILE  45          HD12      ILE  45  -6.440  -2.736   2.395
  342   HD13  ILE  45          HD13      ILE  45  -5.017  -1.742   2.059
  343    H    GLU  46           HN       GLU  46  -7.149   1.312  -2.490
  344    HA   GLU  46           HA       GLU  46  -9.549   2.581  -1.572
  345    HB2  GLU  46           HB2      GLU  46  -7.325   3.739  -2.033
  346    HB3  GLU  46           HB1      GLU  46  -7.659   3.582  -3.749
  347    HG2  GLU  46           HG2      GLU  46  -9.552   5.019  -1.878
  348    HG3  GLU  46           HG1      GLU  46  -8.148   5.832  -2.557
  349    H    LEU  47           HN       LEU  47  -8.405   1.221  -4.658
  350    HA   LEU  47           HA       LEU  47 -10.630   1.523  -6.318
  351    HB2  LEU  47           HB2      LEU  47  -8.773  -0.861  -5.981
  352    HB3  LEU  47           HB1      LEU  47  -9.943  -0.759  -7.276
  353    HG   LEU  47           HG       LEU  47  -7.761   1.332  -6.958
  354   HD11  LEU  47          HD11      LEU  47  -7.571  -1.242  -8.574
  355   HD12  LEU  47          HD12      LEU  47  -6.653  -0.868  -7.116
  356   HD13  LEU  47          HD13      LEU  47  -6.398   0.082  -8.575
  357   HD21  LEU  47          HD21      LEU  47  -9.428   0.421  -9.331
  358   HD22  LEU  47          HD22      LEU  47  -8.203   1.700  -9.359
  359   HD23  LEU  47          HD23      LEU  47  -9.668   1.907  -8.403
  360    H    TYR  48           HN       TYR  48 -10.135  -0.633  -3.581
  361    HA   TYR  48           HA       TYR  48 -12.630  -2.117  -4.098
  362    HB2  TYR  48           HB2      TYR  48 -10.679  -2.682  -1.838
  363    HB3  TYR  48           HB1      TYR  48 -11.842  -3.785  -2.581
  364    HD1  TYR  48           HD1      TYR  48  -8.742  -4.134  -2.098
  365    HD2  TYR  48           HD2      TYR  48 -11.016  -3.024  -5.543
  366    HE1  TYR  48           HE1      TYR  48  -6.944  -4.955  -3.556
  367    HE2  TYR  48           HE2      TYR  48  -9.215  -3.816  -7.003
  368    HH   TYR  48           HH       TYR  48  -6.665  -5.756  -5.858
  369    H    THR  49           HN       THR  49 -11.797   0.654  -2.346
  370    HA   THR  49           HA       THR  49 -14.004   0.279  -0.365
  371    HB   THR  49           HB       THR  49 -12.828   1.957   1.090
  372    HG1  THR  49           HG1      THR  49 -10.480   1.637  -0.427
  373   HG21  THR  49          HG21      THR  49 -12.429  -0.430   1.523
  374   HG22  THR  49          HG22      THR  49 -10.978   0.511   1.851
  375   HG23  THR  49          HG23      THR  49 -11.094  -0.439   0.369
  376    H    ASP  50           HN       ASP  50 -14.492   1.102  -2.964
  377    HA   ASP  50           HA       ASP  50 -14.410   3.490  -4.038
  378    HB2  ASP  50           HB2      ASP  50 -16.935   1.834  -3.763
  379    HB3  ASP  50           HB1      ASP  50 -16.789   3.183  -4.888
  380    H    GLY  51           HN       GLY  51 -17.040   2.849  -1.698
  381    HA2  GLY  51           HA2      GLY  51 -16.900   5.615  -0.720
  382    HA3  GLY  51           HA1      GLY  51 -18.408   5.112  -1.477
  383    H    ARG  52           HN       ARG  52 -16.410   2.933   0.419
  384    HA   ARG  52           HA       ARG  52 -18.539   2.728   2.449
  385    HB2  ARG  52           HB2      ARG  52 -16.009   1.050   2.147
  386    HB3  ARG  52           HB1      ARG  52 -17.263   0.795   3.351
  387    HG2  ARG  52           HG2      ARG  52 -17.676  -0.838   1.716
  388    HG3  ARG  52           HG1      ARG  52 -18.880   0.407   1.387
  389    HD2  ARG  52           HD2      ARG  52 -17.559   1.241  -0.483
  390    HD3  ARG  52           HD1      ARG  52 -16.239   0.131  -0.095
  391    HE   ARG  52           HE       ARG  52 -18.759  -1.180  -0.622
  392   HH11  ARG  52          HH11      ARG  52 -15.854   0.098  -2.147
  393   HH12  ARG  52          HH12      ARG  52 -16.002  -0.900  -3.554
  394   HH21  ARG  52          HH21      ARG  52 -17.750  -2.391  -3.711
  395   HH22  ARG  52          HH22      ARG  52 -18.910  -2.519  -2.430
  396    H    VAL  53           HN       VAL  53 -15.028   3.261   2.257
  397    HA   VAL  53           HA       VAL  53 -15.035   5.009   4.586
  398    HB   VAL  53           HB       VAL  53 -14.732   2.767   5.617
  399   HG11  VAL  53          HG11      VAL  53 -13.815   1.556   3.690
  400   HG12  VAL  53          HG12      VAL  53 -12.796   1.335   5.110
  401   HG13  VAL  53          HG13      VAL  53 -12.292   2.442   3.829
  402   HG21  VAL  53          HG21      VAL  53 -13.552   4.668   6.667
  403   HG22  VAL  53          HG22      VAL  53 -12.131   4.366   5.664
  404   HG23  VAL  53          HG23      VAL  53 -12.632   3.177   6.871
  405    H    GLU  54           HN       GLU  54 -13.223   6.367   4.620
  406    HA   GLU  54           HA       GLU  54 -11.755   6.833   2.212
  407    HB2  GLU  54           HB2      GLU  54 -11.137   7.857   5.023
  408    HB3  GLU  54           HB1      GLU  54 -10.599   8.569   3.503
  409    HG2  GLU  54           HG2      GLU  54 -12.873   9.235   2.967
  410    HG3  GLU  54           HG1      GLU  54 -13.496   8.394   4.380
  411    H    CYS  55           HN       CYS  55 -10.325   5.272   1.571
  412    HA   CYS  55           HA       CYS  55  -8.658   3.771   3.363
  413    HB2  CYS  55           HB2      CYS  55  -9.258   2.837   1.189
  414    HB3  CYS  55           HB1      CYS  55  -8.501   4.188   0.351
  415    H    ARG  56           HN       ARG  56  -6.585   4.202   4.042
  416    HA   ARG  56           HA       ARG  56  -5.020   6.319   2.761
  417    HB2  ARG  56           HB2      ARG  56  -4.371   7.373   4.913
  418    HB3  ARG  56           HB1      ARG  56  -6.068   7.593   4.536
  419    HG2  ARG  56           HG2      ARG  56  -5.292   5.335   6.373
  420    HG3  ARG  56           HG1      ARG  56  -5.264   6.985   6.993
  421    HD2  ARG  56           HD2      ARG  56  -7.690   5.688   5.692
  422    HD3  ARG  56           HD1      ARG  56  -7.420   5.787   7.436
  423    HE   ARG  56           HE       ARG  56  -7.254   8.365   6.262
  424   HH11  ARG  56          HH11      ARG  56  -9.691   5.976   7.128
  425   HH12  ARG  56          HH12      ARG  56 -10.940   7.160   7.333
  426   HH21  ARG  56          HH21      ARG  56 -10.491   9.393   6.991
  427   HH22  ARG  56          HH22      ARG  56  -8.896   9.892   6.526
  428    H    GLU  57           HN       GLU  57  -2.877   6.057   2.862
  429    HA   GLU  57           HA       GLU  57  -1.752   3.632   4.159
  430    HB2  GLU  57           HB2      GLU  57   0.062   3.832   2.363
  431    HB3  GLU  57           HB1      GLU  57  -1.527   3.379   1.767
  432    HG2  GLU  57           HG2      GLU  57  -1.920   5.755   1.109
  433    HG3  GLU  57           HG1      GLU  57  -0.270   6.126   1.622
  434    H    LEU  58           HN       LEU  58   0.548   3.877   4.771
  435    HA   LEU  58           HA       LEU  58   1.102   6.327   6.148
  436    HB2  LEU  58           HB2      LEU  58   2.724   3.795   5.717
  437    HB3  LEU  58           HB1      LEU  58   3.321   5.155   6.664
  438    HG   LEU  58           HG       LEU  58   0.729   3.691   7.307
  439   HD11  LEU  58          HD11      LEU  58   1.888   2.531   9.115
  440   HD12  LEU  58          HD12      LEU  58   3.426   3.240   8.610
  441   HD13  LEU  58          HD13      LEU  58   2.583   2.110   7.550
  442   HD21  LEU  58          HD21      LEU  58   2.354   5.694   8.919
  443   HD22  LEU  58          HD22      LEU  58   0.925   4.838   9.503
  444   HD23  LEU  58          HD23      LEU  58   0.782   5.972   8.164
  445    H    ARG  59           HN       ARG  59   2.786   7.796   5.737
  446    HA   ARG  59           HA       ARG  59   3.118   8.506   3.020
  447    HB2  ARG  59           HB2      ARG  59   4.313  10.444   3.751
  448    HB3  ARG  59           HB1      ARG  59   3.008  10.178   4.916
  449    HG2  ARG  59           HG2      ARG  59   5.941   9.477   5.338
  450    HG3  ARG  59           HG1      ARG  59   5.118  10.878   6.020
  451    HD2  ARG  59           HD2      ARG  59   3.748   9.453   7.421
  452    HD3  ARG  59           HD1      ARG  59   4.332   8.002   6.612
  453    HE   ARG  59           HE       ARG  59   5.761   9.620   8.587
  454   HH11  ARG  59          HH11      ARG  59   7.206   6.108   7.251
  455   HH12  ARG  59          HH12      ARG  59   5.857   6.826   6.432
  456   HH21  ARG  59          HH21      ARG  59   8.110   7.119   9.095
  457   HH22  ARG  59          HH22      ARG  59   7.448   8.608   9.688
  458    HA   PRO  60           HA       PRO  60   6.805   6.401   1.872
  459    HB2  PRO  60           HB2      PRO  60   8.047   8.159   0.187
  460    HB3  PRO  60           HB1      PRO  60   6.541   7.323  -0.249
  461    HG2  PRO  60           HG2      PRO  60   6.916  10.107   0.804
  462    HG3  PRO  60           HG1      PRO  60   5.911   9.518  -0.526
  463    HD2  PRO  60           HD2      PRO  60   4.855  10.031   1.937
  464    HD3  PRO  60           HD1      PRO  60   4.231   8.737   0.872
  465    H    ASP  61           HN       ASP  61   8.304   6.017   3.251
  466    HA   ASP  61           HA       ASP  61   9.540   7.901   5.043
  467    HB2  ASP  61           HB2      ASP  61   8.979   5.596   5.754
  468    HB3  ASP  61           HB1      ASP  61  10.105   4.940   4.573
  469    H    VAL  62           HN       VAL  62  11.038   5.571   2.788
  470    HA   VAL  62           HA       VAL  62  12.770   7.709   1.670
  471    HB   VAL  62           HB       VAL  62  13.574   4.760   1.986
  472   HG11  VAL  62          HG11      VAL  62  15.182   7.071   0.803
  473   HG12  VAL  62          HG12      VAL  62  14.453   5.743  -0.097
  474   HG13  VAL  62          HG13      VAL  62  15.762   5.415   1.033
  475   HG21  VAL  62          HG21      VAL  62  14.726   7.198   3.416
  476   HG22  VAL  62          HG22      VAL  62  15.330   5.542   3.542
  477   HG23  VAL  62          HG23      VAL  62  13.722   5.940   4.141
  478    H    PHE  63           HN       PHE  63  11.965   8.108  -0.284
  479    HA   PHE  63           HA       PHE  63  11.493   6.041  -2.246
  480    HB2  PHE  63           HB2      PHE  63   9.327   6.005  -1.051
  481    HB3  PHE  63           HB1      PHE  63   9.158   7.741  -1.262
  482    HD1  PHE  63           HD1      PHE  63   9.188   4.482  -3.075
  483    HD2  PHE  63           HD2      PHE  63   8.242   8.649  -3.315
  484    HE1  PHE  63           HE1      PHE  63   7.989   4.099  -5.186
  485    HE2  PHE  63           HE2      PHE  63   7.041   8.250  -5.429
  486    HZ   PHE  63           HZ       PHE  63   6.909   5.974  -6.364
  487    H    GLY  64           HN       GLY  64  11.525   6.848  -4.320
  488    HA2  GLY  64           HA2      GLY  64  11.090   9.273  -5.403
  489    HA3  GLY  64           HA1      GLY  64  12.701   9.461  -4.711
  490    H    ALA  65           HN       ALA  65  12.061   9.589  -7.470
  491    HA   ALA  65           HA       ALA  65  13.693   7.340  -8.500
  492    HB1  ALA  65           HB1      ALA  65  11.364   7.091  -9.255
  493    HB2  ALA  65           HB2      ALA  65  12.413   7.479 -10.620
  494    HB3  ALA  65           HB3      ALA  65  11.379   8.726  -9.916
  Start of MODEL    7
    1    H1   MET   1           HT1      MET   1 -14.757  -3.489  11.583
    2    H2   MET   1           HT2      MET   1 -14.229  -1.927  11.968
    3    H3   MET   1           HT3      MET   1 -13.113  -3.120  11.545
    4    HA   MET   1           HA       MET   1 -13.911  -3.230   9.330
    5    HB2  MET   1           HB2      MET   1 -15.921  -1.102  10.197
    6    HB3  MET   1           HB1      MET   1 -15.662  -1.617   8.534
    7    HG2  MET   1           HG2      MET   1 -16.435  -3.867   9.082
    8    HG3  MET   1           HG1      MET   1 -16.645  -3.397  10.774
    9    HE1  MET   1           HE1      MET   1 -19.031  -4.746   9.141
   10    HE2  MET   1           HE2      MET   1 -20.367  -3.706   9.634
   11    HE3  MET   1           HE3      MET   1 -19.153  -4.200  10.814
   12    H    ASN   2           HN       ASN   2 -12.552  -2.245   8.022
   13    HA   ASN   2           HA       ASN   2 -11.947   0.572   8.026
   14    HB2  ASN   2           HB2      ASN   2  -9.433   0.197   8.168
   15    HB3  ASN   2           HB1      ASN   2 -10.297   0.027   9.686
   16   HD21  ASN   2          HD21      ASN   2  -8.966  -1.317  10.746
   17   HD22  ASN   2          HD22      ASN   2  -8.532  -2.907  10.227
   18    H    ALA   3           HN       ALA   3 -10.254   0.937   6.202
   19    HA   ALA   3           HA       ALA   3 -11.266   0.248   3.782
   20    HB1  ALA   3           HB1      ALA   3  -9.629   2.041   4.128
   21    HB2  ALA   3           HB2      ALA   3  -9.155   0.998   2.788
   22    HB3  ALA   3           HB3      ALA   3  -8.346   0.845   4.351
   23    H    ILE   4           HN       ILE   4  -8.741  -1.460   5.524
   24    HA   ILE   4           HA       ILE   4  -7.967  -3.259   3.459
   25    HB   ILE   4           HB       ILE   4  -7.620  -3.785   6.441
   26   HG12  ILE   4          HG12      ILE   4  -5.234  -2.727   6.011
   27   HG13  ILE   4          HG11      ILE   4  -6.027  -1.897   4.680
   28   HG21  ILE   4          HG21      ILE   4  -5.638  -5.087   5.771
   29   HG22  ILE   4          HG22      ILE   4  -5.968  -4.720   4.074
   30   HG23  ILE   4          HG23      ILE   4  -7.104  -5.697   5.006
   31   HD11  ILE   4          HD11      ILE   4  -5.908  -0.460   6.601
   32   HD12  ILE   4          HD12      ILE   4  -6.687  -1.667   7.620
   33   HD13  ILE   4          HD13      ILE   4  -7.604  -0.877   6.332
   34    H    ASP   5           HN       ASP   5 -10.117  -3.455   6.253
   35    HA   ASP   5           HA       ASP   5 -10.978  -6.118   6.090
   36    HB2  ASP   5           HB2      ASP   5 -11.349  -4.803   8.100
   37    HB3  ASP   5           HB1      ASP   5 -12.342  -3.645   7.222
   38    H    ILE   6           HN       ILE   6 -12.414  -3.155   4.803
   39    HA   ILE   6           HA       ILE   6 -14.764  -4.352   3.780
   40    HB   ILE   6           HB       ILE   6 -13.443  -1.691   3.086
   41   HG12  ILE   6          HG12      ILE   6 -14.116  -1.849   5.463
   42   HG13  ILE   6          HG11      ILE   6 -15.110  -0.680   4.612
   43   HG21  ILE   6          HG21      ILE   6 -14.929  -2.342   1.255
   44   HG22  ILE   6          HG22      ILE   6 -15.642  -1.011   2.159
   45   HG23  ILE   6          HG23      ILE   6 -16.249  -2.651   2.388
   46   HD11  ILE   6          HD11      ILE   6 -16.940  -2.322   4.533
   47   HD12  ILE   6          HD12      ILE   6 -16.426  -1.972   6.182
   48   HD13  ILE   6          HD13      ILE   6 -15.930  -3.476   5.408
   49    H    ALA   7           HN       ALA   7 -11.557  -3.733   2.426
   50    HA   ALA   7           HA       ALA   7 -12.162  -4.559  -0.254
   51    HB1  ALA   7           HB1      ALA   7  -9.452  -4.454   1.097
   52    HB2  ALA   7           HB2      ALA   7 -10.232  -3.106   0.266
   53    HB3  ALA   7           HB3      ALA   7  -9.763  -4.552  -0.641
   54    H    ILE   8           HN       ILE   8 -11.130  -6.297   2.674
   55    HA   ILE   8           HA       ILE   8 -10.693  -8.875   1.576
   56    HB   ILE   8           HB       ILE   8 -11.960  -8.163   4.269
   57   HG12  ILE   8          HG12      ILE   8  -9.068  -8.960   3.715
   58   HG13  ILE   8          HG11      ILE   8  -9.609  -7.300   3.906
   59   HG21  ILE   8          HG21      ILE   8 -11.364 -10.454   5.013
   60   HG22  ILE   8          HG22      ILE   8 -10.822 -10.841   3.377
   61   HG23  ILE   8          HG23      ILE   8 -12.521 -10.476   3.685
   62   HD11  ILE   8          HD11      ILE   8  -9.732  -9.455   6.003
   63   HD12  ILE   8          HD12      ILE   8 -10.309  -7.799   6.203
   64   HD13  ILE   8          HD13      ILE   8  -8.595  -8.111   5.933
   65    H    ASN   9           HN       ASN   9 -13.641  -7.373   2.893
   66    HA   ASN   9           HA       ASN   9 -15.430  -9.475   2.229
   67    HB2  ASN   9           HB2      ASN   9 -16.030  -6.545   2.834
   68    HB3  ASN   9           HB1      ASN   9 -17.235  -7.828   2.773
   69   HD21  ASN   9          HD21      ASN   9 -14.933  -6.217   4.731
   70   HD22  ASN   9          HD22      ASN   9 -15.082  -7.201   6.140
   71    H    LYS  10           HN       LYS  10 -14.179  -6.777   0.397
   72    HA   LYS  10           HA       LYS  10 -16.251  -6.725  -1.623
   73    HB2  LYS  10           HB2      LYS  10 -14.802  -4.727  -0.916
   74    HB3  LYS  10           HB1      LYS  10 -13.476  -5.442  -1.822
   75    HG2  LYS  10           HG2      LYS  10 -16.117  -4.843  -3.183
   76    HG3  LYS  10           HG1      LYS  10 -14.942  -3.561  -2.897
   77    HD2  LYS  10           HD2      LYS  10 -13.240  -4.864  -4.175
   78    HD3  LYS  10           HD1      LYS  10 -14.457  -6.098  -4.512
   79    HE2  LYS  10           HE2      LYS  10 -14.594  -3.194  -5.384
   80    HE3  LYS  10           HE1      LYS  10 -14.151  -4.556  -6.415
   81    HZ1  LYS  10           HZ1      LYS  10 -16.346  -5.480  -6.064
   82    HZ2  LYS  10           HZ2      LYS  10 -16.444  -3.922  -6.710
   83    HZ3  LYS  10           HZ3      LYS  10 -16.767  -4.176  -5.074
   84    H    LEU  11           HN       LEU  11 -12.936  -8.039  -1.370
   85    HA   LEU  11           HA       LEU  11 -13.235  -9.430  -3.943
   86    HB2  LEU  11           HB2      LEU  11 -10.865  -9.559  -2.050
   87    HB3  LEU  11           HB1      LEU  11 -10.929 -10.158  -3.700
   88    HG   LEU  11           HG       LEU  11 -10.673  -7.308  -2.716
   89   HD11  LEU  11          HD11      LEU  11  -8.853  -7.202  -4.368
   90   HD12  LEU  11          HD12      LEU  11  -9.192  -8.867  -4.847
   91   HD13  LEU  11          HD13      LEU  11  -8.623  -8.514  -3.218
   92   HD21  LEU  11          HD21      LEU  11 -11.129  -6.394  -4.921
   93   HD22  LEU  11          HD22      LEU  11 -12.559  -7.198  -4.290
   94   HD23  LEU  11          HD23      LEU  11 -11.584  -7.991  -5.530
   95    H    GLY  12           HN       GLY  12 -14.365  -9.975  -0.953
   96    HA2  GLY  12           HA2      GLY  12 -15.577 -11.761  -0.179
   97    HA3  GLY  12           HA1      GLY  12 -15.013 -12.721  -1.535
   98    H    SER  13           HN       SER  13 -12.192 -11.625  -0.227
   99    HA   SER  13           HA       SER  13 -11.832 -13.344   2.014
  100    HB2  SER  13           HB2      SER  13 -10.376 -15.056   0.848
  101    HB3  SER  13           HB1      SER  13 -12.078 -15.157   0.406
  102    HG   SER  13           HG       SER  13 -11.490 -13.816  -1.453
  103    H    VAL  14           HN       VAL  14  -9.648 -13.466   2.735
  104    HA   VAL  14           HA       VAL  14  -7.940 -11.222   2.100
  105    HB   VAL  14           HB       VAL  14  -7.808 -13.519   4.110
  106   HG11  VAL  14          HG11      VAL  14  -5.474 -13.233   3.410
  107   HG12  VAL  14          HG12      VAL  14  -5.699 -12.603   5.039
  108   HG13  VAL  14          HG13      VAL  14  -5.579 -11.491   3.672
  109   HG21  VAL  14          HG21      VAL  14  -9.233 -11.635   4.680
  110   HG22  VAL  14          HG22      VAL  14  -7.914 -10.495   4.378
  111   HG23  VAL  14          HG23      VAL  14  -7.821 -11.631   5.740
  112    H    SER  15           HN       SER  15  -8.182 -14.594   1.212
  113    HA   SER  15           HA       SER  15  -5.554 -15.003   0.233
  114    HB2  SER  15           HB2      SER  15  -6.544 -16.944  -0.978
  115    HB3  SER  15           HB1      SER  15  -7.096 -16.877   0.697
  116    HG   SER  15           HG       SER  15  -9.072 -16.552   0.025
  117    H    ALA  16           HN       ALA  16  -8.610 -14.133  -1.450
  118    HA   ALA  16           HA       ALA  16  -7.465 -13.537  -3.970
  119    HB1  ALA  16           HB1      ALA  16 -10.026 -12.425  -2.765
  120    HB2  ALA  16           HB2      ALA  16  -9.882 -13.928  -3.677
  121    HB3  ALA  16           HB3      ALA  16  -9.583 -12.382  -4.473
  122    H    LEU  17           HN       LEU  17  -8.068 -11.513  -1.095
  123    HA   LEU  17           HA       LEU  17  -7.479  -9.020  -2.280
  124    HB2  LEU  17           HB2      LEU  17  -8.704  -9.243  -0.132
  125    HB3  LEU  17           HB1      LEU  17  -7.224  -9.773   0.658
  126    HG   LEU  17           HG       LEU  17  -6.184  -7.589   0.215
  127   HD11  LEU  17          HD11      LEU  17  -7.490  -5.674  -0.647
  128   HD12  LEU  17          HD12      LEU  17  -8.849  -6.751  -0.982
  129   HD13  LEU  17          HD13      LEU  17  -7.328  -6.946  -1.856
  130   HD21  LEU  17          HD21      LEU  17  -8.845  -7.269   1.601
  131   HD22  LEU  17          HD22      LEU  17  -7.423  -6.237   1.792
  132   HD23  LEU  17          HD23      LEU  17  -7.366  -7.921   2.314
  133    H    ALA  18           HN       ALA  18  -5.424 -11.268  -0.506
  134    HA   ALA  18           HA       ALA  18  -3.094  -9.654  -0.394
  135    HB1  ALA  18           HB1      ALA  18  -3.532 -11.479   1.194
  136    HB2  ALA  18           HB2      ALA  18  -1.965 -11.685   0.397
  137    HB3  ALA  18           HB3      ALA  18  -3.349 -12.662  -0.107
  138    H    ALA  19           HN       ALA  19  -4.238 -12.154  -2.628
  139    HA   ALA  19           HA       ALA  19  -1.940 -12.314  -4.295
  140    HB1  ALA  19           HB1      ALA  19  -3.459 -13.394  -5.914
  141    HB2  ALA  19           HB2      ALA  19  -4.853 -12.866  -4.967
  142    HB3  ALA  19           HB3      ALA  19  -3.715 -14.026  -4.282
  143    H    ALA  20           HN       ALA  20  -4.779 -10.212  -4.267
  144    HA   ALA  20           HA       ALA  20  -4.220  -8.876  -6.773
  145    HB1  ALA  20           HB1      ALA  20  -6.181  -8.151  -4.577
  146    HB2  ALA  20           HB2      ALA  20  -6.524  -9.188  -5.964
  147    HB3  ALA  20           HB3      ALA  20  -6.153  -7.478  -6.209
  148    H    LEU  21           HN       LEU  21  -3.293  -8.414  -3.459
  149    HA   LEU  21           HA       LEU  21  -2.301  -5.678  -3.947
  150    HB2  LEU  21           HB2      LEU  21  -2.537  -7.334  -1.417
  151    HB3  LEU  21           HB1      LEU  21  -1.792  -5.739  -1.466
  152    HG   LEU  21           HG       LEU  21  -4.692  -6.327  -2.193
  153   HD11  LEU  21          HD11      LEU  21  -3.539  -5.120   0.323
  154   HD12  LEU  21          HD12      LEU  21  -4.415  -6.648   0.157
  155   HD13  LEU  21          HD13      LEU  21  -5.255  -5.122  -0.108
  156   HD21  LEU  21          HD21      LEU  21  -3.815  -4.402  -3.418
  157   HD22  LEU  21          HD22      LEU  21  -3.257  -3.671  -1.910
  158   HD23  LEU  21          HD23      LEU  21  -4.987  -3.889  -2.207
  159    H    GLY  22           HN       GLY  22  -1.223  -8.870  -4.084
  160    HA2  GLY  22           HA2      GLY  22   0.800  -9.778  -4.659
  161    HA3  GLY  22           HA1      GLY  22   1.419  -8.144  -4.866
  162    H    VAL  23           HN       VAL  23   0.076  -9.663  -1.980
  163    HA   VAL  23           HA       VAL  23   2.672  -9.705  -0.595
  164    HB   VAL  23           HB       VAL  23   1.573  -8.793   1.478
  165   HG11  VAL  23          HG11      VAL  23   2.880  -7.246   0.098
  166   HG12  VAL  23          HG12      VAL  23   1.509  -6.411   0.834
  167   HG13  VAL  23          HG13      VAL  23   1.450  -6.867  -0.871
  168   HG21  VAL  23          HG21      VAL  23  -0.801  -8.176  -0.339
  169   HG22  VAL  23          HG22      VAL  23  -0.626  -7.644   1.335
  170   HG23  VAL  23          HG23      VAL  23  -0.777  -9.361   0.975
  171    H    ASN  24           HN       ASN  24   2.133 -10.764   1.722
  172    HA   ASN  24           HA       ASN  24   0.766 -13.301   1.278
  173    HB2  ASN  24           HB2      ASN  24   2.574 -12.213   3.431
  174    HB3  ASN  24           HB1      ASN  24   1.523 -13.559   3.841
  175   HD21  ASN  24          HD21      ASN  24   1.812 -15.543   2.861
  176   HD22  ASN  24          HD22      ASN  24   3.271 -15.957   2.014
  177    H    GLN  25           HN       GLN  25  -0.540 -14.133   3.095
  178    HA   GLN  25           HA       GLN  25  -2.940 -12.519   3.225
  179    HB2  GLN  25           HB2      GLN  25  -2.465 -15.348   4.301
  180    HB3  GLN  25           HB1      GLN  25  -4.027 -14.569   4.073
  181    HG2  GLN  25           HG2      GLN  25  -3.776 -16.086   2.268
  182    HG3  GLN  25           HG1      GLN  25  -3.524 -14.476   1.596
  183   HE21  GLN  25          HE21      GLN  25  -2.263 -15.106  -0.133
  184   HE22  GLN  25          HE22      GLN  25  -0.707 -15.824   0.009
  185    H    SER  26           HN       SER  26  -0.475 -13.784   5.370
  186    HA   SER  26           HA       SER  26  -1.596 -13.062   7.878
  187    HB2  SER  26           HB2      SER  26   1.354 -13.301   7.129
  188    HB3  SER  26           HB1      SER  26   0.659 -13.463   8.748
  189    HG   SER  26           HG       SER  26  -0.545 -15.290   7.845
  190    H    ALA  27           HN       ALA  27   0.340 -11.301   5.506
  191    HA   ALA  27           HA       ALA  27   0.892  -8.942   6.967
  192    HB1  ALA  27           HB1      ALA  27   2.046  -9.515   4.866
  193    HB2  ALA  27           HB2      ALA  27   1.334  -7.906   4.774
  194    HB3  ALA  27           HB3      ALA  27   0.548  -9.262   3.960
  195    H    ILE  28           HN       ILE  28  -1.827  -9.823   4.846
  196    HA   ILE  28           HA       ILE  28  -3.239  -7.370   4.876
  197    HB   ILE  28           HB       ILE  28  -4.327 -10.203   4.559
  198   HG12  ILE  28          HG12      ILE  28  -2.625  -9.656   2.876
  199   HG13  ILE  28          HG11      ILE  28  -4.215  -9.751   2.127
  200   HG21  ILE  28          HG21      ILE  28  -6.262  -9.165   3.411
  201   HG22  ILE  28          HG22      ILE  28  -5.646  -7.563   3.829
  202   HG23  ILE  28          HG23      ILE  28  -6.163  -8.675   5.102
  203   HD11  ILE  28          HD11      ILE  28  -4.339  -7.288   2.171
  204   HD12  ILE  28          HD12      ILE  28  -2.989  -7.905   1.222
  205   HD13  ILE  28          HD13      ILE  28  -2.703  -7.245   2.832
  206    H    SER  29           HN       SER  29  -3.484 -10.248   6.909
  207    HA   SER  29           HA       SER  29  -5.596  -9.486   8.593
  208    HB2  SER  29           HB2      SER  29  -3.171 -11.206   9.294
  209    HB3  SER  29           HB1      SER  29  -4.739 -11.223  10.112
  210    HG   SER  29           HG       SER  29  -4.338 -11.861   7.364
  211    H    GLN  30           HN       GLN  30  -2.138  -8.882   8.729
  212    HA   GLN  30           HA       GLN  30  -2.017  -7.565  11.254
  213    HB2  GLN  30           HB2      GLN  30  -0.081  -8.687  10.264
  214    HB3  GLN  30           HB1      GLN  30  -0.124  -7.614   8.871
  215    HG2  GLN  30           HG2      GLN  30   0.394  -5.702  10.401
  216    HG3  GLN  30           HG1      GLN  30   0.572  -6.863  11.721
  217   HE21  GLN  30          HE21      GLN  30   1.877  -5.774   8.671
  218   HE22  GLN  30          HE22      GLN  30   3.442  -6.480   8.855
  219    H    TRP  31           HN       TRP  31  -2.452  -6.435   7.911
  220    HA   TRP  31           HA       TRP  31  -2.076  -3.651   8.428
  221    HB2  TRP  31           HB2      TRP  31  -3.442  -5.073   6.112
  222    HB3  TRP  31           HB1      TRP  31  -3.179  -3.332   6.169
  223    HD1  TRP  31           HD1      TRP  31  -0.064  -4.516   7.546
  224    HE1  TRP  31           HE1      TRP  31   1.731  -4.817   5.729
  225    HE3  TRP  31           HE3      TRP  31  -3.057  -4.465   3.399
  226    HZ2  TRP  31           HZ2      TRP  31   1.860  -4.999   2.919
  227    HZ3  TRP  31           HZ3      TRP  31  -2.029  -4.694   1.197
  228    HH2  TRP  31           HH2      TRP  31   0.377  -4.955   0.954
  229    H    ARG  32           HN       ARG  32  -4.870  -5.793   8.369
  230    HA   ARG  32           HA       ARG  32  -6.864  -3.774   8.771
  231    HB2  ARG  32           HB2      ARG  32  -7.459  -5.988   7.822
  232    HB3  ARG  32           HB1      ARG  32  -6.979  -6.782   9.320
  233    HG2  ARG  32           HG2      ARG  32  -8.790  -5.700  10.537
  234    HG3  ARG  32           HG1      ARG  32  -9.216  -4.735   9.123
  235    HD2  ARG  32           HD2      ARG  32 -10.807  -6.530   9.358
  236    HD3  ARG  32           HD1      ARG  32  -9.829  -6.827   7.923
  237    HE   ARG  32           HE       ARG  32  -8.575  -8.268   9.857
  238   HH11  ARG  32          HH11      ARG  32 -12.209  -9.825   9.096
  239   HH12  ARG  32          HH12      ARG  32 -11.897  -8.163   8.708
  240   HH21  ARG  32          HH21      ARG  32  -8.996 -10.447  10.366
  241   HH22  ARG  32          HH22      ARG  32 -10.562 -11.127  10.041
  242    H    ALA  33           HN       ALA  33  -4.974  -5.921  10.853
  243    HA   ALA  33           HA       ALA  33  -6.191  -5.112  13.300
  244    HB1  ALA  33           HB1      ALA  33  -5.067  -7.290  13.091
  245    HB2  ALA  33           HB2      ALA  33  -4.342  -6.345  14.393
  246    HB3  ALA  33           HB3      ALA  33  -3.516  -6.483  12.837
  247    H    ARG  34           HN       ARG  34  -3.785  -3.719  11.276
  248    HA   ARG  34           HA       ARG  34  -2.699  -1.856  13.226
  249    HB2  ARG  34           HB2      ARG  34  -1.296  -2.714  11.385
  250    HB3  ARG  34           HB1      ARG  34  -2.447  -2.121  10.200
  251    HG2  ARG  34           HG2      ARG  34  -0.557  -0.672  10.224
  252    HG3  ARG  34           HG1      ARG  34  -1.931   0.201  10.884
  253    HD2  ARG  34           HD2      ARG  34   0.164   0.632  12.148
  254    HD3  ARG  34           HD1      ARG  34  -1.097  -0.091  13.151
  255    HE   ARG  34           HE       ARG  34   0.587  -2.101  12.075
  256   HH11  ARG  34          HH11      ARG  34   1.794  -0.453  15.541
  257   HH12  ARG  34          HH12      ARG  34   0.633   0.387  14.565
  258   HH21  ARG  34          HH21      ARG  34   2.076  -3.194  13.378
  259   HH22  ARG  34          HH22      ARG  34   2.612  -2.485  14.866
  260    H    GLY  35           HN       GLY  35  -5.107  -1.967  10.680
  261    HA2  GLY  35           HA2      GLY  35  -7.022  -0.671  10.379
  262    HA3  GLY  35           HA1      GLY  35  -6.441   0.464  11.590
  263    H    ARG  36           HN       ARG  36  -4.005  -0.236   9.401
  264    HA   ARG  36           HA       ARG  36  -4.537   1.725   7.356
  265    HB2  ARG  36           HB2      ARG  36  -4.004   3.251   9.222
  266    HB3  ARG  36           HB1      ARG  36  -2.543   2.348   9.592
  267    HG2  ARG  36           HG2      ARG  36  -1.515   3.074   7.510
  268    HG3  ARG  36           HG1      ARG  36  -3.001   3.885   7.016
  269    HD2  ARG  36           HD2      ARG  36  -1.491   4.648   9.539
  270    HD3  ARG  36           HD1      ARG  36  -1.129   5.351   7.968
  271    HE   ARG  36           HE       ARG  36  -3.117   6.532   8.005
  272   HH11  ARG  36          HH11      ARG  36  -2.889   4.563  10.901
  273   HH12  ARG  36          HH12      ARG  36  -4.165   5.406  11.718
  274   HH21  ARG  36          HH21      ARG  36  -4.818   7.606   9.069
  275   HH22  ARG  36          HH22      ARG  36  -5.264   7.135  10.681
  276    H    VAL  37           HN       VAL  37  -3.127   1.369   5.615
  277    HA   VAL  37           HA       VAL  37  -1.380  -0.984   5.808
  278    HB   VAL  37           HB       VAL  37  -1.261  -0.927   3.366
  279   HG11  VAL  37          HG11      VAL  37  -3.644  -1.258   2.821
  280   HG12  VAL  37          HG12      VAL  37  -4.097  -0.496   4.348
  281   HG13  VAL  37          HG13      VAL  37  -3.200  -2.018   4.350
  282   HG21  VAL  37          HG21      VAL  37  -2.433   0.784   2.009
  283   HG22  VAL  37          HG22      VAL  37  -1.153   1.504   2.985
  284   HG23  VAL  37          HG23      VAL  37  -2.839   1.676   3.477
  285    HA   PRO  38           HA       PRO  38   2.598   1.288   5.575
  286    HB2  PRO  38           HB2      PRO  38   3.300  -0.778   3.478
  287    HB3  PRO  38           HB1      PRO  38   4.196  -0.296   4.937
  288    HG2  PRO  38           HG2      PRO  38   2.900  -2.583   4.905
  289    HG3  PRO  38           HG1      PRO  38   2.849  -1.547   6.352
  290    HD2  PRO  38           HD2      PRO  38   0.754  -1.901   4.213
  291    HD3  PRO  38           HD1      PRO  38   0.562  -1.828   5.980
  292    H    ALA  39           HN       ALA  39   4.038   2.256   3.912
  293    HA   ALA  39           HA       ALA  39   2.694   4.012   2.235
  294    HB1  ALA  39           HB1      ALA  39   4.942   4.421   3.146
  295    HB2  ALA  39           HB2      ALA  39   4.945   4.607   1.391
  296    HB3  ALA  39           HB3      ALA  39   5.614   3.146   2.123
  297    H    GLY  40           HN       GLY  40   1.904   3.821   0.177
  298    HA2  GLY  40           HA2      GLY  40   1.793   3.342  -2.066
  299    HA3  GLY  40           HA1      GLY  40   3.279   2.422  -1.928
  300    H    ARG  41           HN       ARG  41  -0.094   2.106  -0.712
  301    HA   ARG  41           HA       ARG  41  -0.608  -0.224  -2.328
  302    HB2  ARG  41           HB2      ARG  41   0.724  -1.100  -0.291
  303    HB3  ARG  41           HB1      ARG  41  -0.653  -0.645   0.698
  304    HG2  ARG  41           HG2      ARG  41  -0.950  -2.940   0.334
  305    HG3  ARG  41           HG1      ARG  41  -2.048  -2.202  -0.830
  306    HD2  ARG  41           HD2      ARG  41   0.738  -3.239  -1.455
  307    HD3  ARG  41           HD1      ARG  41  -0.760  -4.113  -1.772
  308    HE   ARG  41           HE       ARG  41  -1.184  -1.853  -3.166
  309   HH11  ARG  41          HH11      ARG  41   1.621  -3.983  -3.082
  310   HH12  ARG  41          HH12      ARG  41   2.096  -3.623  -4.708
  311   HH21  ARG  41          HH21      ARG  41  -0.525  -1.393  -5.311
  312   HH22  ARG  41          HH22      ARG  41   0.887  -2.161  -5.970
  313    H    CYS  42           HN       CYS  42  -1.608   2.206  -0.109
  314    HA   CYS  42           HA       CYS  42  -4.252   1.482   0.458
  315    HB2  CYS  42           HB2      CYS  42  -3.234   3.269   1.693
  316    HB3  CYS  42           HB1      CYS  42  -2.930   4.203   0.234
  317    H    ILE  43           HN       ILE  43  -2.884   2.942  -2.427
  318    HA   ILE  43           HA       ILE  43  -5.132   3.948  -3.744
  319    HB   ILE  43           HB       ILE  43  -2.652   2.603  -4.904
  320   HG12  ILE  43          HG12      ILE  43  -3.341   5.556  -4.524
  321   HG13  ILE  43          HG11      ILE  43  -2.190   4.640  -3.559
  322   HG21  ILE  43          HG21      ILE  43  -4.725   4.273  -6.381
  323   HG22  ILE  43          HG22      ILE  43  -4.415   2.550  -6.597
  324   HG23  ILE  43          HG23      ILE  43  -3.184   3.722  -7.053
  325   HD11  ILE  43          HD11      ILE  43  -1.939   5.326  -6.483
  326   HD12  ILE  43          HD12      ILE  43  -0.785   4.356  -5.562
  327   HD13  ILE  43          HD13      ILE  43  -1.051   6.049  -5.143
  328    H    ASP  44           HN       ASP  44  -3.856   0.634  -3.667
  329    HA   ASP  44           HA       ASP  44  -5.644  -0.454  -5.632
  330    HB2  ASP  44           HB2      ASP  44  -4.054  -1.969  -3.515
  331    HB3  ASP  44           HB1      ASP  44  -4.651  -2.599  -5.051
  332    H    ILE  45           HN       ILE  45  -5.441  -0.630  -2.083
  333    HA   ILE  45           HA       ILE  45  -7.804  -2.133  -1.645
  334    HB   ILE  45           HB       ILE  45  -6.172  -0.303   0.160
  335   HG12  ILE  45          HG12      ILE  45  -6.506  -3.325  -0.093
  336   HG13  ILE  45          HG11      ILE  45  -5.038  -2.376  -0.298
  337   HG21  ILE  45          HG21      ILE  45  -8.588  -1.920   1.037
  338   HG22  ILE  45          HG22      ILE  45  -8.497  -0.161   0.957
  339   HG23  ILE  45          HG23      ILE  45  -7.486  -1.035   2.101
  340   HD11  ILE  45          HD11      ILE  45  -4.913  -3.604   1.749
  341   HD12  ILE  45          HD12      ILE  45  -6.474  -2.989   2.292
  342   HD13  ILE  45          HD13      ILE  45  -5.094  -1.898   2.147
  343    H    GLU  46           HN       GLU  46  -7.248   1.283  -2.192
  344    HA   GLU  46           HA       GLU  46  -9.851   2.227  -1.432
  345    HB2  GLU  46           HB2      GLU  46  -7.795   3.667  -1.426
  346    HB3  GLU  46           HB1      GLU  46  -7.772   3.598  -3.184
  347    HG2  GLU  46           HG2      GLU  46 -10.032   4.660  -3.184
  348    HG3  GLU  46           HG1      GLU  46  -9.902   4.835  -1.431
  349    H    LEU  47           HN       LEU  47  -8.358   1.057  -4.389
  350    HA   LEU  47           HA       LEU  47 -10.367   1.608  -6.255
  351    HB2  LEU  47           HB2      LEU  47  -7.947   0.120  -6.195
  352    HB3  LEU  47           HB1      LEU  47  -9.158  -1.060  -6.649
  353    HG   LEU  47           HG       LEU  47  -8.587   1.544  -8.108
  354   HD11  LEU  47          HD11      LEU  47  -7.906  -1.313  -8.877
  355   HD12  LEU  47          HD12      LEU  47  -6.768  -0.055  -8.385
  356   HD13  LEU  47          HD13      LEU  47  -7.666   0.114  -9.889
  357   HD21  LEU  47          HD21      LEU  47 -10.500  -0.698  -8.857
  358   HD22  LEU  47          HD22      LEU  47 -10.104   0.697  -9.865
  359   HD23  LEU  47          HD23      LEU  47 -10.951   0.929  -8.339
  360    H    TYR  48           HN       TYR  48 -10.072  -0.918  -3.814
  361    HA   TYR  48           HA       TYR  48 -12.543  -2.278  -4.572
  362    HB2  TYR  48           HB2      TYR  48 -10.830  -2.818  -2.111
  363    HB3  TYR  48           HB1      TYR  48 -11.990  -3.921  -2.869
  364    HD1  TYR  48           HD1      TYR  48  -8.745  -3.977  -2.256
  365    HD2  TYR  48           HD2      TYR  48 -11.173  -3.677  -5.769
  366    HE1  TYR  48           HE1      TYR  48  -6.909  -4.886  -3.611
  367    HE2  TYR  48           HE2      TYR  48  -9.331  -4.593  -7.112
  368    HH   TYR  48           HH       TYR  48  -6.911  -4.794  -7.015
  369    H    THR  49           HN       THR  49 -11.443   0.093  -2.241
  370    HA   THR  49           HA       THR  49 -14.113   0.188  -0.987
  371    HB   THR  49           HB       THR  49 -13.131   1.475   0.859
  372    HG1  THR  49           HG1      THR  49 -10.517   1.037  -0.115
  373   HG21  THR  49          HG21      THR  49 -11.486  -1.012   0.262
  374   HG22  THR  49          HG22      THR  49 -13.087  -0.991   1.005
  375   HG23  THR  49          HG23      THR  49 -11.720  -0.271   1.851
  376    H    ASP  50           HN       ASP  50 -14.549   0.948  -3.173
  377    HA   ASP  50           HA       ASP  50 -13.887   3.140  -4.569
  378    HB2  ASP  50           HB2      ASP  50 -16.780   2.290  -4.112
  379    HB3  ASP  50           HB1      ASP  50 -16.163   3.156  -5.520
  380    H    GLY  51           HN       GLY  51 -16.472   3.232  -2.145
  381    HA2  GLY  51           HA2      GLY  51 -15.606   5.805  -1.093
  382    HA3  GLY  51           HA1      GLY  51 -17.183   5.829  -1.891
  383    H    ARG  52           HN       ARG  52 -15.741   3.176  -0.139
  384    HA   ARG  52           HA       ARG  52 -18.225   2.732   1.313
  385    HB2  ARG  52           HB2      ARG  52 -15.699   1.093   1.710
  386    HB3  ARG  52           HB1      ARG  52 -17.378   0.577   1.823
  387    HG2  ARG  52           HG2      ARG  52 -15.829   1.181  -0.713
  388    HG3  ARG  52           HG1      ARG  52 -16.269  -0.415  -0.106
  389    HD2  ARG  52           HD2      ARG  52 -18.675   0.192  -0.413
  390    HD3  ARG  52           HD1      ARG  52 -18.158   1.729  -1.116
  391    HE   ARG  52           HE       ARG  52 -17.187   0.546  -2.955
  392   HH11  ARG  52          HH11      ARG  52 -19.370  -2.703  -2.099
  393   HH12  ARG  52          HH12      ARG  52 -19.145  -1.491  -0.878
  394   HH21  ARG  52          HH21      ARG  52 -18.420  -2.453  -4.155
  395   HH22  ARG  52          HH22      ARG  52 -17.466  -1.048  -4.518
  396    H    VAL  53           HN       VAL  53 -14.806   3.199   2.032
  397    HA   VAL  53           HA       VAL  53 -15.292   4.674   4.477
  398    HB   VAL  53           HB       VAL  53 -15.310   2.298   5.258
  399   HG11  VAL  53          HG11      VAL  53 -13.960   1.268   3.503
  400   HG12  VAL  53          HG12      VAL  53 -13.319   0.864   5.095
  401   HG13  VAL  53          HG13      VAL  53 -12.511   2.083   4.108
  402   HG21  VAL  53          HG21      VAL  53 -14.423   4.006   6.807
  403   HG22  VAL  53          HG22      VAL  53 -12.795   3.756   6.169
  404   HG23  VAL  53          HG23      VAL  53 -13.612   2.458   7.044
  405    H    GLU  54           HN       GLU  54 -13.328   5.735   5.184
  406    HA   GLU  54           HA       GLU  54 -11.597   6.675   3.159
  407    HB2  GLU  54           HB2      GLU  54 -10.320   7.690   5.100
  408    HB3  GLU  54           HB1      GLU  54 -12.040   8.061   5.088
  409    HG2  GLU  54           HG2      GLU  54 -12.437   6.348   6.807
  410    HG3  GLU  54           HG1      GLU  54 -10.725   5.939   6.812
  411    H    CYS  55           HN       CYS  55  -9.868   5.716   2.266
  412    HA   CYS  55           HA       CYS  55  -8.451   3.546   3.624
  413    HB2  CYS  55           HB2      CYS  55  -8.915   3.230   1.243
  414    HB3  CYS  55           HB1      CYS  55  -8.077   4.730   0.844
  415    H    ARG  56           HN       ARG  56  -6.370   3.736   4.428
  416    HA   ARG  56           HA       ARG  56  -4.978   6.326   4.174
  417    HB2  ARG  56           HB2      ARG  56  -5.267   4.837   6.820
  418    HB3  ARG  56           HB1      ARG  56  -4.308   6.282   6.550
  419    HG2  ARG  56           HG2      ARG  56  -6.168   7.175   7.576
  420    HG3  ARG  56           HG1      ARG  56  -6.614   7.367   5.882
  421    HD2  ARG  56           HD2      ARG  56  -8.514   6.530   7.161
  422    HD3  ARG  56           HD1      ARG  56  -7.974   5.289   6.030
  423    HE   ARG  56           HE       ARG  56  -6.977   4.088   7.850
  424   HH11  ARG  56          HH11      ARG  56  -9.259   6.060  10.492
  425   HH12  ARG  56          HH12      ARG  56  -9.053   6.719   8.904
  426   HH21  ARG  56          HH21      ARG  56  -7.270   3.246   9.922
  427   HH22  ARG  56          HH22      ARG  56  -8.250   4.086  11.078
  428    H    GLU  57           HN       GLU  57  -2.786   6.200   4.076
  429    HA   GLU  57           HA       GLU  57  -1.468   3.557   4.318
  430    HB2  GLU  57           HB2      GLU  57   0.284   4.718   2.685
  431    HB3  GLU  57           HB1      GLU  57  -1.154   3.951   2.047
  432    HG2  GLU  57           HG2      GLU  57  -0.722   6.069   0.932
  433    HG3  GLU  57           HG1      GLU  57  -2.254   6.098   1.792
  434    H    LEU  58           HN       LEU  58   0.789   3.651   4.924
  435    HA   LEU  58           HA       LEU  58   1.429   5.732   6.876
  436    HB2  LEU  58           HB2      LEU  58   2.624   3.003   6.297
  437    HB3  LEU  58           HB1      LEU  58   3.332   4.116   7.456
  438    HG   LEU  58           HG       LEU  58   0.457   3.186   7.766
  439   HD11  LEU  58          HD11      LEU  58   2.881   1.704   8.834
  440   HD12  LEU  58          HD12      LEU  58   1.751   1.121   7.611
  441   HD13  LEU  58          HD13      LEU  58   1.196   1.377   9.263
  442   HD21  LEU  58          HD21      LEU  58   1.143   5.100   9.141
  443   HD22  LEU  58          HD22      LEU  58   2.502   4.178   9.786
  444   HD23  LEU  58          HD23      LEU  58   0.845   3.689  10.156
  445    H    ARG  59           HN       ARG  59   3.567   6.708   6.834
  446    HA   ARG  59           HA       ARG  59   4.772   6.994   4.187
  447    HB2  ARG  59           HB2      ARG  59   6.133   8.775   5.074
  448    HB3  ARG  59           HB1      ARG  59   4.480   9.039   5.633
  449    HG2  ARG  59           HG2      ARG  59   6.641   7.764   7.346
  450    HG3  ARG  59           HG1      ARG  59   6.325   9.498   7.325
  451    HD2  ARG  59           HD2      ARG  59   4.053   9.106   8.164
  452    HD3  ARG  59           HD1      ARG  59   4.317   7.359   8.102
  453    HE   ARG  59           HE       ARG  59   6.263   8.702   9.736
  454   HH11  ARG  59          HH11      ARG  59   2.983   7.441   9.765
  455   HH12  ARG  59          HH12      ARG  59   2.966   7.213  11.481
  456   HH21  ARG  59          HH21      ARG  59   6.239   8.306  11.987
  457   HH22  ARG  59          HH22      ARG  59   4.796   7.693  12.737
  458    HA   PRO  60           HA       PRO  60   8.141   4.066   4.828
  459    HB2  PRO  60           HB2      PRO  60  10.426   5.385   4.046
  460    HB3  PRO  60           HB1      PRO  60   9.178   4.855   2.898
  461    HG2  PRO  60           HG2      PRO  60   9.548   7.573   4.139
  462    HG3  PRO  60           HG1      PRO  60   9.303   7.147   2.427
  463    HD2  PRO  60           HD2      PRO  60   7.236   7.996   3.910
  464    HD3  PRO  60           HD1      PRO  60   7.021   6.675   2.728
  465    H    ASP  61           HN       ASP  61   7.642   6.199   7.143
  466    HA   ASP  61           HA       ASP  61  10.056   5.793   8.734
  467    HB2  ASP  61           HB2      ASP  61   8.934   8.010   8.762
  468    HB3  ASP  61           HB1      ASP  61   7.442   7.254   9.309
  469    H    VAL  62           HN       VAL  62   6.655   4.850   8.533
  470    HA   VAL  62           HA       VAL  62   7.124   2.578  10.383
  471    HB   VAL  62           HB       VAL  62   4.471   4.025   9.871
  472   HG11  VAL  62          HG11      VAL  62   3.533   2.573  11.643
  473   HG12  VAL  62          HG12      VAL  62   5.074   1.716  11.759
  474   HG13  VAL  62          HG13      VAL  62   4.126   1.630  10.274
  475   HG21  VAL  62          HG21      VAL  62   6.190   4.024  12.390
  476   HG22  VAL  62          HG22      VAL  62   4.606   4.791  12.218
  477   HG23  VAL  62          HG23      VAL  62   5.976   5.381  11.278
  478    H    PHE  63           HN       PHE  63   7.226   0.719   9.229
  479    HA   PHE  63           HA       PHE  63   5.560   0.378   6.800
  480    HB2  PHE  63           HB2      PHE  63   7.911   1.077   6.192
  481    HB3  PHE  63           HB1      PHE  63   8.519  -0.360   7.004
  482    HD1  PHE  63           HD1      PHE  63   6.446   0.819   4.138
  483    HD2  PHE  63           HD2      PHE  63   8.514  -2.503   5.870
  484    HE1  PHE  63           HE1      PHE  63   6.166  -0.451   2.050
  485    HE2  PHE  63           HE2      PHE  63   8.231  -3.759   3.778
  486    HZ   PHE  63           HZ       PHE  63   7.061  -2.738   1.864
  487    H    GLY  64           HN       GLY  64   4.164  -1.013   7.836
  488    HA2  GLY  64           HA2      GLY  64   5.194  -3.398   9.250
  489    HA3  GLY  64           HA1      GLY  64   3.551  -2.776   9.289
  490    H    ALA  65           HN       ALA  65   5.888  -4.022   6.890
  491    HA   ALA  65           HA       ALA  65   3.949  -6.052   6.027
  492    HB1  ALA  65           HB1      ALA  65   4.280  -5.524   3.617
  493    HB2  ALA  65           HB2      ALA  65   5.233  -4.104   4.057
  494    HB3  ALA  65           HB3      ALA  65   3.524  -4.184   4.479
  Start of MODEL    8
    1    H1   MET   1           HT1      MET   1 -14.431  -2.767  11.584
    2    H2   MET   1           HT2      MET   1 -13.341  -3.706  10.700
    3    H3   MET   1           HT3      MET   1 -14.975  -4.134  10.752
    4    HA   MET   1           HA       MET   1 -14.425  -3.132   8.655
    5    HB2  MET   1           HB2      MET   1 -16.220  -1.447  10.459
    6    HB3  MET   1           HB1      MET   1 -16.144  -1.237   8.712
    7    HG2  MET   1           HG2      MET   1 -17.031  -3.753  10.157
    8    HG3  MET   1           HG1      MET   1 -18.083  -2.586   9.345
    9    HE1  MET   1           HE1      MET   1 -18.208  -5.719   6.936
   10    HE2  MET   1           HE2      MET   1 -19.173  -4.581   7.876
   11    HE3  MET   1           HE3      MET   1 -18.132  -5.745   8.698
   12    H    ASN   2           HN       ASN   2 -12.380  -2.489   8.305
   13    HA   ASN   2           HA       ASN   2 -11.905   0.413   8.382
   14    HB2  ASN   2           HB2      ASN   2  -9.437  -0.002   8.736
   15    HB3  ASN   2           HB1      ASN   2 -10.425  -0.356  10.142
   16   HD21  ASN   2          HD21      ASN   2  -9.241  -1.867  11.134
   17   HD22  ASN   2          HD22      ASN   2  -8.729  -3.360  10.440
   18    H    ALA   3           HN       ALA   3 -10.142   0.909   6.706
   19    HA   ALA   3           HA       ALA   3 -10.939   0.469   4.168
   20    HB1  ALA   3           HB1      ALA   3  -9.230   2.109   4.838
   21    HB2  ALA   3           HB2      ALA   3  -8.706   1.179   3.432
   22    HB3  ALA   3           HB3      ALA   3  -8.057   0.802   5.029
   23    H    ILE   4           HN       ILE   4  -8.651  -1.578   5.894
   24    HA   ILE   4           HA       ILE   4  -7.806  -3.152   3.644
   25    HB   ILE   4           HB       ILE   4  -7.470  -3.942   6.566
   26   HG12  ILE   4          HG12      ILE   4  -5.124  -2.750   6.307
   27   HG13  ILE   4          HG11      ILE   4  -5.927  -1.801   5.069
   28   HG21  ILE   4          HG21      ILE   4  -5.742  -4.534   4.148
   29   HG22  ILE   4          HG22      ILE   4  -6.857  -5.655   4.929
   30   HG23  ILE   4          HG23      ILE   4  -5.435  -5.083   5.800
   31   HD11  ILE   4          HD11      ILE   4  -6.641  -1.931   8.004
   32   HD12  ILE   4          HD12      ILE   4  -7.551  -1.015   6.799
   33   HD13  ILE   4          HD13      ILE   4  -5.872  -0.594   7.152
   34    H    ASP   5           HN       ASP   5 -10.001  -3.500   6.373
   35    HA   ASP   5           HA       ASP   5 -10.816  -6.191   5.994
   36    HB2  ASP   5           HB2      ASP   5 -11.011  -5.027   8.168
   37    HB3  ASP   5           HB1      ASP   5 -12.205  -3.926   7.488
   38    H    ILE   6           HN       ILE   6 -12.027  -3.118   4.815
   39    HA   ILE   6           HA       ILE   6 -14.534  -4.075   3.789
   40    HB   ILE   6           HB       ILE   6 -12.966  -1.506   3.274
   41   HG12  ILE   6          HG12      ILE   6 -13.822  -1.670   5.563
   42   HG13  ILE   6          HG11      ILE   6 -14.727  -0.444   4.690
   43   HG21  ILE   6          HG21      ILE   6 -14.991  -0.570   2.209
   44   HG22  ILE   6          HG22      ILE   6 -15.771  -2.151   2.284
   45   HG23  ILE   6          HG23      ILE   6 -14.330  -1.921   1.290
   46   HD11  ILE   6          HD11      ILE   6 -16.191  -1.728   6.105
   47   HD12  ILE   6          HD12      ILE   6 -15.666  -3.235   5.358
   48   HD13  ILE   6          HD13      ILE   6 -16.583  -2.055   4.418
   49    H    ALA   7           HN       ALA   7 -11.267  -3.616   2.485
   50    HA   ALA   7           HA       ALA   7 -11.842  -4.307  -0.212
   51    HB1  ALA   7           HB1      ALA   7  -9.228  -4.672   1.283
   52    HB2  ALA   7           HB2      ALA   7  -9.747  -3.193   0.467
   53    HB3  ALA   7           HB3      ALA   7  -9.449  -4.661  -0.472
   54    H    ILE   8           HN       ILE   8 -11.091  -6.261   2.655
   55    HA   ILE   8           HA       ILE   8 -11.003  -8.850   1.469
   56    HB   ILE   8           HB       ILE   8 -12.033  -8.111   4.264
   57   HG12  ILE   8          HG12      ILE   8  -9.209  -8.945   3.470
   58   HG13  ILE   8          HG11      ILE   8  -9.702  -7.288   3.766
   59   HG21  ILE   8          HG21      ILE   8 -11.460 -10.437   4.909
   60   HG22  ILE   8          HG22      ILE   8 -11.017 -10.795   3.240
   61   HG23  ILE   8          HG23      ILE   8 -12.688 -10.401   3.643
   62   HD11  ILE   8          HD11      ILE   8 -10.193  -7.860   6.096
   63   HD12  ILE   8          HD12      ILE   8  -8.518  -8.181   5.650
   64   HD13  ILE   8          HD13      ILE   8  -9.661  -9.515   5.788
   65    H    ASN   9           HN       ASN   9 -13.648  -6.867   2.741
   66    HA   ASN   9           HA       ASN   9 -15.772  -8.737   2.366
   67    HB2  ASN   9           HB2      ASN   9 -15.896  -5.692   2.619
   68    HB3  ASN   9           HB1      ASN   9 -17.264  -6.789   2.798
   69   HD21  ASN   9          HD21      ASN   9 -16.145  -4.869   4.725
   70   HD22  ASN   9          HD22      ASN   9 -15.711  -5.782   6.125
   71    H    LYS  10           HN       LYS  10 -14.257  -6.349   0.297
   72    HA   LYS  10           HA       LYS  10 -16.410  -6.196  -1.632
   73    HB2  LYS  10           HB2      LYS  10 -14.833  -4.289  -1.020
   74    HB3  LYS  10           HB1      LYS  10 -13.562  -5.104  -1.910
   75    HG2  LYS  10           HG2      LYS  10 -16.164  -4.372  -3.286
   76    HG3  LYS  10           HG1      LYS  10 -14.916  -3.156  -3.031
   77    HD2  LYS  10           HD2      LYS  10 -13.300  -4.598  -4.281
   78    HD3  LYS  10           HD1      LYS  10 -14.611  -5.738  -4.607
   79    HE2  LYS  10           HE2      LYS  10 -14.472  -2.852  -5.551
   80    HE3  LYS  10           HE1      LYS  10 -14.237  -4.288  -6.546
   81    HZ1  LYS  10           HZ1      LYS  10 -16.446  -3.402  -6.828
   82    HZ2  LYS  10           HZ2      LYS  10 -16.751  -3.518  -5.168
   83    HZ3  LYS  10           HZ3      LYS  10 -16.530  -4.922  -6.086
   84    H    LEU  11           HN       LEU  11 -13.150  -7.695  -1.509
   85    HA   LEU  11           HA       LEU  11 -13.499  -8.948  -4.126
   86    HB2  LEU  11           HB2      LEU  11 -11.249  -9.450  -2.140
   87    HB3  LEU  11           HB1      LEU  11 -11.282  -9.904  -3.832
   88    HG   LEU  11           HG       LEU  11 -10.821  -7.177  -2.615
   89   HD11  LEU  11          HD11      LEU  11  -8.885  -7.134  -4.131
   90   HD12  LEU  11          HD12      LEU  11  -9.331  -8.724  -4.757
   91   HD13  LEU  11          HD13      LEU  11  -8.860  -8.537  -3.070
   92   HD21  LEU  11          HD21      LEU  11 -11.618  -7.579  -5.512
   93   HD22  LEU  11          HD22      LEU  11 -11.036  -6.080  -4.774
   94   HD23  LEU  11          HD23      LEU  11 -12.572  -6.767  -4.266
   95    H    GLY  12           HN       GLY  12 -14.152  -9.721  -0.840
   96    HA2  GLY  12           HA2      GLY  12 -15.661 -11.415  -0.233
   97    HA3  GLY  12           HA1      GLY  12 -15.186 -12.368  -1.629
   98    H    SER  13           HN       SER  13 -12.239 -11.700  -0.795
   99    HA   SER  13           HA       SER  13 -11.903 -13.347   1.581
  100    HB2  SER  13           HB2      SER  13 -10.494 -15.038   0.374
  101    HB3  SER  13           HB1      SER  13 -12.172 -15.053  -0.163
  102    HG   SER  13           HG       SER  13 -11.041 -15.023  -2.014
  103    H    VAL  14           HN       VAL  14  -9.731 -13.514   2.287
  104    HA   VAL  14           HA       VAL  14  -8.001 -11.245   1.754
  105    HB   VAL  14           HB       VAL  14  -7.783 -13.614   3.682
  106   HG11  VAL  14          HG11      VAL  14  -5.922 -11.216   3.514
  107   HG12  VAL  14          HG12      VAL  14  -5.500 -12.876   3.104
  108   HG13  VAL  14          HG13      VAL  14  -5.896 -12.457   4.770
  109   HG21  VAL  14          HG21      VAL  14  -8.382 -10.675   4.133
  110   HG22  VAL  14          HG22      VAL  14  -8.206 -11.889   5.416
  111   HG23  VAL  14          HG23      VAL  14  -9.533 -12.014   4.259
  112    H    SER  15           HN       SER  15  -8.237 -14.612   0.845
  113    HA   SER  15           HA       SER  15  -5.557 -15.039   0.011
  114    HB2  SER  15           HB2      SER  15  -6.598 -16.986  -1.254
  115    HB3  SER  15           HB1      SER  15  -6.968 -16.934   0.474
  116    HG   SER  15           HG       SER  15  -8.791 -17.306  -1.017
  117    H    ALA  16           HN       ALA  16  -8.503 -13.988  -1.703
  118    HA   ALA  16           HA       ALA  16  -7.201 -13.504  -4.236
  119    HB1  ALA  16           HB1      ALA  16  -9.319 -12.444  -4.909
  120    HB2  ALA  16           HB2      ALA  16  -9.896 -12.504  -3.242
  121    HB3  ALA  16           HB3      ALA  16  -9.619 -14.001  -4.132
  122    H    LEU  17           HN       LEU  17  -7.961 -11.574  -1.359
  123    HA   LEU  17           HA       LEU  17  -7.466  -9.005  -2.418
  124    HB2  LEU  17           HB2      LEU  17  -8.645  -9.324  -0.266
  125    HB3  LEU  17           HB1      LEU  17  -7.166  -9.935   0.464
  126    HG   LEU  17           HG       LEU  17  -6.089  -7.762   0.235
  127   HD11  LEU  17          HD11      LEU  17  -7.290  -5.761  -0.549
  128   HD12  LEU  17          HD12      LEU  17  -8.672  -6.758  -1.009
  129   HD13  LEU  17          HD13      LEU  17  -7.121  -6.957  -1.831
  130   HD21  LEU  17          HD21      LEU  17  -8.791  -7.460   1.547
  131   HD22  LEU  17          HD22      LEU  17  -7.362  -6.462   1.839
  132   HD23  LEU  17          HD23      LEU  17  -7.345  -8.169   2.272
  133    H    ALA  18           HN       ALA  18  -5.349 -11.144  -0.572
  134    HA   ALA  18           HA       ALA  18  -3.063  -9.463  -0.566
  135    HB1  ALA  18           HB1      ALA  18  -3.487 -11.189   1.130
  136    HB2  ALA  18           HB2      ALA  18  -1.917 -11.424   0.366
  137    HB3  ALA  18           HB3      ALA  18  -3.281 -12.452  -0.085
  138    H    ALA  19           HN       ALA  19  -4.134 -12.111  -2.690
  139    HA   ALA  19           HA       ALA  19  -1.834 -12.366  -4.315
  140    HB1  ALA  19           HB1      ALA  19  -3.352 -13.359  -5.989
  141    HB2  ALA  19           HB2      ALA  19  -4.750 -12.754  -5.093
  142    HB3  ALA  19           HB3      ALA  19  -3.700 -13.973  -4.372
  143    H    ALA  20           HN       ALA  20  -4.629 -10.187  -4.503
  144    HA   ALA  20           HA       ALA  20  -3.920  -8.821  -6.913
  145    HB1  ALA  20           HB1      ALA  20  -5.742  -7.929  -4.645
  146    HB2  ALA  20           HB2      ALA  20  -6.230  -8.870  -6.055
  147    HB3  ALA  20           HB3      ALA  20  -5.671  -7.210  -6.256
  148    H    LEU  21           HN       LEU  21  -3.185  -8.338  -3.508
  149    HA   LEU  21           HA       LEU  21  -1.975  -5.704  -3.880
  150    HB2  LEU  21           HB2      LEU  21  -2.348  -7.471  -1.433
  151    HB3  LEU  21           HB1      LEU  21  -1.616  -5.874  -1.381
  152    HG   LEU  21           HG       LEU  21  -4.476  -6.445  -2.245
  153   HD11  LEU  21          HD11      LEU  21  -3.419  -5.334   0.362
  154   HD12  LEU  21          HD12      LEU  21  -4.292  -6.851   0.099
  155   HD13  LEU  21          HD13      LEU  21  -5.120  -5.312  -0.134
  156   HD21  LEU  21          HD21      LEU  21  -3.586  -4.486  -3.363
  157   HD22  LEU  21          HD22      LEU  21  -3.072  -3.800  -1.821
  158   HD23  LEU  21          HD23      LEU  21  -4.791  -4.020  -2.166
  159    H    GLY  22           HN       GLY  22  -0.901  -8.888  -4.180
  160    HA2  GLY  22           HA2      GLY  22   1.186  -9.793  -4.568
  161    HA3  GLY  22           HA1      GLY  22   1.819  -8.154  -4.621
  162    H    VAL  23           HN       VAL  23   0.125  -9.544  -1.901
  163    HA   VAL  23           HA       VAL  23   2.582  -9.781  -0.269
  164    HB   VAL  23           HB       VAL  23   1.345  -8.862   1.690
  165   HG11  VAL  23          HG11      VAL  23   2.728  -7.324   0.365
  166   HG12  VAL  23          HG12      VAL  23   1.340  -6.489   1.058
  167   HG13  VAL  23          HG13      VAL  23   1.340  -6.924  -0.653
  168   HG21  VAL  23          HG21      VAL  23  -0.916  -8.254  -0.265
  169   HG22  VAL  23          HG22      VAL  23  -0.846  -7.708   1.413
  170   HG23  VAL  23          HG23      VAL  23  -0.967  -9.427   1.052
  171    H    ASN  24           HN       ASN  24   1.903 -10.933   1.875
  172    HA   ASN  24           HA       ASN  24   0.532 -13.427   1.295
  173    HB2  ASN  24           HB2      ASN  24   2.018 -12.406   3.751
  174    HB3  ASN  24           HB1      ASN  24   1.170 -13.946   3.724
  175   HD21  ASN  24          HD21      ASN  24   2.802 -15.304   3.905
  176   HD22  ASN  24          HD22      ASN  24   4.131 -15.445   2.797
  177    H    GLN  25           HN       GLN  25  -0.977 -14.263   2.837
  178    HA   GLN  25           HA       GLN  25  -3.189 -12.530   3.404
  179    HB2  GLN  25           HB2      GLN  25  -2.698 -15.497   3.979
  180    HB3  GLN  25           HB1      GLN  25  -4.203 -14.674   4.369
  181    HG2  GLN  25           HG2      GLN  25  -4.475 -15.875   2.283
  182    HG3  GLN  25           HG1      GLN  25  -4.548 -14.145   1.976
  183   HE21  GLN  25          HE21      GLN  25  -3.949 -14.172  -0.161
  184   HE22  GLN  25          HE22      GLN  25  -2.391 -14.680  -0.719
  185    H    SER  26           HN       SER  26  -0.483 -13.832   5.159
  186    HA   SER  26           HA       SER  26  -1.237 -13.243   7.825
  187    HB2  SER  26           HB2      SER  26   1.546 -13.302   6.573
  188    HB3  SER  26           HB1      SER  26   1.185 -13.453   8.289
  189    HG   SER  26           HG       SER  26  -0.256 -15.300   7.257
  190    H    ALA  27           HN       ALA  27   0.295 -11.298   5.276
  191    HA   ALA  27           HA       ALA  27   1.022  -9.018   6.796
  192    HB1  ALA  27           HB1      ALA  27   1.952  -9.461   4.559
  193    HB2  ALA  27           HB2      ALA  27   1.217  -7.859   4.623
  194    HB3  ALA  27           HB3      ALA  27   0.366  -9.190   3.831
  195    H    ILE  28           HN       ILE  28  -1.852  -9.764   4.861
  196    HA   ILE  28           HA       ILE  28  -3.277  -7.353   5.068
  197    HB   ILE  28           HB       ILE  28  -4.430 -10.178   4.867
  198   HG12  ILE  28          HG12      ILE  28  -2.790  -9.737   3.083
  199   HG13  ILE  28          HG11      ILE  28  -4.418  -9.845   2.425
  200   HG21  ILE  28          HG21      ILE  28  -5.704  -7.528   4.093
  201   HG22  ILE  28          HG22      ILE  28  -6.187  -8.565   5.440
  202   HG23  ILE  28          HG23      ILE  28  -6.386  -9.125   3.781
  203   HD11  ILE  28          HD11      ILE  28  -2.860  -7.318   2.930
  204   HD12  ILE  28          HD12      ILE  28  -4.515  -7.392   2.316
  205   HD13  ILE  28          HD13      ILE  28  -3.191  -8.072   1.372
  206    H    SER  29           HN       SER  29  -3.323 -10.229   7.130
  207    HA   SER  29           HA       SER  29  -5.364  -9.533   8.904
  208    HB2  SER  29           HB2      SER  29  -2.872 -11.202   9.435
  209    HB3  SER  29           HB1      SER  29  -4.353 -11.228  10.402
  210    HG   SER  29           HG       SER  29  -3.803 -12.456   8.026
  211    H    GLN  30           HN       GLN  30  -1.914  -8.709   8.958
  212    HA   GLN  30           HA       GLN  30  -2.007  -7.432  11.557
  213    HB2  GLN  30           HB2      GLN  30   0.192  -7.354   9.450
  214    HB3  GLN  30           HB1      GLN  30   0.350  -6.846  11.133
  215    HG2  GLN  30           HG2      GLN  30  -0.107  -9.173  11.871
  216    HG3  GLN  30           HG1      GLN  30  -0.230  -9.665  10.181
  217   HE21  GLN  30          HE21      GLN  30   1.675  -9.671   8.903
  218   HE22  GLN  30          HE22      GLN  30   3.242  -9.734   9.629
  219    H    TRP  31           HN       TRP  31  -2.229  -6.332   8.199
  220    HA   TRP  31           HA       TRP  31  -1.970  -3.528   8.675
  221    HB2  TRP  31           HB2      TRP  31  -3.400  -5.014   6.434
  222    HB3  TRP  31           HB1      TRP  31  -3.115  -3.276   6.446
  223    HD1  TRP  31           HD1      TRP  31   0.041  -4.379   7.739
  224    HE1  TRP  31           HE1      TRP  31   1.751  -4.764   5.864
  225    HE3  TRP  31           HE3      TRP  31  -3.132  -4.574   3.721
  226    HZ2  TRP  31           HZ2      TRP  31   1.764  -5.095   3.078
  227    HZ3  TRP  31           HZ3      TRP  31  -2.189  -4.911   1.489
  228    HH2  TRP  31           HH2      TRP  31   0.210  -5.165   1.179
  229    H    ARG  32           HN       ARG  32  -4.723  -5.711   8.465
  230    HA   ARG  32           HA       ARG  32  -6.805  -3.838   8.904
  231    HB2  ARG  32           HB2      ARG  32  -7.357  -5.983   7.917
  232    HB3  ARG  32           HB1      ARG  32  -6.645  -6.868   9.265
  233    HG2  ARG  32           HG2      ARG  32  -8.436  -6.139  10.748
  234    HG3  ARG  32           HG1      ARG  32  -9.110  -5.100   9.490
  235    HD2  ARG  32           HD2      ARG  32 -10.373  -7.213   9.770
  236    HD3  ARG  32           HD1      ARG  32  -9.707  -7.039   8.146
  237    HE   ARG  32           HE       ARG  32  -7.924  -8.539   9.752
  238   HH11  ARG  32          HH11      ARG  32 -10.970 -10.578   8.031
  239   HH12  ARG  32          HH12      ARG  32 -11.096  -8.851   8.217
  240   HH21  ARG  32          HH21      ARG  32  -7.760 -10.797   9.460
  241   HH22  ARG  32          HH22      ARG  32  -9.070 -11.681   8.739
  242    H    ALA  33           HN       ALA  33  -4.955  -5.998  11.037
  243    HA   ALA  33           HA       ALA  33  -6.296  -5.403  13.423
  244    HB1  ALA  33           HB1      ALA  33  -4.821  -7.350  13.176
  245    HB2  ALA  33           HB2      ALA  33  -4.326  -6.377  14.558
  246    HB3  ALA  33           HB3      ALA  33  -3.414  -6.294  13.049
  247    H    ARG  34           HN       ARG  34  -3.616  -3.818  11.780
  248    HA   ARG  34           HA       ARG  34  -2.960  -1.898  13.814
  249    HB2  ARG  34           HB2      ARG  34  -1.360  -2.615  12.063
  250    HB3  ARG  34           HB1      ARG  34  -2.433  -2.020  10.803
  251    HG2  ARG  34           HG2      ARG  34  -0.624  -0.482  11.068
  252    HG3  ARG  34           HG1      ARG  34  -2.092   0.287  11.644
  253    HD2  ARG  34           HD2      ARG  34  -1.447  -0.042  13.949
  254    HD3  ARG  34           HD1      ARG  34  -0.058  -1.029  13.482
  255    HE   ARG  34           HE       ARG  34  -0.335   1.876  12.967
  256   HH11  ARG  34          HH11      ARG  34   3.180   0.042  13.647
  257   HH12  ARG  34          HH12      ARG  34   1.730  -0.916  13.581
  258   HH21  ARG  34          HH21      ARG  34   3.080   2.298  13.385
  259   HH22  ARG  34          HH22      ARG  34   1.562   3.089  13.117
  260    H    GLY  35           HN       GLY  35  -5.118  -2.037  11.056
  261    HA2  GLY  35           HA2      GLY  35  -7.024  -0.760  10.595
  262    HA3  GLY  35           HA1      GLY  35  -6.532   0.411  11.812
  263    H    ARG  36           HN       ARG  36  -4.030  -0.505   9.659
  264    HA   ARG  36           HA       ARG  36  -4.463   1.448   7.605
  265    HB2  ARG  36           HB2      ARG  36  -3.869   2.967   9.486
  266    HB3  ARG  36           HB1      ARG  36  -2.364   2.096   9.739
  267    HG2  ARG  36           HG2      ARG  36  -1.410   2.930   7.731
  268    HG3  ARG  36           HG1      ARG  36  -2.975   3.432   7.091
  269    HD2  ARG  36           HD2      ARG  36  -1.596   4.694   9.487
  270    HD3  ARG  36           HD1      ARG  36  -1.590   5.346   7.842
  271    HE   ARG  36           HE       ARG  36  -4.254   4.915   8.675
  272   HH11  ARG  36          HH11      ARG  36  -1.600   7.144   9.310
  273   HH12  ARG  36          HH12      ARG  36  -2.659   8.440   9.769
  274   HH21  ARG  36          HH21      ARG  36  -5.602   6.605   9.289
  275   HH22  ARG  36          HH22      ARG  36  -4.922   8.136   9.755
  276    H    VAL  37           HN       VAL  37  -2.987   1.289   5.936
  277    HA   VAL  37           HA       VAL  37  -1.272  -1.107   5.891
  278    HB   VAL  37           HB       VAL  37  -1.337  -0.868   3.415
  279   HG11  VAL  37          HG11      VAL  37  -3.063  -2.203   4.504
  280   HG12  VAL  37          HG12      VAL  37  -3.725  -1.395   3.086
  281   HG13  VAL  37          HG13      VAL  37  -4.087  -0.779   4.700
  282   HG21  VAL  37          HG21      VAL  37  -3.130   1.555   3.889
  283   HG22  VAL  37          HG22      VAL  37  -2.805   0.808   2.323
  284   HG23  VAL  37          HG23      VAL  37  -1.499   1.586   3.214
  285    HA   PRO  38           HA       PRO  38   2.571   1.380   5.256
  286    HB2  PRO  38           HB2      PRO  38   3.885  -0.178   3.399
  287    HB3  PRO  38           HB1      PRO  38   3.779  -0.630   5.113
  288    HG2  PRO  38           HG2      PRO  38   2.064  -1.560   2.830
  289    HG3  PRO  38           HG1      PRO  38   2.873  -2.523   4.094
  290    HD2  PRO  38           HD2      PRO  38   0.279  -1.919   4.326
  291    HD3  PRO  38           HD1      PRO  38   1.338  -1.895   5.752
  292    H    ALA  39           HN       ALA  39   3.762   2.383   3.396
  293    HA   ALA  39           HA       ALA  39   2.114   4.091   1.976
  294    HB1  ALA  39           HB1      ALA  39   4.436   4.589   2.557
  295    HB2  ALA  39           HB2      ALA  39   4.162   4.843   0.833
  296    HB3  ALA  39           HB3      ALA  39   5.012   3.397   1.390
  297    H    GLY  40           HN       GLY  40   1.532   4.283  -0.214
  298    HA2  GLY  40           HA2      GLY  40   1.428   3.882  -2.486
  299    HA3  GLY  40           HA1      GLY  40   2.488   2.497  -2.298
  300    H    ARG  41           HN       ARG  41   1.049   0.990  -0.458
  301    HA   ARG  41           HA       ARG  41  -0.455  -0.540  -2.293
  302    HB2  ARG  41           HB2      ARG  41   0.956  -1.361  -0.313
  303    HB3  ARG  41           HB1      ARG  41  -0.373  -0.894   0.735
  304    HG2  ARG  41           HG2      ARG  41  -0.669  -3.195   0.434
  305    HG3  ARG  41           HG1      ARG  41  -1.832  -2.486  -0.683
  306    HD2  ARG  41           HD2      ARG  41   0.922  -3.502  -1.460
  307    HD3  ARG  41           HD1      ARG  41  -0.570  -4.425  -1.613
  308    HE   ARG  41           HE       ARG  41  -1.161  -2.242  -3.084
  309   HH11  ARG  41          HH11      ARG  41   2.007  -4.101  -4.769
  310   HH12  ARG  41          HH12      ARG  41   1.671  -4.353  -3.087
  311   HH21  ARG  41          HH21      ARG  41   0.705  -2.769  -6.020
  312   HH22  ARG  41          HH22      ARG  41  -0.672  -1.957  -5.335
  313    H    CYS  42           HN       CYS  42  -1.426   1.947  -0.110
  314    HA   CYS  42           HA       CYS  42  -4.073   1.303   0.494
  315    HB2  CYS  42           HB2      CYS  42  -2.972   3.214   1.519
  316    HB3  CYS  42           HB1      CYS  42  -2.878   4.041  -0.036
  317    H    ILE  43           HN       ILE  43  -2.686   2.626  -2.457
  318    HA   ILE  43           HA       ILE  43  -4.843   3.682  -3.847
  319    HB   ILE  43           HB       ILE  43  -2.387   2.156  -4.839
  320   HG12  ILE  43          HG12      ILE  43  -2.972   5.155  -4.717
  321   HG13  ILE  43          HG11      ILE  43  -1.969   4.270  -3.575
  322   HG21  ILE  43          HG21      ILE  43  -4.305   3.786  -6.553
  323   HG22  ILE  43          HG22      ILE  43  -4.047   2.042  -6.637
  324   HG23  ILE  43          HG23      ILE  43  -2.748   3.143  -7.087
  325   HD11  ILE  43          HD11      ILE  43  -1.397   4.690  -6.501
  326   HD12  ILE  43          HD12      ILE  43  -0.398   3.751  -5.386
  327   HD13  ILE  43          HD13      ILE  43  -0.612   5.483  -5.135
  328    H    ASP  44           HN       ASP  44  -3.799   0.300  -3.669
  329    HA   ASP  44           HA       ASP  44  -5.695  -0.672  -5.614
  330    HB2  ASP  44           HB2      ASP  44  -4.173  -2.345  -3.598
  331    HB3  ASP  44           HB1      ASP  44  -4.781  -2.850  -5.169
  332    H    ILE  45           HN       ILE  45  -5.336  -0.938  -2.080
  333    HA   ILE  45           HA       ILE  45  -7.799  -2.198  -1.524
  334    HB   ILE  45           HB       ILE  45  -5.979  -0.468   0.206
  335   HG12  ILE  45          HG12      ILE  45  -6.522  -3.464   0.023
  336   HG13  ILE  45          HG11      ILE  45  -5.012  -2.622  -0.289
  337   HG21  ILE  45          HG21      ILE  45  -8.445  -1.921   1.209
  338   HG22  ILE  45          HG22      ILE  45  -8.267  -0.169   1.088
  339   HG23  ILE  45          HG23      ILE  45  -7.251  -1.079   2.204
  340   HD11  ILE  45          HD11      ILE  45  -4.837  -3.824   1.769
  341   HD12  ILE  45          HD12      ILE  45  -6.308  -3.089   2.407
  342   HD13  ILE  45          HD13      ILE  45  -4.867  -2.102   2.140
  343    H    GLU  46           HN       GLU  46  -7.040   1.085  -2.371
  344    HA   GLU  46           HA       GLU  46  -9.423   2.355  -1.403
  345    HB2  GLU  46           HB2      GLU  46  -7.051   3.360  -2.143
  346    HB3  GLU  46           HB1      GLU  46  -7.830   3.517  -3.703
  347    HG2  GLU  46           HG2      GLU  46  -8.660   4.806  -1.092
  348    HG3  GLU  46           HG1      GLU  46  -7.947   5.607  -2.481
  349    H    LEU  47           HN       LEU  47  -8.381   1.009  -4.546
  350    HA   LEU  47           HA       LEU  47 -10.613   1.405  -6.163
  351    HB2  LEU  47           HB2      LEU  47  -8.795  -1.022  -5.884
  352    HB3  LEU  47           HB1      LEU  47 -10.008  -0.922  -7.143
  353    HG   LEU  47           HG       LEU  47  -7.824   1.181  -6.903
  354   HD11  LEU  47          HD11      LEU  47  -6.675  -0.982  -7.060
  355   HD12  LEU  47          HD12      LEU  47  -6.489  -0.067  -8.550
  356   HD13  LEU  47          HD13      LEU  47  -7.629  -1.415  -8.482
  357   HD21  LEU  47          HD21      LEU  47  -9.537   0.241  -9.229
  358   HD22  LEU  47          HD22      LEU  47  -8.311   1.513  -9.299
  359   HD23  LEU  47          HD23      LEU  47  -9.751   1.736  -8.313
  360    H    TYR  48           HN       TYR  48 -10.098  -0.894  -3.541
  361    HA   TYR  48           HA       TYR  48 -12.671  -2.246  -3.987
  362    HB2  TYR  48           HB2      TYR  48 -10.736  -3.012  -1.785
  363    HB3  TYR  48           HB1      TYR  48 -11.873  -4.031  -2.671
  364    HD1  TYR  48           HD1      TYR  48  -8.728  -4.300  -2.067
  365    HD2  TYR  48           HD2      TYR  48 -10.997  -3.212  -5.522
  366    HE1  TYR  48           HE1      TYR  48  -6.883  -5.026  -3.513
  367    HE2  TYR  48           HE2      TYR  48  -9.145  -3.923  -6.956
  368    HH   TYR  48           HH       TYR  48  -6.715  -4.270  -6.803
  369    H    THR  49           HN       THR  49 -11.439   0.299  -2.083
  370    HA   THR  49           HA       THR  49 -13.875   0.292  -0.393
  371    HB   THR  49           HB       THR  49 -12.774   2.001   1.028
  372    HG1  THR  49           HG1      THR  49 -11.384   2.866  -0.697
  373   HG21  THR  49          HG21      THR  49 -10.982   0.622   2.028
  374   HG22  THR  49          HG22      THR  49 -10.976  -0.405   0.595
  375   HG23  THR  49          HG23      THR  49 -12.398  -0.356   1.635
  376    H    ASP  50           HN       ASP  50 -14.657   0.620  -2.666
  377    HA   ASP  50           HA       ASP  50 -14.241   3.070  -4.073
  378    HB2  ASP  50           HB2      ASP  50 -14.655   0.827  -5.110
  379    HB3  ASP  50           HB1      ASP  50 -16.315   0.880  -4.532
  380    H    GLY  51           HN       GLY  51 -15.069   3.968  -1.652
  381    HA2  GLY  51           HA2      GLY  51 -16.459   5.963  -1.381
  382    HA3  GLY  51           HA1      GLY  51 -17.807   5.061  -2.070
  383    H    ARG  52           HN       ARG  52 -16.624   2.689  -0.453
  384    HA   ARG  52           HA       ARG  52 -18.538   2.722   1.615
  385    HB2  ARG  52           HB2      ARG  52 -17.097   0.765   0.353
  386    HB3  ARG  52           HB1      ARG  52 -16.202   0.835   1.856
  387    HG2  ARG  52           HG2      ARG  52 -19.179   0.255   1.604
  388    HG3  ARG  52           HG1      ARG  52 -17.915  -0.952   1.802
  389    HD2  ARG  52           HD2      ARG  52 -18.768  -0.749   3.963
  390    HD3  ARG  52           HD1      ARG  52 -17.365   0.315   4.016
  391    HE   ARG  52           HE       ARG  52 -18.802   2.199   3.975
  392   HH11  ARG  52          HH11      ARG  52 -22.059  -0.033   4.759
  393   HH12  ARG  52          HH12      ARG  52 -20.613  -0.819   4.209
  394   HH21  ARG  52          HH21      ARG  52 -22.099   2.237   5.037
  395   HH22  ARG  52          HH22      ARG  52 -20.689   3.194   4.698
  396    H    VAL  53           HN       VAL  53 -14.961   3.050   1.755
  397    HA   VAL  53           HA       VAL  53 -15.131   4.822   4.065
  398    HB   VAL  53           HB       VAL  53 -14.987   2.533   5.107
  399   HG11  VAL  53          HG11      VAL  53 -12.950   1.179   4.917
  400   HG12  VAL  53          HG12      VAL  53 -12.308   2.302   3.714
  401   HG13  VAL  53          HG13      VAL  53 -13.760   1.363   3.360
  402   HG21  VAL  53          HG21      VAL  53 -14.080   4.442   6.350
  403   HG22  VAL  53          HG22      VAL  53 -12.508   4.236   5.577
  404   HG23  VAL  53          HG23      VAL  53 -13.123   2.995   6.672
  405    H    GLU  54           HN       GLU  54 -13.101   6.039   4.364
  406    HA   GLU  54           HA       GLU  54 -11.525   6.314   1.953
  407    HB2  GLU  54           HB2      GLU  54 -12.161   8.309   3.282
  408    HB3  GLU  54           HB1      GLU  54 -11.203   7.723   4.639
  409    HG2  GLU  54           HG2      GLU  54  -9.148   7.998   3.403
  410    HG3  GLU  54           HG1      GLU  54 -10.021   8.310   1.907
  411    H    CYS  55           HN       CYS  55  -9.920   4.956   1.510
  412    HA   CYS  55           HA       CYS  55  -8.474   3.431   3.451
  413    HB2  CYS  55           HB2      CYS  55  -8.657   2.490   1.245
  414    HB3  CYS  55           HB1      CYS  55  -7.993   3.940   0.497
  415    H    ARG  56           HN       ARG  56  -6.420   3.740   4.273
  416    HA   ARG  56           HA       ARG  56  -4.959   6.223   3.680
  417    HB2  ARG  56           HB2      ARG  56  -5.936   5.450   6.471
  418    HB3  ARG  56           HB1      ARG  56  -4.734   6.702   6.159
  419    HG2  ARG  56           HG2      ARG  56  -6.310   8.086   5.024
  420    HG3  ARG  56           HG1      ARG  56  -7.501   6.793   4.931
  421    HD2  ARG  56           HD2      ARG  56  -7.782   6.898   7.390
  422    HD3  ARG  56           HD1      ARG  56  -6.614   8.232   7.450
  423    HE   ARG  56           HE       ARG  56  -8.296   9.260   5.722
  424   HH11  ARG  56          HH11      ARG  56 -10.663   8.361   8.839
  425   HH12  ARG  56          HH12      ARG  56  -9.162   7.514   8.653
  426   HH21  ARG  56          HH21      ARG  56 -11.294   9.950   7.305
  427   HH22  ARG  56          HH22      ARG  56 -10.267  10.306   5.947
  428    H    GLU  57           HN       GLU  57  -2.790   6.170   4.189
  429    HA   GLU  57           HA       GLU  57  -1.592   3.525   4.764
  430    HB2  GLU  57           HB2      GLU  57   0.085   4.003   2.964
  431    HB3  GLU  57           HB1      GLU  57  -1.550   3.787   2.353
  432    HG2  GLU  57           HG2      GLU  57  -1.821   6.153   1.999
  433    HG3  GLU  57           HG1      GLU  57  -0.313   6.511   2.841
  434    H    LEU  58           HN       LEU  58   0.725   3.640   5.248
  435    HA   LEU  58           HA       LEU  58   1.494   6.033   6.768
  436    HB2  LEU  58           HB2      LEU  58   2.668   3.221   6.624
  437    HB3  LEU  58           HB1      LEU  58   3.432   4.527   7.518
  438    HG   LEU  58           HG       LEU  58   0.634   3.503   8.128
  439   HD11  LEU  58          HD11      LEU  58   1.595   2.301  10.032
  440   HD12  LEU  58          HD12      LEU  58   3.225   2.743   9.513
  441   HD13  LEU  58          HD13      LEU  58   2.226   1.693   8.504
  442   HD21  LEU  58          HD21      LEU  58   1.009   5.791   8.867
  443   HD22  LEU  58          HD22      LEU  58   2.485   5.313   9.710
  444   HD23  LEU  58          HD23      LEU  58   0.916   4.711  10.257
  445    H    ARG  59           HN       ARG  59   2.602   7.548   5.650
  446    HA   ARG  59           HA       ARG  59   3.144   7.306   2.916
  447    HB2  ARG  59           HB2      ARG  59   4.449   9.349   4.783
  448    HB3  ARG  59           HB1      ARG  59   4.203   9.513   3.038
  449    HG2  ARG  59           HG2      ARG  59   2.058   9.483   5.189
  450    HG3  ARG  59           HG1      ARG  59   2.607  10.887   4.279
  451    HD2  ARG  59           HD2      ARG  59   1.732   9.801   2.194
  452    HD3  ARG  59           HD1      ARG  59   1.090   8.488   3.186
  453    HE   ARG  59           HE       ARG  59  -0.022  11.113   2.831
  454   HH11  ARG  59          HH11      ARG  59  -1.369   8.921   5.914
  455   HH12  ARG  59          HH12      ARG  59   0.103   8.446   5.135
  456   HH21  ARG  59          HH21      ARG  59  -1.895  11.739   3.918
  457   HH22  ARG  59          HH22      ARG  59  -2.500  10.777   5.235
  458    HA   PRO  60           HA       PRO  60   7.015   5.295   2.357
  459    HB2  PRO  60           HB2      PRO  60   8.435   6.842   0.549
  460    HB3  PRO  60           HB1      PRO  60   7.050   5.824   0.104
  461    HG2  PRO  60           HG2      PRO  60   7.104   8.762   0.697
  462    HG3  PRO  60           HG1      PRO  60   6.328   7.885  -0.631
  463    HD2  PRO  60           HD2      PRO  60   4.873   8.693   1.482
  464    HD3  PRO  60           HD1      PRO  60   4.561   7.113   0.705
  465    H    ASP  61           HN       ASP  61   8.570   5.081   3.693
  466    HA   ASP  61           HA       ASP  61   9.715   7.268   5.242
  467    HB2  ASP  61           HB2      ASP  61   9.084   5.103   6.340
  468    HB3  ASP  61           HB1      ASP  61  10.297   4.266   5.380
  469    H    VAL  62           HN       VAL  62  10.751   4.786   2.947
  470    HA   VAL  62           HA       VAL  62  13.246   6.261   2.337
  471    HB   VAL  62           HB       VAL  62  12.542   3.347   1.670
  472   HG11  VAL  62          HG11      VAL  62  15.190   4.816   1.331
  473   HG12  VAL  62          HG12      VAL  62  14.100   4.310   0.039
  474   HG13  VAL  62          HG13      VAL  62  14.910   3.098   1.026
  475   HG21  VAL  62          HG21      VAL  62  12.827   3.620   4.099
  476   HG22  VAL  62          HG22      VAL  62  14.406   4.369   3.857
  477   HG23  VAL  62          HG23      VAL  62  14.152   2.677   3.419
  478    H    PHE  63           HN       PHE  63  12.848   7.615   0.678
  479    HA   PHE  63           HA       PHE  63  11.039   6.813  -1.532
  480    HB2  PHE  63           HB2      PHE  63   9.979   8.494  -0.018
  481    HB3  PHE  63           HB1      PHE  63  11.334   9.585  -0.275
  482    HD1  PHE  63           HD1      PHE  63   8.514   7.870  -2.027
  483    HD2  PHE  63           HD2      PHE  63  11.321  11.093  -2.164
  484    HE1  PHE  63           HE1      PHE  63   7.356   8.801  -3.983
  485    HE2  PHE  63           HE2      PHE  63  10.144  12.020  -4.123
  486    HZ   PHE  63           HZ       PHE  63   8.164  10.873  -5.034
  487    H    GLY  64           HN       GLY  64  12.099   6.726  -3.418
  488    HA2  GLY  64           HA2      GLY  64  14.218   8.628  -4.120
  489    HA3  GLY  64           HA1      GLY  64  14.644   6.915  -4.089
  490    H    ALA  65           HN       ALA  65  13.966   9.219  -6.195
  491    HA   ALA  65           HA       ALA  65  12.720   7.442  -8.179
  492    HB1  ALA  65           HB1      ALA  65  11.644  10.220  -7.541
  493    HB2  ALA  65           HB2      ALA  65  10.838   8.691  -7.186
  494    HB3  ALA  65           HB3      ALA  65  11.101   9.178  -8.861
  Start of MODEL    9
    1    H1   MET   1           HT1      MET   1 -15.611  -2.135  11.424
    2    H2   MET   1           HT2      MET   1 -15.296  -0.559  10.899
    3    H3   MET   1           HT3      MET   1 -14.046  -1.503  11.526
    4    HA   MET   1           HA       MET   1 -14.158  -3.006   9.704
    5    HB2  MET   1           HB2      MET   1 -16.326  -1.149   8.617
    6    HB3  MET   1           HB1      MET   1 -15.611  -2.504   7.747
    7    HG2  MET   1           HG2      MET   1 -17.756  -3.179   8.550
    8    HG3  MET   1           HG1      MET   1 -16.537  -4.033   9.496
    9    HE1  MET   1           HE1      MET   1 -19.725  -3.553  10.245
   10    HE2  MET   1           HE2      MET   1 -19.610  -3.248  11.976
   11    HE3  MET   1           HE3      MET   1 -18.675  -4.554  11.250
   12    H    ASN   2           HN       ASN   2 -12.087  -2.312   9.422
   13    HA   ASN   2           HA       ASN   2 -11.286   0.302   8.542
   14    HB2  ASN   2           HB2      ASN   2  -9.799  -2.368   8.485
   15    HB3  ASN   2           HB1      ASN   2  -9.053  -0.815   8.121
   16   HD21  ASN   2          HD21      ASN   2  -8.505  -2.794  10.248
   17   HD22  ASN   2          HD22      ASN   2  -8.587  -1.926  11.736
   18    H    ALA   3           HN       ALA   3 -10.170   0.688   6.468
   19    HA   ALA   3           HA       ALA   3 -11.500   0.039   4.130
   20    HB1  ALA   3           HB1      ALA   3  -9.975   1.953   4.337
   21    HB2  ALA   3           HB2      ALA   3  -9.538   0.959   2.947
   22    HB3  ALA   3           HB3      ALA   3  -8.590   0.860   4.437
   23    H    ILE   4           HN       ILE   4  -8.647  -1.463   5.559
   24    HA   ILE   4           HA       ILE   4  -8.018  -3.308   3.518
   25    HB   ILE   4           HB       ILE   4  -7.538  -3.812   6.486
   26   HG12  ILE   4          HG12      ILE   4  -5.149  -2.827   5.887
   27   HG13  ILE   4          HG11      ILE   4  -6.013  -1.989   4.607
   28   HG21  ILE   4          HG21      ILE   4  -7.129  -5.763   5.055
   29   HG22  ILE   4          HG22      ILE   4  -5.621  -5.169   5.748
   30   HG23  ILE   4          HG23      ILE   4  -6.013  -4.820   4.062
   31   HD11  ILE   4          HD11      ILE   4  -5.679  -0.579   6.550
   32   HD12  ILE   4          HD12      ILE   4  -6.524  -1.737   7.576
   33   HD13  ILE   4          HD13      ILE   4  -7.403  -0.873   6.308
   34    H    ASP   5           HN       ASP   5 -10.168  -3.437   6.306
   35    HA   ASP   5           HA       ASP   5 -10.959  -6.165   6.192
   36    HB2  ASP   5           HB2      ASP   5 -11.230  -4.913   8.249
   37    HB3  ASP   5           HB1      ASP   5 -12.223  -3.696   7.454
   38    H    ILE   6           HN       ILE   6 -12.413  -3.195   4.889
   39    HA   ILE   6           HA       ILE   6 -14.783  -4.396   3.853
   40    HB   ILE   6           HB       ILE   6 -13.428  -1.719   3.318
   41   HG12  ILE   6          HG12      ILE   6 -14.420  -2.052   5.581
   42   HG13  ILE   6          HG11      ILE   6 -15.223  -0.769   4.686
   43   HG21  ILE   6          HG21      ILE   6 -16.135  -2.589   2.214
   44   HG22  ILE   6          HG22      ILE   6 -14.684  -2.236   1.275
   45   HG23  ILE   6          HG23      ILE   6 -15.489  -0.944   2.161
   46   HD11  ILE   6          HD11      ILE   6 -17.082  -2.304   4.184
   47   HD12  ILE   6          HD12      ILE   6 -16.831  -2.107   5.916
   48   HD13  ILE   6          HD13      ILE   6 -16.274  -3.572   5.110
   49    H    ALA   7           HN       ALA   7 -11.553  -3.888   2.549
   50    HA   ALA   7           HA       ALA   7 -12.179  -4.574  -0.173
   51    HB1  ALA   7           HB1      ALA   7  -9.472  -4.626   1.191
   52    HB2  ALA   7           HB2      ALA   7 -10.192  -3.223   0.394
   53    HB3  ALA   7           HB3      ALA   7  -9.775  -4.661  -0.554
   54    H    ILE   8           HN       ILE   8 -11.302  -6.433   2.695
   55    HA   ILE   8           HA       ILE   8 -10.813  -8.975   1.556
   56    HB   ILE   8           HB       ILE   8 -12.288  -8.380   4.173
   57   HG12  ILE   8          HG12      ILE   8  -9.317  -8.972   3.768
   58   HG13  ILE   8          HG11      ILE   8  -9.990  -7.375   4.058
   59   HG21  ILE   8          HG21      ILE   8 -11.634 -10.667   4.884
   60   HG22  ILE   8          HG22      ILE   8 -10.929 -10.967   3.292
   61   HG23  ILE   8          HG23      ILE   8 -12.667 -10.706   3.458
   62   HD11  ILE   8          HD11      ILE   8 -10.070  -9.701   5.968
   63   HD12  ILE   8          HD12      ILE   8 -10.763  -8.102   6.265
   64   HD13  ILE   8          HD13      ILE   8  -9.020  -8.290   6.065
   65    H    ASN   9           HN       ASN   9 -13.820  -7.441   2.635
   66    HA   ASN   9           HA       ASN   9 -15.625  -9.488   1.858
   67    HB2  ASN   9           HB2      ASN   9 -16.255  -7.794   3.517
   68    HB3  ASN   9           HB1      ASN   9 -16.053  -6.505   2.344
   69   HD21  ASN   9          HD21      ASN   9 -17.722  -6.065   0.915
   70   HD22  ASN   9          HD22      ASN   9 -19.264  -6.830   0.984
   71    H    LYS  10           HN       LYS  10 -14.253  -6.724   0.146
   72    HA   LYS  10           HA       LYS  10 -16.105  -6.662  -2.025
   73    HB2  LYS  10           HB2      LYS  10 -14.568  -4.770  -1.190
   74    HB3  LYS  10           HB1      LYS  10 -13.266  -5.541  -2.083
   75    HG2  LYS  10           HG2      LYS  10 -15.821  -4.828  -3.533
   76    HG3  LYS  10           HG1      LYS  10 -14.680  -3.552  -3.121
   77    HD2  LYS  10           HD2      LYS  10 -12.895  -4.768  -4.355
   78    HD3  LYS  10           HD1      LYS  10 -14.079  -5.996  -4.825
   79    HE2  LYS  10           HE2      LYS  10 -14.212  -3.047  -5.543
   80    HE3  LYS  10           HE1      LYS  10 -13.694  -4.338  -6.626
   81    HZ1  LYS  10           HZ1      LYS  10 -16.389  -4.019  -5.433
   82    HZ2  LYS  10           HZ2      LYS  10 -15.906  -5.323  -6.392
   83    HZ3  LYS  10           HZ3      LYS  10 -15.968  -3.769  -7.052
   84    H    LEU  11           HN       LEU  11 -12.924  -8.177  -1.571
   85    HA   LEU  11           HA       LEU  11 -13.053  -9.416  -4.241
   86    HB2  LEU  11           HB2      LEU  11 -10.817  -9.603  -2.198
   87    HB3  LEU  11           HB1      LEU  11 -10.754 -10.115  -3.879
   88    HG   LEU  11           HG       LEU  11 -10.753  -7.286  -2.768
   89   HD11  LEU  11          HD11      LEU  11  -8.719  -7.053  -4.181
   90   HD12  LEU  11          HD12      LEU  11  -8.853  -8.762  -4.608
   91   HD13  LEU  11          HD13      LEU  11  -8.578  -8.282  -2.937
   92   HD21  LEU  11          HD21      LEU  11 -11.185  -7.995  -5.689
   93   HD22  LEU  11          HD22      LEU  11 -10.915  -6.378  -5.020
   94   HD23  LEU  11          HD23      LEU  11 -12.374  -7.262  -4.603
   95    H    GLY  12           HN       GLY  12 -14.131 -10.118  -1.168
   96    HA2  GLY  12           HA2      GLY  12 -15.483 -11.975  -0.697
   97    HA3  GLY  12           HA1      GLY  12 -14.644 -12.913  -1.920
   98    H    SER  13           HN       SER  13 -11.955 -12.097  -0.806
   99    HA   SER  13           HA       SER  13 -11.846 -13.351   1.815
  100    HB2  SER  13           HB2      SER  13 -10.376 -15.226   1.049
  101    HB3  SER  13           HB1      SER  13 -12.003 -15.337   0.382
  102    HG   SER  13           HG       SER  13 -11.262 -14.636  -1.575
  103    H    VAL  14           HN       VAL  14  -9.642 -13.505   2.642
  104    HA   VAL  14           HA       VAL  14  -7.972 -11.239   2.012
  105    HB   VAL  14           HB       VAL  14  -7.779 -13.558   3.986
  106   HG11  VAL  14          HG11      VAL  14  -5.461 -13.164   3.322
  107   HG12  VAL  14          HG12      VAL  14  -5.723 -12.551   4.951
  108   HG13  VAL  14          HG13      VAL  14  -5.638 -11.430   3.589
  109   HG21  VAL  14          HG21      VAL  14  -9.310 -11.747   4.566
  110   HG22  VAL  14          HG22      VAL  14  -8.026 -10.547   4.358
  111   HG23  VAL  14          HG23      VAL  14  -7.931 -11.740   5.667
  112    H    SER  15           HN       SER  15  -8.038 -14.659   1.231
  113    HA   SER  15           HA       SER  15  -5.415 -14.930   0.244
  114    HB2  SER  15           HB2      SER  15  -7.878 -16.467  -0.635
  115    HB3  SER  15           HB1      SER  15  -6.191 -16.976  -0.787
  116    HG   SER  15           HG       SER  15  -6.052 -17.094   1.443
  117    H    ALA  16           HN       ALA  16  -8.458 -13.933  -1.291
  118    HA   ALA  16           HA       ALA  16  -7.328 -13.502  -3.920
  119    HB1  ALA  16           HB1      ALA  16  -9.513 -12.474  -4.447
  120    HB2  ALA  16           HB2      ALA  16  -9.955 -12.525  -2.737
  121    HB3  ALA  16           HB3      ALA  16  -9.719 -14.027  -3.630
  122    H    LEU  17           HN       LEU  17  -7.852 -11.562  -1.023
  123    HA   LEU  17           HA       LEU  17  -7.485  -9.000  -2.185
  124    HB2  LEU  17           HB2      LEU  17  -8.629  -9.320  -0.012
  125    HB3  LEU  17           HB1      LEU  17  -7.109  -9.835   0.710
  126    HG   LEU  17           HG       LEU  17  -6.149  -7.616   0.405
  127   HD11  LEU  17          HD11      LEU  17  -7.223  -6.929  -1.683
  128   HD12  LEU  17          HD12      LEU  17  -7.462  -5.701  -0.445
  129   HD13  LEU  17          HD13      LEU  17  -8.785  -6.793  -0.867
  130   HD21  LEU  17          HD21      LEU  17  -8.875  -7.408   1.707
  131   HD22  LEU  17          HD22      LEU  17  -7.501  -6.325   1.971
  132   HD23  LEU  17          HD23      LEU  17  -7.395  -8.016   2.463
  133    H    ALA  18           HN       ALA  18  -5.305 -10.920  -0.200
  134    HA   ALA  18           HA       ALA  18  -3.005  -9.354  -0.407
  135    HB1  ALA  18           HB1      ALA  18  -3.382 -11.077   1.315
  136    HB2  ALA  18           HB2      ALA  18  -1.837 -11.309   0.490
  137    HB3  ALA  18           HB3      ALA  18  -3.221 -12.334   0.087
  138    H    ALA  19           HN       ALA  19  -4.229 -11.980  -2.460
  139    HA   ALA  19           HA       ALA  19  -2.030 -12.334  -4.184
  140    HB1  ALA  19           HB1      ALA  19  -3.682 -13.193  -5.807
  141    HB2  ALA  19           HB2      ALA  19  -4.993 -12.524  -4.830
  142    HB3  ALA  19           HB3      ALA  19  -3.986 -13.818  -4.182
  143    H    ALA  20           HN       ALA  20  -4.784 -10.100  -4.378
  144    HA   ALA  20           HA       ALA  20  -4.023  -8.784  -6.809
  145    HB1  ALA  20           HB1      ALA  20  -5.953  -7.907  -4.640
  146    HB2  ALA  20           HB2      ALA  20  -6.358  -8.909  -6.037
  147    HB3  ALA  20           HB3      ALA  20  -5.854  -7.231  -6.264
  148    H    LEU  21           HN       LEU  21  -3.176  -8.354  -3.482
  149    HA   LEU  21           HA       LEU  21  -1.983  -5.690  -3.886
  150    HB2  LEU  21           HB2      LEU  21  -2.350  -7.367  -1.378
  151    HB3  LEU  21           HB1      LEU  21  -1.675  -5.740  -1.414
  152    HG   LEU  21           HG       LEU  21  -4.519  -6.463  -2.239
  153   HD11  LEU  21          HD11      LEU  21  -3.524  -5.177   0.308
  154   HD12  LEU  21          HD12      LEU  21  -4.281  -6.763   0.130
  155   HD13  LEU  21          HD13      LEU  21  -5.220  -5.304  -0.178
  156   HD21  LEU  21          HD21      LEU  21  -3.699  -4.514  -3.454
  157   HD22  LEU  21          HD22      LEU  21  -3.210  -3.744  -1.942
  158   HD23  LEU  21          HD23      LEU  21  -4.920  -4.036  -2.277
  159    H    GLY  22           HN       GLY  22  -1.078  -8.906  -4.148
  160    HA2  GLY  22           HA2      GLY  22   0.925  -9.922  -4.608
  161    HA3  GLY  22           HA1      GLY  22   1.661  -8.327  -4.667
  162    H    VAL  23           HN       VAL  23   0.010  -9.167  -1.759
  163    HA   VAL  23           HA       VAL  23   2.573  -9.539  -0.321
  164    HB   VAL  23           HB       VAL  23   1.497  -8.559   1.669
  165   HG11  VAL  23          HG11      VAL  23   2.684  -7.037   0.178
  166   HG12  VAL  23          HG12      VAL  23   1.299  -6.218   0.901
  167   HG13  VAL  23          HG13      VAL  23   1.216  -6.773  -0.772
  168   HG21  VAL  23          HG21      VAL  23  -0.982  -8.140  -0.064
  169   HG22  VAL  23          HG22      VAL  23  -0.755  -7.500   1.564
  170   HG23  VAL  23          HG23      VAL  23  -0.848  -9.241   1.312
  171    H    ASN  24           HN       ASN  24   1.953 -10.546   1.977
  172    HA   ASN  24           HA       ASN  24   0.892 -13.200   1.433
  173    HB2  ASN  24           HB2      ASN  24   3.017 -12.837   2.716
  174    HB3  ASN  24           HB1      ASN  24   2.093 -12.094   4.013
  175   HD21  ASN  24          HD21      ASN  24   2.689 -13.658   5.540
  176   HD22  ASN  24          HD22      ASN  24   2.161 -15.298   5.466
  177    H    GLN  25           HN       GLN  25  -0.505 -14.184   3.090
  178    HA   GLN  25           HA       GLN  25  -2.974 -12.691   3.202
  179    HB2  GLN  25           HB2      GLN  25  -2.797 -15.395   4.537
  180    HB3  GLN  25           HB1      GLN  25  -4.063 -14.735   3.495
  181    HG2  GLN  25           HG2      GLN  25  -1.371 -15.825   2.620
  182    HG3  GLN  25           HG1      GLN  25  -2.939 -16.604   2.414
  183   HE21  GLN  25          HE21      GLN  25  -0.811 -15.606   0.493
  184   HE22  GLN  25          HE22      GLN  25  -1.658 -14.640  -0.654
  185    H    SER  26           HN       SER  26  -0.598 -13.935   5.469
  186    HA   SER  26           HA       SER  26  -1.824 -13.073   7.889
  187    HB2  SER  26           HB2      SER  26   1.130 -13.583   7.301
  188    HB3  SER  26           HB1      SER  26   0.365 -13.563   8.898
  189    HG   SER  26           HG       SER  26  -1.039 -15.298   7.656
  190    H    ALA  27           HN       ALA  27   0.135 -11.457   5.463
  191    HA   ALA  27           HA       ALA  27   0.911  -9.153   6.948
  192    HB1  ALA  27           HB1      ALA  27   1.939  -9.746   4.783
  193    HB2  ALA  27           HB2      ALA  27   1.310  -8.100   4.759
  194    HB3  ALA  27           HB3      ALA  27   0.418  -9.397   3.957
  195    H    ILE  28           HN       ILE  28  -1.936  -9.934   5.002
  196    HA   ILE  28           HA       ILE  28  -3.306  -7.451   5.223
  197    HB   ILE  28           HB       ILE  28  -4.464 -10.244   4.825
  198   HG12  ILE  28          HG12      ILE  28  -2.792  -9.653   3.102
  199   HG13  ILE  28          HG11      ILE  28  -4.412  -9.762   2.422
  200   HG21  ILE  28          HG21      ILE  28  -6.408  -9.125   3.804
  201   HG22  ILE  28          HG22      ILE  28  -5.725  -7.549   4.210
  202   HG23  ILE  28          HG23      ILE  28  -6.218  -8.659   5.494
  203   HD11  ILE  28          HD11      ILE  28  -4.562  -7.307   2.448
  204   HD12  ILE  28          HD12      ILE  28  -3.209  -7.896   1.485
  205   HD13  ILE  28          HD13      ILE  28  -2.920  -7.229   3.090
  206    H    SER  29           HN       SER  29  -3.351 -10.409   7.187
  207    HA   SER  29           HA       SER  29  -5.365  -9.710   9.033
  208    HB2  SER  29           HB2      SER  29  -2.877 -11.408   9.536
  209    HB3  SER  29           HB1      SER  29  -4.386 -11.453  10.465
  210    HG   SER  29           HG       SER  29  -5.434 -12.210   8.568
  211    H    GLN  30           HN       GLN  30  -1.950  -8.856   8.853
  212    HA   GLN  30           HA       GLN  30  -1.803  -7.565  11.423
  213    HB2  GLN  30           HB2      GLN  30   0.249  -8.432  10.435
  214    HB3  GLN  30           HB1      GLN  30   0.028  -7.466   8.984
  215    HG2  GLN  30           HG2      GLN  30   1.766  -6.464  10.284
  216    HG3  GLN  30           HG1      GLN  30   0.367  -5.403  10.364
  217   HE21  GLN  30          HE21      GLN  30   2.663  -5.559  12.147
  218   HE22  GLN  30          HE22      GLN  30   2.040  -5.866  13.724
  219    H    TRP  31           HN       TRP  31  -2.322  -6.467   8.078
  220    HA   TRP  31           HA       TRP  31  -2.282  -3.672   8.591
  221    HB2  TRP  31           HB2      TRP  31  -3.580  -5.219   6.322
  222    HB3  TRP  31           HB1      TRP  31  -3.428  -3.466   6.363
  223    HD1  TRP  31           HD1      TRP  31  -0.211  -4.437   7.663
  224    HE1  TRP  31           HE1      TRP  31   1.549  -4.620   5.803
  225    HE3  TRP  31           HE3      TRP  31  -3.296  -4.593   3.573
  226    HZ2  TRP  31           HZ2      TRP  31   1.636  -4.810   3.003
  227    HZ3  TRP  31           HZ3      TRP  31  -2.290  -4.757   1.350
  228    HH2  TRP  31           HH2      TRP  31   0.125  -4.866   1.068
  229    H    ARG  32           HN       ARG  32  -4.787  -6.086   8.680
  230    HA   ARG  32           HA       ARG  32  -7.061  -4.373   8.921
  231    HB2  ARG  32           HB2      ARG  32  -7.143  -6.728   8.074
  232    HB3  ARG  32           HB1      ARG  32  -6.703  -7.309   9.676
  233    HG2  ARG  32           HG2      ARG  32  -8.833  -6.273  10.538
  234    HG3  ARG  32           HG1      ARG  32  -9.264  -5.903   8.863
  235    HD2  ARG  32           HD2      ARG  32  -9.061  -8.356   8.335
  236    HD3  ARG  32           HD1      ARG  32  -8.823  -8.672  10.058
  237    HE   ARG  32           HE       ARG  32 -11.250  -7.402   8.953
  238   HH11  ARG  32          HH11      ARG  32 -11.308 -10.330  11.713
  239   HH12  ARG  32          HH12      ARG  32  -9.793  -9.787  11.069
  240   HH21  ARG  32          HH21      ARG  32 -13.285  -9.385  10.974
  241   HH22  ARG  32          HH22      ARG  32 -13.246  -8.134   9.767
  242    H    ALA  33           HN       ALA  33  -4.797  -5.917  11.124
  243    HA   ALA  33           HA       ALA  33  -6.230  -5.151  13.538
  244    HB1  ALA  33           HB1      ALA  33  -4.985  -7.273  13.480
  245    HB2  ALA  33           HB2      ALA  33  -4.321  -6.204  14.717
  246    HB3  ALA  33           HB3      ALA  33  -3.479  -6.399  13.177
  247    H    ARG  34           HN       ARG  34  -3.765  -3.859  11.477
  248    HA   ARG  34           HA       ARG  34  -2.633  -1.943  13.307
  249    HB2  ARG  34           HB2      ARG  34  -1.322  -2.852  11.398
  250    HB3  ARG  34           HB1      ARG  34  -2.503  -2.213  10.268
  251    HG2  ARG  34           HG2      ARG  34  -0.831  -0.657  10.097
  252    HG3  ARG  34           HG1      ARG  34  -1.871   0.104  11.291
  253    HD2  ARG  34           HD2      ARG  34   0.343   0.361  12.120
  254    HD3  ARG  34           HD1      ARG  34  -0.364  -0.944  13.078
  255    HE   ARG  34           HE       ARG  34   1.201  -1.664  10.708
  256   HH11  ARG  34          HH11      ARG  34   2.491  -2.549  14.415
  257   HH12  ARG  34          HH12      ARG  34   1.125  -1.499  14.229
  258   HH21  ARG  34          HH21      ARG  34   3.025  -2.964  10.981
  259   HH22  ARG  34          HH22      ARG  34   3.575  -3.383  12.572
  260    H    GLY  35           HN       GLY  35  -5.204  -2.080  10.947
  261    HA2  GLY  35           HA2      GLY  35  -6.912  -0.647  10.373
  262    HA3  GLY  35           HA1      GLY  35  -6.378   0.461  11.632
  263    H    ARG  36           HN       ARG  36  -3.978  -0.568   9.427
  264    HA   ARG  36           HA       ARG  36  -4.132   1.666   7.579
  265    HB2  ARG  36           HB2      ARG  36  -2.196   1.606   9.898
  266    HB3  ARG  36           HB1      ARG  36  -1.583   2.196   8.366
  267    HG2  ARG  36           HG2      ARG  36  -2.558   4.201   8.611
  268    HG3  ARG  36           HG1      ARG  36  -4.119   3.501   9.037
  269    HD2  ARG  36           HD2      ARG  36  -1.798   3.909  10.958
  270    HD3  ARG  36           HD1      ARG  36  -3.207   4.969  10.820
  271    HE   ARG  36           HE       ARG  36  -3.294   2.138  11.737
  272   HH11  ARG  36          HH11      ARG  36  -4.601   5.399  11.845
  273   HH12  ARG  36          HH12      ARG  36  -5.761   5.019  13.073
  274   HH21  ARG  36          HH21      ARG  36  -4.810   1.669  13.369
  275   HH22  ARG  36          HH22      ARG  36  -5.882   2.909  13.936
  276    H    VAL  37           HN       VAL  37  -2.355   1.585   6.012
  277    HA   VAL  37           HA       VAL  37  -1.068  -1.075   5.723
  278    HB   VAL  37           HB       VAL  37  -1.244  -0.824   3.252
  279   HG11  VAL  37          HG11      VAL  37  -3.659  -1.287   3.039
  280   HG12  VAL  37          HG12      VAL  37  -3.914  -0.680   4.678
  281   HG13  VAL  37          HG13      VAL  37  -2.938  -2.127   4.414
  282   HG21  VAL  37          HG21      VAL  37  -2.728   0.893   2.253
  283   HG22  VAL  37          HG22      VAL  37  -1.359   1.632   3.083
  284   HG23  VAL  37          HG23      VAL  37  -2.952   1.628   3.843
  285    HA   PRO  38           HA       PRO  38   2.929   1.081   4.981
  286    HB2  PRO  38           HB2      PRO  38   3.080  -0.976   2.742
  287    HB3  PRO  38           HB1      PRO  38   4.304  -0.540   3.958
  288    HG2  PRO  38           HG2      PRO  38   2.936  -2.776   4.225
  289    HG3  PRO  38           HG1      PRO  38   3.262  -1.754   5.646
  290    HD2  PRO  38           HD2      PRO  38   0.717  -2.047   4.075
  291    HD3  PRO  38           HD1      PRO  38   0.952  -1.881   5.828
  292    H    ALA  39           HN       ALA  39   3.996   2.237   3.218
  293    HA   ALA  39           HA       ALA  39   2.257   4.030   1.982
  294    HB1  ALA  39           HB1      ALA  39   4.536   4.575   2.649
  295    HB2  ALA  39           HB2      ALA  39   4.281   4.966   0.948
  296    HB3  ALA  39           HB3      ALA  39   5.195   3.520   1.395
  297    H    GLY  40           HN       GLY  40   1.169   3.923   0.110
  298    HA2  GLY  40           HA2      GLY  40   1.158   3.986  -2.257
  299    HA3  GLY  40           HA1      GLY  40   2.375   2.724  -2.287
  300    H    ARG  41           HN       ARG  41   0.740   1.152  -0.234
  301    HA   ARG  41           HA       ARG  41  -0.593  -0.389  -2.295
  302    HB2  ARG  41           HB2      ARG  41   0.817  -1.329  -0.344
  303    HB3  ARG  41           HB1      ARG  41  -0.591  -1.053   0.673
  304    HG2  ARG  41           HG2      ARG  41  -0.717  -3.325   0.061
  305    HG3  ARG  41           HG1      ARG  41  -1.898  -2.531  -0.977
  306    HD2  ARG  41           HD2      ARG  41   0.920  -3.340  -1.793
  307    HD3  ARG  41           HD1      ARG  41  -0.549  -4.230  -2.176
  308    HE   ARG  41           HE       ARG  41  -1.249  -2.164  -3.468
  309   HH11  ARG  41          HH11      ARG  41   2.674  -1.981  -4.383
  310   HH12  ARG  41          HH12      ARG  41   2.173  -2.828  -2.958
  311   HH21  ARG  41          HH21      ARG  41  -0.548  -1.094  -5.372
  312   HH22  ARG  41          HH22      ARG  41   1.141  -1.003  -5.746
  313    H    CYS  42           HN       CYS  42  -1.607   2.016  -0.164
  314    HA   CYS  42           HA       CYS  42  -4.291   1.265   0.409
  315    HB2  CYS  42           HB2      CYS  42  -3.186   3.064   1.624
  316    HB3  CYS  42           HB1      CYS  42  -3.017   4.011   0.152
  317    H    ILE  43           HN       ILE  43  -2.762   2.581  -2.405
  318    HA   ILE  43           HA       ILE  43  -4.827   3.813  -3.796
  319    HB   ILE  43           HB       ILE  43  -2.524   2.141  -4.882
  320   HG12  ILE  43          HG12      ILE  43  -1.689   3.987  -3.543
  321   HG13  ILE  43          HG11      ILE  43  -1.404   4.361  -5.235
  322   HG21  ILE  43          HG21      ILE  43  -4.270   4.108  -6.402
  323   HG22  ILE  43          HG22      ILE  43  -4.190   2.361  -6.639
  324   HG23  ILE  43          HG23      ILE  43  -2.791   3.361  -7.020
  325   HD11  ILE  43          HD11      ILE  43  -3.352   5.889  -5.197
  326   HD12  ILE  43          HD12      ILE  43  -2.101   6.341  -4.041
  327   HD13  ILE  43          HD13      ILE  43  -3.567   5.542  -3.478
  328    H    ASP  44           HN       ASP  44  -3.936   0.397  -3.670
  329    HA   ASP  44           HA       ASP  44  -5.905  -0.476  -5.599
  330    HB2  ASP  44           HB2      ASP  44  -4.278  -2.171  -3.655
  331    HB3  ASP  44           HB1      ASP  44  -4.994  -2.682  -5.185
  332    H    ILE  45           HN       ILE  45  -5.481  -0.757  -2.057
  333    HA   ILE  45           HA       ILE  45  -7.846  -2.206  -1.503
  334    HB   ILE  45           HB       ILE  45  -6.135  -0.403   0.257
  335   HG12  ILE  45          HG12      ILE  45  -6.499  -3.432   0.028
  336   HG13  ILE  45          HG11      ILE  45  -5.048  -2.500  -0.326
  337   HG21  ILE  45          HG21      ILE  45  -8.516  -2.048   1.198
  338   HG22  ILE  45          HG22      ILE  45  -8.437  -0.286   1.146
  339   HG23  ILE  45          HG23      ILE  45  -7.382  -1.176   2.238
  340   HD11  ILE  45          HD11      ILE  45  -4.759  -3.704   1.722
  341   HD12  ILE  45          HD12      ILE  45  -6.251  -3.048   2.398
  342   HD13  ILE  45          HD13      ILE  45  -4.866  -1.987   2.107
  343    H    GLU  46           HN       GLU  46  -7.300   1.245  -1.959
  344    HA   GLU  46           HA       GLU  46  -9.910   2.084  -1.091
  345    HB2  GLU  46           HB2      GLU  46  -7.968   3.631  -1.002
  346    HB3  GLU  46           HB1      GLU  46  -7.872   3.609  -2.760
  347    HG2  GLU  46           HG2      GLU  46 -10.084   4.638  -2.914
  348    HG3  GLU  46           HG1      GLU  46 -10.238   4.606  -1.156
  349    H    LEU  47           HN       LEU  47  -8.410   1.247  -4.185
  350    HA   LEU  47           HA       LEU  47 -10.536   1.799  -5.918
  351    HB2  LEU  47           HB2      LEU  47  -7.992   0.582  -6.096
  352    HB3  LEU  47           HB1      LEU  47  -9.081  -0.701  -6.581
  353    HG   LEU  47           HG       LEU  47  -9.008   2.058  -7.855
  354   HD11  LEU  47          HD11      LEU  47  -7.853   1.006  -9.752
  355   HD12  LEU  47          HD12      LEU  47  -7.773  -0.524  -8.875
  356   HD13  LEU  47          HD13      LEU  47  -6.900   0.889  -8.274
  357   HD21  LEU  47          HD21      LEU  47 -10.457  -0.481  -8.714
  358   HD22  LEU  47          HD22      LEU  47 -10.354   1.006  -9.665
  359   HD23  LEU  47          HD23      LEU  47 -11.195   1.011  -8.119
  360    H    TYR  48           HN       TYR  48 -10.170  -0.694  -3.505
  361    HA   TYR  48           HA       TYR  48 -12.528  -2.184  -4.403
  362    HB2  TYR  48           HB2      TYR  48 -10.851  -2.674  -1.905
  363    HB3  TYR  48           HB1      TYR  48 -11.995  -3.793  -2.657
  364    HD1  TYR  48           HD1      TYR  48  -8.794  -3.918  -2.027
  365    HD2  TYR  48           HD2      TYR  48 -11.161  -3.477  -5.557
  366    HE1  TYR  48           HE1      TYR  48  -6.968  -4.854  -3.376
  367    HE2  TYR  48           HE2      TYR  48  -9.337  -4.407  -6.893
  368    HH   TYR  48           HH       TYR  48  -6.965  -4.692  -6.799
  369    H    THR  49           HN       THR  49 -11.674   0.269  -2.064
  370    HA   THR  49           HA       THR  49 -14.305   0.023  -0.686
  371    HB   THR  49           HB       THR  49 -13.265   1.077   1.263
  372    HG1  THR  49           HG1      THR  49 -11.787   2.491   0.578
  373   HG21  THR  49          HG21      THR  49 -11.429  -1.091   0.163
  374   HG22  THR  49          HG22      THR  49 -12.912  -1.355   1.082
  375   HG23  THR  49          HG23      THR  49 -11.529  -0.584   1.851
  376    H    ASP  50           HN       ASP  50 -14.419   1.277  -3.082
  377    HA   ASP  50           HA       ASP  50 -13.274   3.482  -3.905
  378    HB2  ASP  50           HB2      ASP  50 -15.029   2.351  -5.173
  379    HB3  ASP  50           HB1      ASP  50 -16.263   3.026  -4.120
  380    H    GLY  51           HN       GLY  51 -16.380   4.013  -2.225
  381    HA2  GLY  51           HA2      GLY  51 -15.255   6.348  -0.796
  382    HA3  GLY  51           HA1      GLY  51 -16.684   6.574  -1.809
  383    H    ARG  52           HN       ARG  52 -16.157   3.600  -0.100
  384    HA   ARG  52           HA       ARG  52 -18.536   4.049   1.580
  385    HB2  ARG  52           HB2      ARG  52 -16.882   1.529   1.099
  386    HB3  ARG  52           HB1      ARG  52 -18.405   1.609   1.987
  387    HG2  ARG  52           HG2      ARG  52 -19.577   2.326  -0.076
  388    HG3  ARG  52           HG1      ARG  52 -18.055   2.255  -0.969
  389    HD2  ARG  52           HD2      ARG  52 -17.919  -0.176  -0.515
  390    HD3  ARG  52           HD1      ARG  52 -19.452  -0.088   0.364
  391    HE   ARG  52           HE       ARG  52 -20.028   0.944  -2.099
  392   HH11  ARG  52          HH11      ARG  52 -18.684  -2.102  -0.975
  393   HH12  ARG  52          HH12      ARG  52 -19.320  -3.015  -2.306
  394   HH21  ARG  52          HH21      ARG  52 -20.870  -0.266  -3.840
  395   HH22  ARG  52          HH22      ARG  52 -20.561  -1.970  -3.931
  396    H    VAL  53           HN       VAL  53 -15.122   3.165   1.850
  397    HA   VAL  53           HA       VAL  53 -14.926   4.748   4.303
  398    HB   VAL  53           HB       VAL  53 -15.051   2.461   5.204
  399   HG11  VAL  53          HG11      VAL  53 -14.414   1.192   3.203
  400   HG12  VAL  53          HG12      VAL  53 -13.480   0.680   4.609
  401   HG13  VAL  53          HG13      VAL  53 -12.737   1.721   3.386
  402   HG21  VAL  53          HG21      VAL  53 -13.497   4.017   6.322
  403   HG22  VAL  53          HG22      VAL  53 -12.177   3.471   5.286
  404   HG23  VAL  53          HG23      VAL  53 -12.911   2.355   6.442
  405    H    GLU  54           HN       GLU  54 -13.274   6.107   4.140
  406    HA   GLU  54           HA       GLU  54 -11.646   6.156   1.755
  407    HB2  GLU  54           HB2      GLU  54 -11.749   7.967   4.201
  408    HB3  GLU  54           HB1      GLU  54 -10.801   8.294   2.751
  409    HG2  GLU  54           HG2      GLU  54 -12.777   8.547   1.409
  410    HG3  GLU  54           HG1      GLU  54 -13.811   7.938   2.703
  411    H    CYS  55           HN       CYS  55  -9.912   4.935   1.612
  412    HA   CYS  55           HA       CYS  55  -8.552   3.737   3.825
  413    HB2  CYS  55           HB2      CYS  55  -8.677   2.460   1.822
  414    HB3  CYS  55           HB1      CYS  55  -8.088   3.789   0.829
  415    H    ARG  56           HN       ARG  56  -6.645   4.351   4.823
  416    HA   ARG  56           HA       ARG  56  -5.031   6.523   3.602
  417    HB2  ARG  56           HB2      ARG  56  -5.400   5.981   6.582
  418    HB3  ARG  56           HB1      ARG  56  -4.206   7.084   5.917
  419    HG2  ARG  56           HG2      ARG  56  -5.899   8.525   6.559
  420    HG3  ARG  56           HG1      ARG  56  -6.247   8.304   4.843
  421    HD2  ARG  56           HD2      ARG  56  -8.294   8.200   6.194
  422    HD3  ARG  56           HD1      ARG  56  -7.984   6.643   5.415
  423    HE   ARG  56           HE       ARG  56  -6.827   6.687   8.001
  424   HH11  ARG  56          HH11      ARG  56 -10.687   5.580   7.851
  425   HH12  ARG  56          HH12      ARG  56 -10.015   6.457   6.516
  426   HH21  ARG  56          HH21      ARG  56  -9.391   5.042   9.653
  427   HH22  ARG  56          HH22      ARG  56  -7.721   5.510   9.701
  428    H    GLU  57           HN       GLU  57  -3.028   6.012   3.110
  429    HA   GLU  57           HA       GLU  57  -1.720   3.594   4.169
  430    HB2  GLU  57           HB2      GLU  57   0.117   4.220   2.493
  431    HB3  GLU  57           HB1      GLU  57  -1.433   3.774   1.800
  432    HG2  GLU  57           HG2      GLU  57  -1.991   6.175   1.527
  433    HG3  GLU  57           HG1      GLU  57  -0.394   6.589   2.160
  434    H    LEU  58           HN       LEU  58   0.518   3.789   4.834
  435    HA   LEU  58           HA       LEU  58   1.020   6.097   6.536
  436    HB2  LEU  58           HB2      LEU  58   2.368   3.378   6.372
  437    HB3  LEU  58           HB1      LEU  58   2.847   4.652   7.492
  438    HG   LEU  58           HG       LEU  58   0.095   3.335   7.454
  439   HD11  LEU  58          HD11      LEU  58   0.727   2.193   9.511
  440   HD12  LEU  58          HD12      LEU  58   2.362   2.864   9.409
  441   HD13  LEU  58          HD13      LEU  58   1.793   1.725   8.183
  442   HD21  LEU  58          HD21      LEU  58  -0.033   5.624   8.299
  443   HD22  LEU  58          HD22      LEU  58   1.299   5.325   9.417
  444   HD23  LEU  58          HD23      LEU  58  -0.242   4.493   9.633
  445    H    ARG  59           HN       ARG  59   3.306   6.949   6.591
  446    HA   ARG  59           HA       ARG  59   3.843   8.017   4.054
  447    HB2  ARG  59           HB2      ARG  59   5.771   9.127   5.017
  448    HB3  ARG  59           HB1      ARG  59   4.388   9.244   6.126
  449    HG2  ARG  59           HG2      ARG  59   5.330   7.462   7.535
  450    HG3  ARG  59           HG1      ARG  59   6.674   7.250   6.413
  451    HD2  ARG  59           HD2      ARG  59   7.445   9.546   6.913
  452    HD3  ARG  59           HD1      ARG  59   6.096   9.750   8.040
  453    HE   ARG  59           HE       ARG  59   7.548   7.450   8.760
  454   HH11  ARG  59          HH11      ARG  59   7.991  10.945   8.776
  455   HH12  ARG  59          HH12      ARG  59   9.088  10.919  10.118
  456   HH21  ARG  59          HH21      ARG  59   8.969   7.429  10.541
  457   HH22  ARG  59          HH22      ARG  59   9.649   8.914  11.129
  458    HA   PRO  60           HA       PRO  60   7.012   5.257   2.375
  459    HB2  PRO  60           HB2      PRO  60   8.466   7.036   0.892
  460    HB3  PRO  60           HB1      PRO  60   6.840   6.507   0.405
  461    HG2  PRO  60           HG2      PRO  60   7.663   9.039   1.795
  462    HG3  PRO  60           HG1      PRO  60   6.539   8.809   0.436
  463    HD2  PRO  60           HD2      PRO  60   5.687   9.111   3.030
  464    HD3  PRO  60           HD1      PRO  60   4.794   8.141   1.818
  465    H    ASP  61           HN       ASP  61   9.237   4.799   2.684
  466    HA   ASP  61           HA       ASP  61  10.633   6.331   4.806
  467    HB2  ASP  61           HB2      ASP  61  10.091   3.950   5.350
  468    HB3  ASP  61           HB1      ASP  61  11.031   3.416   3.959
  469    H    VAL  62           HN       VAL  62  11.781   4.092   2.256
  470    HA   VAL  62           HA       VAL  62  13.873   5.977   1.433
  471    HB   VAL  62           HB       VAL  62  14.719   4.111   0.011
  472   HG11  VAL  62          HG11      VAL  62  14.239   3.296   2.898
  473   HG12  VAL  62          HG12      VAL  62  15.535   4.343   2.315
  474   HG13  VAL  62          HG13      VAL  62  15.490   2.646   1.832
  475   HG21  VAL  62          HG21      VAL  62  12.586   2.984  -0.521
  476   HG22  VAL  62          HG22      VAL  62  12.411   2.479   1.161
  477   HG23  VAL  62          HG23      VAL  62  13.732   1.840   0.181
  478    H    PHE  63           HN       PHE  63  10.698   5.255   0.560
  479    HA   PHE  63           HA       PHE  63  10.931   5.853  -2.289
  480    HB2  PHE  63           HB2      PHE  63   8.453   5.352  -0.584
  481    HB3  PHE  63           HB1      PHE  63   8.486   5.457  -2.340
  482    HD1  PHE  63           HD1      PHE  63   8.950   3.294   0.535
  483    HD2  PHE  63           HD2      PHE  63   9.741   3.671  -3.652
  484    HE1  PHE  63           HE1      PHE  63   9.394   0.880   0.394
  485    HE2  PHE  63           HE2      PHE  63  10.176   1.257  -3.786
  486    HZ   PHE  63           HZ       PHE  63  10.007  -0.143  -1.763
  487    H    GLY  64           HN       GLY  64   8.737   7.413  -2.827
  488    HA2  GLY  64           HA2      GLY  64   7.921   9.569  -2.838
  489    HA3  GLY  64           HA1      GLY  64   8.532   9.764  -1.198
  490    H    ALA  65           HN       ALA  65  10.727   8.734  -3.653
  491    HA   ALA  65           HA       ALA  65  11.822  11.351  -4.244
  492    HB1  ALA  65           HB1      ALA  65  14.034  10.883  -3.185
  493    HB2  ALA  65           HB2      ALA  65  13.379   9.411  -2.461
  494    HB3  ALA  65           HB3      ALA  65  12.745  10.986  -1.983
  Start of MODEL   10
    1    H1   MET   1           HT1      MET   1 -13.798  -2.083  11.589
    2    H2   MET   1           HT2      MET   1 -15.314  -2.825  11.622
    3    H3   MET   1           HT3      MET   1 -15.189  -1.172  11.290
    4    HA   MET   1           HA       MET   1 -14.197  -3.392   9.614
    5    HB2  MET   1           HB2      MET   1 -16.435  -1.375   9.115
    6    HB3  MET   1           HB1      MET   1 -15.887  -2.592   7.964
    7    HG2  MET   1           HG2      MET   1 -17.938  -3.328   9.005
    8    HG3  MET   1           HG1      MET   1 -16.608  -4.365   9.527
    9    HE1  MET   1           HE1      MET   1 -18.010  -5.330  11.585
   10    HE2  MET   1           HE2      MET   1 -19.398  -4.375  11.059
   11    HE3  MET   1           HE3      MET   1 -18.868  -4.307  12.738
   12    H    ASN   2           HN       ASN   2 -12.131  -2.647   9.259
   13    HA   ASN   2           HA       ASN   2 -11.427   0.073   8.586
   14    HB2  ASN   2           HB2      ASN   2  -9.872  -2.517   8.108
   15    HB3  ASN   2           HB1      ASN   2  -9.204  -0.889   8.006
   16   HD21  ASN   2          HD21      ASN   2  -7.653  -1.357   9.544
   17   HD22  ASN   2          HD22      ASN   2  -8.018  -1.567  11.223
   18    H    ALA   3           HN       ALA   3 -10.495   0.667   6.446
   19    HA   ALA   3           HA       ALA   3 -11.909  -0.084   4.161
   20    HB1  ALA   3           HB1      ALA   3 -10.654   1.999   4.336
   21    HB2  ALA   3           HB2      ALA   3 -10.196   1.104   2.888
   22    HB3  ALA   3           HB3      ALA   3  -9.128   1.109   4.299
   23    H    ILE   4           HN       ILE   4  -8.824  -1.266   5.411
   24    HA   ILE   4           HA       ILE   4  -8.140  -3.042   3.334
   25    HB   ILE   4           HB       ILE   4  -7.567  -3.574   6.277
   26   HG12  ILE   4          HG12      ILE   4  -5.239  -2.497   5.667
   27   HG13  ILE   4          HG11      ILE   4  -6.127  -1.702   4.379
   28   HG21  ILE   4          HG21      ILE   4  -7.117  -5.506   4.834
   29   HG22  ILE   4          HG22      ILE   4  -5.609  -4.853   5.471
   30   HG23  ILE   4          HG23      ILE   4  -6.080  -4.515   3.803
   31   HD11  ILE   4          HD11      ILE   4  -5.828  -0.263   6.301
   32   HD12  ILE   4          HD12      ILE   4  -6.649  -1.426   7.342
   33   HD13  ILE   4          HD13      ILE   4  -7.543  -0.603   6.059
   34    H    ASP   5           HN       ASP   5 -10.185  -3.384   6.194
   35    HA   ASP   5           HA       ASP   5 -10.888  -6.117   5.934
   36    HB2  ASP   5           HB2      ASP   5 -11.060  -4.989   8.070
   37    HB3  ASP   5           HB1      ASP   5 -12.191  -3.811   7.419
   38    H    ILE   6           HN       ILE   6 -12.431  -3.144   4.744
   39    HA   ILE   6           HA       ILE   6 -14.828  -4.393   3.790
   40    HB   ILE   6           HB       ILE   6 -13.592  -1.682   3.155
   41   HG12  ILE   6          HG12      ILE   6 -14.376  -1.919   5.490
   42   HG13  ILE   6          HG11      ILE   6 -15.364  -0.760   4.618
   43   HG21  ILE   6          HG21      ILE   6 -15.755  -0.998   2.139
   44   HG22  ILE   6          HG22      ILE   6 -16.348  -2.653   2.300
   45   HG23  ILE   6          HG23      ILE   6 -14.989  -2.305   1.233
   46   HD11  ILE   6          HD11      ILE   6 -17.131  -2.445   4.395
   47   HD12  ILE   6          HD12      ILE   6 -16.710  -2.151   6.082
   48   HD13  ILE   6          HD13      ILE   6 -16.132  -3.607   5.272
   49    H    ALA   7           HN       ALA   7 -11.651  -3.753   2.425
   50    HA   ALA   7           HA       ALA   7 -12.240  -4.504  -0.276
   51    HB1  ALA   7           HB1      ALA   7 -10.300  -3.095   0.284
   52    HB2  ALA   7           HB2      ALA   7  -9.824  -4.541  -0.617
   53    HB3  ALA   7           HB3      ALA   7  -9.559  -4.456   1.134
   54    H    ILE   8           HN       ILE   8 -11.086  -6.250   2.587
   55    HA   ILE   8           HA       ILE   8 -10.604  -8.805   1.556
   56    HB   ILE   8           HB       ILE   8 -11.829  -7.967   4.223
   57   HG12  ILE   8          HG12      ILE   8  -8.985  -8.885   3.618
   58   HG13  ILE   8          HG11      ILE   8  -9.470  -7.203   3.727
   59   HG21  ILE   8          HG21      ILE   8 -11.280 -10.214   5.109
   60   HG22  ILE   8          HG22      ILE   8 -10.822 -10.733   3.485
   61   HG23  ILE   8          HG23      ILE   8 -12.491 -10.282   3.830
   62   HD11  ILE   8          HD11      ILE   8  -8.389  -7.860   5.748
   63   HD12  ILE   8          HD12      ILE   8  -9.476  -9.230   5.951
   64   HD13  ILE   8          HD13      ILE   8 -10.096  -7.584   6.095
   65    H    ASN   9           HN       ASN   9 -13.661  -7.399   2.729
   66    HA   ASN   9           HA       ASN   9 -15.312  -9.618   2.032
   67    HB2  ASN   9           HB2      ASN   9 -15.983  -6.742   2.730
   68    HB3  ASN   9           HB1      ASN   9 -17.214  -7.966   2.429
   69   HD21  ASN   9          HD21      ASN   9 -15.040  -6.658   4.738
   70   HD22  ASN   9          HD22      ASN   9 -15.369  -7.769   6.015
   71    H    LYS  10           HN       LYS  10 -14.336  -6.695   0.318
   72    HA   LYS  10           HA       LYS  10 -16.360  -6.654  -1.666
   73    HB2  LYS  10           HB2      LYS  10 -14.823  -4.745  -1.012
   74    HB3  LYS  10           HB1      LYS  10 -13.537  -5.519  -1.922
   75    HG2  LYS  10           HG2      LYS  10 -16.147  -4.808  -3.272
   76    HG3  LYS  10           HG1      LYS  10 -14.929  -3.571  -2.988
   77    HD2  LYS  10           HD2      LYS  10 -13.288  -4.889  -4.298
   78    HD3  LYS  10           HD1      LYS  10 -14.522  -6.117  -4.600
   79    HE2  LYS  10           HE2      LYS  10 -15.899  -4.359  -5.758
   80    HE3  LYS  10           HE1      LYS  10 -14.550  -3.236  -5.555
   81    HZ1  LYS  10           HZ1      LYS  10 -14.564  -4.287  -7.739
   82    HZ2  LYS  10           HZ2      LYS  10 -14.437  -5.814  -7.022
   83    HZ3  LYS  10           HZ3      LYS  10 -13.172  -4.699  -6.870
   84    H    LEU  11           HN       LEU  11 -13.076  -8.003  -1.675
   85    HA   LEU  11           HA       LEU  11 -13.400  -9.212  -4.289
   86    HB2  LEU  11           HB2      LEU  11 -11.201  -9.705  -2.254
   87    HB3  LEU  11           HB1      LEU  11 -11.175 -10.138  -3.959
   88    HG   LEU  11           HG       LEU  11 -10.967  -7.363  -2.729
   89   HD11  LEU  11          HD11      LEU  11  -8.872  -7.227  -4.022
   90   HD12  LEU  11          HD12      LEU  11  -9.127  -8.880  -4.592
   91   HD13  LEU  11          HD13      LEU  11  -8.877  -8.565  -2.876
   92   HD21  LEU  11          HD21      LEU  11 -11.003  -6.365  -4.951
   93   HD22  LEU  11          HD22      LEU  11 -12.534  -7.158  -4.604
   94   HD23  LEU  11          HD23      LEU  11 -11.370  -7.934  -5.683
   95    H    GLY  12           HN       GLY  12 -13.798 -10.153  -0.940
   96    HA2  GLY  12           HA2      GLY  12 -15.421 -11.829  -0.370
   97    HA3  GLY  12           HA1      GLY  12 -14.978 -12.728  -1.815
   98    H    SER  13           HN       SER  13 -12.050 -11.757  -0.607
   99    HA   SER  13           HA       SER  13 -11.741 -13.419   1.701
  100    HB2  SER  13           HB2      SER  13 -10.233 -15.144   0.692
  101    HB3  SER  13           HB1      SER  13 -11.875 -15.254   0.061
  102    HG   SER  13           HG       SER  13 -11.123 -14.038  -1.766
  103    H    VAL  14           HN       VAL  14  -9.521 -13.557   2.451
  104    HA   VAL  14           HA       VAL  14  -7.944 -11.184   1.959
  105    HB   VAL  14           HB       VAL  14  -7.841 -13.489   3.938
  106   HG11  VAL  14          HG11      VAL  14  -5.622 -11.434   3.652
  107   HG12  VAL  14          HG12      VAL  14  -5.476 -13.167   3.379
  108   HG13  VAL  14          HG13      VAL  14  -5.808 -12.564   4.999
  109   HG21  VAL  14          HG21      VAL  14  -7.959 -11.619   5.583
  110   HG22  VAL  14          HG22      VAL  14  -9.313 -11.632   4.455
  111   HG23  VAL  14          HG23      VAL  14  -7.993 -10.471   4.228
  112    H    SER  15           HN       SER  15  -7.839 -14.594   1.103
  113    HA   SER  15           HA       SER  15  -5.159 -14.700   0.188
  114    HB2  SER  15           HB2      SER  15  -6.131 -16.719  -1.215
  115    HB3  SER  15           HB1      SER  15  -6.089 -16.824   0.546
  116    HG   SER  15           HG       SER  15  -8.176 -16.873   0.573
  117    H    ALA  16           HN       ALA  16  -8.210 -13.880  -1.438
  118    HA   ALA  16           HA       ALA  16  -7.063 -13.374  -4.022
  119    HB1  ALA  16           HB1      ALA  16  -9.470 -13.829  -3.754
  120    HB2  ALA  16           HB2      ALA  16  -9.206 -12.277  -4.548
  121    HB3  ALA  16           HB3      ALA  16  -9.665 -12.330  -2.842
  122    H    LEU  17           HN       LEU  17  -7.794 -11.360  -1.170
  123    HA   LEU  17           HA       LEU  17  -7.275  -8.846  -2.331
  124    HB2  LEU  17           HB2      LEU  17  -8.527  -9.115  -0.212
  125    HB3  LEU  17           HB1      LEU  17  -7.053  -9.624   0.604
  126    HG   LEU  17           HG       LEU  17  -6.050  -7.417   0.222
  127   HD11  LEU  17          HD11      LEU  17  -7.359  -5.509  -0.657
  128   HD12  LEU  17          HD12      LEU  17  -8.689  -6.605  -1.044
  129   HD13  LEU  17          HD13      LEU  17  -7.141  -6.766  -1.873
  130   HD21  LEU  17          HD21      LEU  17  -8.752  -7.157   1.535
  131   HD22  LEU  17          HD22      LEU  17  -7.364  -6.085   1.764
  132   HD23  LEU  17          HD23      LEU  17  -7.273  -7.768   2.287
  133    H    ALA  18           HN       ALA  18  -5.207 -10.988  -0.479
  134    HA   ALA  18           HA       ALA  18  -2.908  -9.338  -0.385
  135    HB1  ALA  18           HB1      ALA  18  -3.388 -11.117   1.254
  136    HB2  ALA  18           HB2      ALA  18  -1.789 -11.311   0.531
  137    HB3  ALA  18           HB3      ALA  18  -3.129 -12.339   0.007
  138    H    ALA  19           HN       ALA  19  -4.063 -11.794  -2.634
  139    HA   ALA  19           HA       ALA  19  -1.735 -12.185  -4.186
  140    HB1  ALA  19           HB1      ALA  19  -3.265 -13.069  -5.907
  141    HB2  ALA  19           HB2      ALA  19  -4.642 -12.376  -5.043
  142    HB3  ALA  19           HB3      ALA  19  -3.699 -13.668  -4.301
  143    H    ALA  20           HN       ALA  20  -4.381  -9.829  -4.429
  144    HA   ALA  20           HA       ALA  20  -3.427  -8.507  -6.809
  145    HB1  ALA  20           HB1      ALA  20  -5.479  -7.607  -4.760
  146    HB2  ALA  20           HB2      ALA  20  -5.817  -8.541  -6.220
  147    HB3  ALA  20           HB3      ALA  20  -5.223  -6.882  -6.347
  148    H    LEU  21           HN       LEU  21  -3.076  -8.020  -3.334
  149    HA   LEU  21           HA       LEU  21  -1.787  -5.417  -3.571
  150    HB2  LEU  21           HB2      LEU  21  -2.331  -7.186  -1.163
  151    HB3  LEU  21           HB1      LEU  21  -1.604  -5.586  -1.070
  152    HG   LEU  21           HG       LEU  21  -4.424  -6.199  -2.059
  153   HD11  LEU  21          HD11      LEU  21  -3.482  -4.913   0.506
  154   HD12  LEU  21          HD12      LEU  21  -4.314  -6.460   0.316
  155   HD13  LEU  21          HD13      LEU  21  -5.164  -4.958  -0.046
  156   HD21  LEU  21          HD21      LEU  21  -4.752  -3.763  -2.158
  157   HD22  LEU  21          HD22      LEU  21  -3.489  -4.285  -3.267
  158   HD23  LEU  21          HD23      LEU  21  -3.053  -3.512  -1.743
  159    H    GLY  22           HN       GLY  22  -0.766  -8.637  -3.749
  160    HA2  GLY  22           HA2      GLY  22   1.304  -9.467  -4.334
  161    HA3  GLY  22           HA1      GLY  22   1.978  -7.852  -4.174
  162    H    VAL  23           HN       VAL  23   0.224  -9.149  -1.495
  163    HA   VAL  23           HA       VAL  23   2.727  -9.774  -0.011
  164    HB   VAL  23           HB       VAL  23   1.526  -9.058   2.065
  165   HG11  VAL  23          HG11      VAL  23   3.034  -7.481   0.953
  166   HG12  VAL  23          HG12      VAL  23   1.679  -6.633   1.702
  167   HG13  VAL  23          HG13      VAL  23   1.701  -6.884  -0.044
  168   HG21  VAL  23          HG21      VAL  23  -0.679  -8.084   0.183
  169   HG22  VAL  23          HG22      VAL  23  -0.582  -7.731   1.909
  170   HG23  VAL  23          HG23      VAL  23  -0.823  -9.391   1.366
  171    H    ASN  24           HN       ASN  24   1.951 -11.098   2.122
  172    HA   ASN  24           HA       ASN  24   0.420 -13.424   1.203
  173    HB2  ASN  24           HB2      ASN  24   1.285 -14.577   3.191
  174    HB3  ASN  24           HB1      ASN  24   2.592 -13.872   2.258
  175   HD21  ASN  24          HD21      ASN  24   2.620 -14.687   5.017
  176   HD22  ASN  24          HD22      ASN  24   3.013 -13.291   5.958
  177    H    GLN  25           HN       GLN  25  -0.987 -14.464   2.900
  178    HA   GLN  25           HA       GLN  25  -3.193 -12.810   3.452
  179    HB2  GLN  25           HB2      GLN  25  -2.466 -15.612   4.342
  180    HB3  GLN  25           HB1      GLN  25  -3.952 -14.851   4.880
  181    HG2  GLN  25           HG2      GLN  25  -4.469 -16.282   3.054
  182    HG3  GLN  25           HG1      GLN  25  -4.663 -14.625   2.504
  183   HE21  GLN  25          HE21      GLN  25  -3.265 -13.842   0.917
  184   HE22  GLN  25          HE22      GLN  25  -2.250 -14.874  -0.018
  185    H    SER  26           HN       SER  26  -0.538 -13.872   5.500
  186    HA   SER  26           HA       SER  26  -1.498 -13.119   8.028
  187    HB2  SER  26           HB2      SER  26   0.471 -14.556   7.736
  188    HB3  SER  26           HB1      SER  26   1.370 -13.225   7.007
  189    HG   SER  26           HG       SER  26   1.989 -13.018   9.028
  190    H    ALA  27           HN       ALA  27   0.275 -11.271   5.552
  191    HA   ALA  27           HA       ALA  27   0.816  -8.920   7.002
  192    HB1  ALA  27           HB1      ALA  27   1.852  -9.406   4.828
  193    HB2  ALA  27           HB2      ALA  27   1.086  -7.816   4.818
  194    HB3  ALA  27           HB3      ALA  27   0.296  -9.183   4.024
  195    H    ILE  28           HN       ILE  28  -2.017  -9.843   5.077
  196    HA   ILE  28           HA       ILE  28  -3.420  -7.375   5.171
  197    HB   ILE  28           HB       ILE  28  -4.593 -10.172   4.882
  198   HG12  ILE  28          HG12      ILE  28  -2.792  -9.689   3.200
  199   HG13  ILE  28          HG11      ILE  28  -4.375  -9.940   2.476
  200   HG21  ILE  28          HG21      ILE  28  -6.446  -9.053   3.678
  201   HG22  ILE  28          HG22      ILE  28  -5.720  -7.483   4.034
  202   HG23  ILE  28          HG23      ILE  28  -6.322  -8.499   5.349
  203   HD11  ILE  28          HD11      ILE  28  -4.623  -7.527   2.189
  204   HD12  ILE  28          HD12      ILE  28  -3.173  -8.138   1.395
  205   HD13  ILE  28          HD13      ILE  28  -3.041  -7.277   2.927
  206    H    SER  29           HN       SER  29  -3.569 -10.294   7.180
  207    HA   SER  29           HA       SER  29  -5.661  -9.596   8.920
  208    HB2  SER  29           HB2      SER  29  -3.211 -11.279   9.619
  209    HB3  SER  29           HB1      SER  29  -4.822 -11.384  10.344
  210    HG   SER  29           HG       SER  29  -3.869 -12.429   7.991
  211    H    GLN  30           HN       GLN  30  -2.205  -8.951   9.042
  212    HA   GLN  30           HA       GLN  30  -2.126  -7.613  11.561
  213    HB2  GLN  30           HB2      GLN  30  -0.192  -7.573   9.210
  214    HB3  GLN  30           HB1      GLN  30   0.154  -6.891  10.798
  215    HG2  GLN  30           HG2      GLN  30   0.046  -9.117  11.814
  216    HG3  GLN  30           HG1      GLN  30  -0.425  -9.827  10.270
  217   HE21  GLN  30          HE21      GLN  30   1.328 -11.216  10.177
  218   HE22  GLN  30          HE22      GLN  30   2.950 -10.680   9.919
  219    H    TRP  31           HN       TRP  31  -2.531  -6.534   8.180
  220    HA   TRP  31           HA       TRP  31  -2.286  -3.731   8.667
  221    HB2  TRP  31           HB2      TRP  31  -3.542  -5.279   6.384
  222    HB3  TRP  31           HB1      TRP  31  -3.442  -3.522   6.393
  223    HD1  TRP  31           HD1      TRP  31  -0.218  -4.269   7.788
  224    HE1  TRP  31           HE1      TRP  31   1.598  -4.453   5.970
  225    HE3  TRP  31           HE3      TRP  31  -3.205  -4.872   3.664
  226    HZ2  TRP  31           HZ2      TRP  31   1.739  -4.813   3.186
  227    HZ3  TRP  31           HZ3      TRP  31  -2.145  -5.112   1.472
  228    HH2  TRP  31           HH2      TRP  31   0.274  -5.087   1.235
  229    H    ARG  32           HN       ARG  32  -4.982  -5.970   8.739
  230    HA   ARG  32           HA       ARG  32  -7.122  -4.108   8.996
  231    HB2  ARG  32           HB2      ARG  32  -7.602  -6.430   8.358
  232    HB3  ARG  32           HB1      ARG  32  -6.840  -7.038   9.823
  233    HG2  ARG  32           HG2      ARG  32  -8.667  -5.797  11.127
  234    HG3  ARG  32           HG1      ARG  32  -9.481  -5.561   9.582
  235    HD2  ARG  32           HD2      ARG  32  -8.694  -8.338  10.495
  236    HD3  ARG  32           HD1      ARG  32 -10.154  -7.576  11.113
  237    HE   ARG  32           HE       ARG  32 -10.536  -7.332   8.484
  238   HH11  ARG  32          HH11      ARG  32 -10.355 -11.261   9.330
  239   HH12  ARG  32          HH12      ARG  32  -9.595 -10.128  10.397
  240   HH21  ARG  32          HH21      ARG  32 -11.591  -8.842   7.140
  241   HH22  ARG  32          HH22      ARG  32 -11.485 -10.535   7.487
  242    H    ALA  33           HN       ALA  33  -5.090  -5.924  11.289
  243    HA   ALA  33           HA       ALA  33  -6.325  -4.804  13.633
  244    HB1  ALA  33           HB1      ALA  33  -5.395  -7.082  13.645
  245    HB2  ALA  33           HB2      ALA  33  -4.621  -6.084  14.876
  246    HB3  ALA  33           HB3      ALA  33  -3.776  -6.433  13.366
  247    H    ARG  34           HN       ARG  34  -3.906  -3.685  11.502
  248    HA   ARG  34           HA       ARG  34  -2.472  -1.991  13.389
  249    HB2  ARG  34           HB2      ARG  34  -1.279  -3.045  11.506
  250    HB3  ARG  34           HB1      ARG  34  -2.386  -2.306  10.365
  251    HG2  ARG  34           HG2      ARG  34  -0.382  -1.084  10.213
  252    HG3  ARG  34           HG1      ARG  34  -1.503  -0.055  11.090
  253    HD2  ARG  34           HD2      ARG  34  -0.429  -0.600  13.207
  254    HD3  ARG  34           HD1      ARG  34   0.640  -1.763  12.408
  255    HE   ARG  34           HE       ARG  34   0.693   1.068  11.620
  256   HH11  ARG  34          HH11      ARG  34   2.399  -1.638  13.048
  257   HH12  ARG  34          HH12      ARG  34   3.931  -0.841  12.988
  258   HH21  ARG  34          HH21      ARG  34   2.706   2.077  11.527
  259   HH22  ARG  34          HH22      ARG  34   4.116   1.270  12.125
  260    H    GLY  35           HN       GLY  35  -4.982  -1.785  10.952
  261    HA2  GLY  35           HA2      GLY  35  -6.623  -0.156  10.634
  262    HA3  GLY  35           HA1      GLY  35  -5.781   0.919  11.742
  263    H    ARG  36           HN       ARG  36  -3.615  -0.417   9.518
  264    HA   ARG  36           HA       ARG  36  -3.828   1.589   7.461
  265    HB2  ARG  36           HB2      ARG  36  -2.920   2.854   9.471
  266    HB3  ARG  36           HB1      ARG  36  -1.511   1.811   9.437
  267    HG2  ARG  36           HG2      ARG  36  -0.810   2.699   7.322
  268    HG3  ARG  36           HG1      ARG  36  -2.337   3.550   7.107
  269    HD2  ARG  36           HD2      ARG  36  -0.277   4.160   9.236
  270    HD3  ARG  36           HD1      ARG  36  -0.489   5.063   7.738
  271    HE   ARG  36           HE       ARG  36  -2.341   4.993  10.036
  272   HH11  ARG  36          HH11      ARG  36  -1.415   6.470   6.994
  273   HH12  ARG  36          HH12      ARG  36  -2.453   7.840   7.202
  274   HH21  ARG  36          HH21      ARG  36  -3.745   8.035   9.110
  275   HH22  ARG  36          HH22      ARG  36  -3.660   6.803  10.331
  276    H    VAL  37           HN       VAL  37  -2.376   1.254   5.772
  277    HA   VAL  37           HA       VAL  37  -0.789  -1.244   5.787
  278    HB   VAL  37           HB       VAL  37  -1.040  -1.267   3.330
  279   HG11  VAL  37          HG11      VAL  37  -2.753  -2.389   4.690
  280   HG12  VAL  37          HG12      VAL  37  -3.430  -1.773   3.186
  281   HG13  VAL  37          HG13      VAL  37  -3.723  -0.914   4.699
  282   HG21  VAL  37          HG21      VAL  37  -2.722   1.254   3.648
  283   HG22  VAL  37          HG22      VAL  37  -2.525   0.333   2.154
  284   HG23  VAL  37          HG23      VAL  37  -1.139   1.148   2.872
  285    HA   PRO  38           HA       PRO  38   3.048   1.102   4.927
  286    HB2  PRO  38           HB2      PRO  38   3.481  -0.948   2.743
  287    HB3  PRO  38           HB1      PRO  38   4.581  -0.444   4.043
  288    HG2  PRO  38           HG2      PRO  38   3.360  -2.768   4.217
  289    HG3  PRO  38           HG1      PRO  38   3.481  -1.720   5.654
  290    HD2  PRO  38           HD2      PRO  38   1.127  -2.125   3.813
  291    HD3  PRO  38           HD1      PRO  38   1.166  -2.067   5.590
  292    H    ALA  39           HN       ALA  39   4.218   2.108   3.036
  293    HA   ALA  39           HA       ALA  39   2.496   3.944   1.823
  294    HB1  ALA  39           HB1      ALA  39   4.812   4.421   2.447
  295    HB2  ALA  39           HB2      ALA  39   4.528   4.804   0.749
  296    HB3  ALA  39           HB3      ALA  39   5.397   3.330   1.185
  297    H    GLY  40           HN       GLY  40   1.380   3.921  -0.032
  298    HA2  GLY  40           HA2      GLY  40   0.807   3.651  -2.229
  299    HA3  GLY  40           HA1      GLY  40   2.362   2.881  -2.511
  300    H    ARG  41           HN       ARG  41  -0.636   2.159  -0.684
  301    HA   ARG  41           HA       ARG  41  -0.961  -0.370  -2.147
  302    HB2  ARG  41           HB2      ARG  41   0.442  -0.753  -0.029
  303    HB3  ARG  41           HB1      ARG  41  -0.994  -0.357   0.898
  304    HG2  ARG  41           HG2      ARG  41  -0.915  -2.729   0.821
  305    HG3  ARG  41           HG1      ARG  41  -2.166  -2.266  -0.335
  306    HD2  ARG  41           HD2      ARG  41   0.699  -2.996  -1.034
  307    HD3  ARG  41           HD1      ARG  41  -0.687  -4.066  -1.190
  308    HE   ARG  41           HE       ARG  41  -1.504  -2.140  -2.816
  309   HH11  ARG  41          HH11      ARG  41   1.767  -3.408  -2.526
  310   HH12  ARG  41          HH12      ARG  41   2.181  -3.062  -4.170
  311   HH21  ARG  41          HH21      ARG  41  -0.904  -1.667  -4.973
  312   HH22  ARG  41          HH22      ARG  41   0.669  -2.078  -5.552
  313    H    CYS  42           HN       CYS  42  -2.252   2.085  -0.023
  314    HA   CYS  42           HA       CYS  42  -4.949   1.224   0.020
  315    HB2  CYS  42           HB2      CYS  42  -3.574   3.802   0.662
  316    HB3  CYS  42           HB1      CYS  42  -5.329   3.823   0.455
  317    H    ILE  43           HN       ILE  43  -3.096   2.613  -2.507
  318    HA   ILE  43           HA       ILE  43  -4.969   3.713  -4.224
  319    HB   ILE  43           HB       ILE  43  -2.699   1.796  -4.899
  320   HG12  ILE  43          HG12      ILE  43  -1.940   3.832  -3.728
  321   HG13  ILE  43          HG11      ILE  43  -1.387   3.832  -5.396
  322   HG21  ILE  43          HG21      ILE  43  -4.216   3.618  -6.801
  323   HG22  ILE  43          HG22      ILE  43  -4.222   1.855  -6.810
  324   HG23  ILE  43          HG23      ILE  43  -2.744   2.732  -7.206
  325   HD11  ILE  43          HD11      ILE  43  -3.178   5.436  -5.968
  326   HD12  ILE  43          HD12      ILE  43  -2.084   6.050  -4.731
  327   HD13  ILE  43          HD13      ILE  43  -3.680   5.458  -4.275
  328    H    ASP  44           HN       ASP  44  -4.152   0.233  -3.927
  329    HA   ASP  44           HA       ASP  44  -6.146  -0.660  -5.794
  330    HB2  ASP  44           HB2      ASP  44  -4.854  -2.401  -3.662
  331    HB3  ASP  44           HB1      ASP  44  -5.435  -2.886  -5.250
  332    H    ILE  45           HN       ILE  45  -5.836  -0.593  -2.254
  333    HA   ILE  45           HA       ILE  45  -8.213  -1.975  -1.619
  334    HB   ILE  45           HB       ILE  45  -6.610  -0.004   0.065
  335   HG12  ILE  45          HG12      ILE  45  -6.579  -3.066  -0.056
  336   HG13  ILE  45          HG11      ILE  45  -5.287  -1.991  -0.588
  337   HG21  ILE  45          HG21      ILE  45  -8.731  -1.979   0.997
  338   HG22  ILE  45          HG22      ILE  45  -8.913  -0.224   0.952
  339   HG23  ILE  45          HG23      ILE  45  -7.738  -0.958   2.041
  340   HD11  ILE  45          HD11      ILE  45  -4.713  -2.991   1.520
  341   HD12  ILE  45          HD12      ILE  45  -6.219  -2.442   2.262
  342   HD13  ILE  45          HD13      ILE  45  -4.988  -1.267   1.769
  343    H    GLU  46           HN       GLU  46  -7.615   1.476  -2.218
  344    HA   GLU  46           HA       GLU  46 -10.166   2.441  -1.351
  345    HB2  GLU  46           HB2      GLU  46  -8.224   3.968  -1.560
  346    HB3  GLU  46           HB1      GLU  46  -8.210   3.723  -3.304
  347    HG2  GLU  46           HG2      GLU  46 -10.502   4.722  -3.415
  348    HG3  GLU  46           HG1      GLU  46 -10.403   5.054  -1.685
  349    H    LEU  47           HN       LEU  47  -8.931   1.151  -4.382
  350    HA   LEU  47           HA       LEU  47 -11.103   1.801  -6.070
  351    HB2  LEU  47           HB2      LEU  47  -9.152   1.266  -7.215
  352    HB3  LEU  47           HB1      LEU  47  -8.697   0.015  -6.081
  353    HG   LEU  47           HG       LEU  47 -10.456  -1.439  -7.088
  354   HD11  LEU  47          HD11      LEU  47 -11.281  -0.968  -9.368
  355   HD12  LEU  47          HD12      LEU  47 -10.556   0.641  -9.297
  356   HD13  LEU  47          HD13      LEU  47 -11.869   0.212  -8.198
  357   HD21  LEU  47          HD21      LEU  47  -8.088  -1.755  -7.597
  358   HD22  LEU  47          HD22      LEU  47  -8.194  -0.600  -8.928
  359   HD23  LEU  47          HD23      LEU  47  -9.073  -2.130  -9.009
  360    H    TYR  48           HN       TYR  48 -10.481  -0.774  -3.732
  361    HA   TYR  48           HA       TYR  48 -12.892  -2.274  -4.417
  362    HB2  TYR  48           HB2      TYR  48 -11.121  -2.679  -1.971
  363    HB3  TYR  48           HB1      TYR  48 -12.224  -3.852  -2.707
  364    HD1  TYR  48           HD1      TYR  48  -9.068  -3.923  -2.051
  365    HD2  TYR  48           HD2      TYR  48 -11.342  -3.449  -5.643
  366    HE1  TYR  48           HE1      TYR  48  -7.200  -4.823  -3.354
  367    HE2  TYR  48           HE2      TYR  48  -9.466  -4.353  -6.936
  368    HH   TYR  48           HH       TYR  48  -6.965  -4.551  -6.670
  369    H    THR  49           HN       THR  49 -11.912   0.233  -2.185
  370    HA   THR  49           HA       THR  49 -14.470   0.060  -0.670
  371    HB   THR  49           HB       THR  49 -13.354   1.252   1.162
  372    HG1  THR  49           HG1      THR  49 -10.832   1.155  -0.080
  373   HG21  THR  49          HG21      THR  49 -11.579  -0.994   0.139
  374   HG22  THR  49          HG22      THR  49 -13.057  -1.191   1.088
  375   HG23  THR  49          HG23      THR  49 -11.657  -0.396   1.797
  376    H    ASP  50           HN       ASP  50 -14.554   1.032  -3.108
  377    HA   ASP  50           HA       ASP  50 -13.851   3.439  -4.037
  378    HB2  ASP  50           HB2      ASP  50 -14.906   1.564  -5.290
  379    HB3  ASP  50           HB1      ASP  50 -16.476   2.049  -4.677
  380    H    GLY  51           HN       GLY  51 -14.164   4.637  -1.799
  381    HA2  GLY  51           HA2      GLY  51 -15.011   6.665  -1.000
  382    HA3  GLY  51           HA1      GLY  51 -16.416   6.507  -2.052
  383    H    ARG  52           HN       ARG  52 -16.155   3.562  -0.636
  384    HA   ARG  52           HA       ARG  52 -18.357   3.880   1.125
  385    HB2  ARG  52           HB2      ARG  52 -17.722   1.775  -0.146
  386    HB3  ARG  52           HB1      ARG  52 -16.406   1.545   0.991
  387    HG2  ARG  52           HG2      ARG  52 -18.299   0.109   1.563
  388    HG3  ARG  52           HG1      ARG  52 -18.036   1.301   2.840
  389    HD2  ARG  52           HD2      ARG  52 -19.905   2.634   2.078
  390    HD3  ARG  52           HD1      ARG  52 -20.090   1.644   0.628
  391    HE   ARG  52           HE       ARG  52 -20.595   0.654   3.376
  392   HH11  ARG  52          HH11      ARG  52 -22.858  -0.272   0.186
  393   HH12  ARG  52          HH12      ARG  52 -21.501   0.784  -0.017
  394   HH21  ARG  52          HH21      ARG  52 -23.371  -1.122   2.232
  395   HH22  ARG  52          HH22      ARG  52 -22.401  -0.719   3.612
  396    H    VAL  53           HN       VAL  53 -14.875   3.508   1.593
  397    HA   VAL  53           HA       VAL  53 -14.931   4.948   4.106
  398    HB   VAL  53           HB       VAL  53 -15.260   2.706   5.020
  399   HG11  VAL  53          HG11      VAL  53 -13.774   0.801   4.550
  400   HG12  VAL  53          HG12      VAL  53 -12.894   1.774   3.368
  401   HG13  VAL  53          HG13      VAL  53 -14.589   1.365   3.084
  402   HG21  VAL  53          HG21      VAL  53 -13.659   4.115   6.279
  403   HG22  VAL  53          HG22      VAL  53 -12.320   3.435   5.353
  404   HG23  VAL  53          HG23      VAL  53 -13.257   2.403   6.435
  405    H    GLU  54           HN       GLU  54 -12.907   5.891   4.572
  406    HA   GLU  54           HA       GLU  54 -11.055   6.257   2.418
  407    HB2  GLU  54           HB2      GLU  54 -11.514   8.080   3.996
  408    HB3  GLU  54           HB1      GLU  54 -10.970   7.098   5.353
  409    HG2  GLU  54           HG2      GLU  54  -8.665   7.066   4.239
  410    HG3  GLU  54           HG1      GLU  54  -9.283   8.276   3.121
  411    H    CYS  55           HN       CYS  55  -9.461   4.813   1.899
  412    HA   CYS  55           HA       CYS  55  -8.391   2.971   3.846
  413    HB2  CYS  55           HB2      CYS  55  -8.538   2.398   1.405
  414    HB3  CYS  55           HB1      CYS  55  -7.229   3.543   1.099
  415    H    ARG  56           HN       ARG  56  -6.348   3.025   4.755
  416    HA   ARG  56           HA       ARG  56  -5.110   5.717   4.922
  417    HB2  ARG  56           HB2      ARG  56  -5.558   3.696   7.174
  418    HB3  ARG  56           HB1      ARG  56  -4.825   5.294   7.345
  419    HG2  ARG  56           HG2      ARG  56  -6.911   6.394   6.811
  420    HG3  ARG  56           HG1      ARG  56  -7.666   4.870   6.352
  421    HD2  ARG  56           HD2      ARG  56  -8.498   5.550   8.519
  422    HD3  ARG  56           HD1      ARG  56  -7.500   4.107   8.701
  423    HE   ARG  56           HE       ARG  56  -5.676   5.644   9.454
  424   HH11  ARG  56          HH11      ARG  56  -8.994   6.690   9.792
  425   HH12  ARG  56          HH12      ARG  56  -8.657   7.736  11.129
  426   HH21  ARG  56          HH21      ARG  56  -5.265   6.914  11.282
  427   HH22  ARG  56          HH22      ARG  56  -6.535   7.859  11.973
  428    H    GLU  57           HN       GLU  57  -3.080   5.615   4.068
  429    HA   GLU  57           HA       GLU  57  -1.445   3.203   4.614
  430    HB2  GLU  57           HB2      GLU  57  -0.192   3.604   2.516
  431    HB3  GLU  57           HB1      GLU  57  -1.893   3.258   2.238
  432    HG2  GLU  57           HG2      GLU  57  -2.361   5.583   1.736
  433    HG3  GLU  57           HG1      GLU  57  -0.718   6.047   2.204
  434    H    LEU  58           HN       LEU  58   0.883   3.564   4.641
  435    HA   LEU  58           HA       LEU  58   1.611   5.848   6.287
  436    HB2  LEU  58           HB2      LEU  58   3.015   3.300   5.431
  437    HB3  LEU  58           HB1      LEU  58   3.849   4.542   6.358
  438    HG   LEU  58           HG       LEU  58   1.257   3.330   7.374
  439   HD11  LEU  58          HD11      LEU  58   2.497   1.704   8.715
  440   HD12  LEU  58          HD12      LEU  58   3.999   2.176   7.914
  441   HD13  LEU  58          HD13      LEU  58   2.707   1.412   6.987
  442   HD21  LEU  58          HD21      LEU  58   2.013   5.394   8.455
  443   HD22  LEU  58          HD22      LEU  58   3.580   4.665   8.802
  444   HD23  LEU  58          HD23      LEU  58   2.127   4.040   9.575
  445    H    ARG  59           HN       ARG  59   3.539   7.154   5.800
  446    HA   ARG  59           HA       ARG  59   3.712   7.967   3.058
  447    HB2  ARG  59           HB2      ARG  59   5.315   9.633   3.745
  448    HB3  ARG  59           HB1      ARG  59   3.982   9.615   4.903
  449    HG2  ARG  59           HG2      ARG  59   6.577   8.136   5.462
  450    HG3  ARG  59           HG1      ARG  59   6.401   9.851   5.818
  451    HD2  ARG  59           HD2      ARG  59   4.696   7.619   6.980
  452    HD3  ARG  59           HD1      ARG  59   6.000   8.465   7.823
  453    HE   ARG  59           HE       ARG  59   3.311   9.398   7.351
  454   HH11  ARG  59          HH11      ARG  59   6.588  10.464   8.024
  455   HH12  ARG  59          HH12      ARG  59   6.081  11.992   8.665
  456   HH21  ARG  59          HH21      ARG  59   3.868  12.546   8.716
  457   HH22  ARG  59          HH22      ARG  59   2.682  11.439   8.109
  458    HA   PRO  60           HA       PRO  60   7.182   5.519   1.592
  459    HB2  PRO  60           HB2      PRO  60   8.531   7.318  -0.010
  460    HB3  PRO  60           HB1      PRO  60   7.001   6.554  -0.486
  461    HG2  PRO  60           HG2      PRO  60   7.465   9.276   0.691
  462    HG3  PRO  60           HG1      PRO  60   6.405   8.804  -0.657
  463    HD2  PRO  60           HD2      PRO  60   5.431   9.239   1.851
  464    HD3  PRO  60           HD1      PRO  60   4.734   8.000   0.766
  465    H    ASP  61           HN       ASP  61   7.805   8.554   3.216
  466    HA   ASP  61           HA       ASP  61  10.552   8.163   3.887
  467    HB2  ASP  61           HB2      ASP  61   9.583  10.396   3.964
  468    HB3  ASP  61           HB1      ASP  61   8.331   9.875   5.082
  469    H    VAL  62           HN       VAL  62  11.336   7.733   6.109
  470    HA   VAL  62           HA       VAL  62  10.387   5.320   7.217
  471    HB   VAL  62           HB       VAL  62  12.225   7.365   8.547
  472   HG11  VAL  62          HG11      VAL  62  11.342   5.740  10.172
  473   HG12  VAL  62          HG12      VAL  62  13.062   5.465   9.905
  474   HG13  VAL  62          HG13      VAL  62  11.874   4.397   9.155
  475   HG21  VAL  62          HG21      VAL  62  12.993   4.978   6.813
  476   HG22  VAL  62          HG22      VAL  62  14.114   6.051   7.655
  477   HG23  VAL  62          HG23      VAL  62  13.110   6.678   6.348
  478    H    PHE  63           HN       PHE  63   8.329   5.361   7.913
  479    HA   PHE  63           HA       PHE  63   7.091   7.372   9.486
  480    HB2  PHE  63           HB2      PHE  63   5.290   5.655   9.842
  481    HB3  PHE  63           HB1      PHE  63   5.700   5.917   8.158
  482    HD1  PHE  63           HD1      PHE  63   5.689   3.476  10.913
  483    HD2  PHE  63           HD2      PHE  63   6.821   4.137   6.840
  484    HE1  PHE  63           HE1      PHE  63   5.955   1.062  10.583
  485    HE2  PHE  63           HE2      PHE  63   7.090   1.719   6.529
  486    HZ   PHE  63           HZ       PHE  63   6.659   0.170   8.401
  487    H    GLY  64           HN       GLY  64   7.128   7.723  11.608
  488    HA2  GLY  64           HA2      GLY  64   7.148   6.702  13.908
  489    HA3  GLY  64           HA1      GLY  64   8.614   5.871  13.401
  490    H    ALA  65           HN       ALA  65   9.003   7.207  15.557
  491    HA   ALA  65           HA       ALA  65  10.758   9.416  14.866
  492    HB1  ALA  65           HB1      ALA  65   8.440   9.900  16.794
  493    HB2  ALA  65           HB2      ALA  65   8.615  10.612  15.190
  494    HB3  ALA  65           HB3      ALA  65   9.761  11.027  16.466
  Start of MODEL   11
    1    H1   MET   1           HT1      MET   1 -14.326  -2.316  12.034
    2    H2   MET   1           HT2      MET   1 -14.438  -0.734  11.452
    3    H3   MET   1           HT3      MET   1 -12.924  -1.464  11.630
    4    HA   MET   1           HA       MET   1 -13.429  -3.066   9.937
    5    HB2  MET   1           HB2      MET   1 -15.915  -3.103  10.394
    6    HB3  MET   1           HB1      MET   1 -16.061  -1.539   9.606
    7    HG2  MET   1           HG2      MET   1 -15.256  -2.552   7.500
    8    HG3  MET   1           HG1      MET   1 -15.173  -4.119   8.306
    9    HE1  MET   1           HE1      MET   1 -16.697  -5.381   6.646
   10    HE2  MET   1           HE2      MET   1 -16.757  -3.939   5.629
   11    HE3  MET   1           HE3      MET   1 -18.247  -4.777   6.055
   12    H    ASN   2           HN       ASN   2 -11.547  -1.826   9.410
   13    HA   ASN   2           HA       ASN   2 -11.784   0.711   8.010
   14    HB2  ASN   2           HB2      ASN   2  -9.285   0.553   7.800
   15    HB3  ASN   2           HB1      ASN   2  -9.885   0.517   9.455
   16   HD21  ASN   2          HD21      ASN   2  -8.156  -0.482  10.306
   17   HD22  ASN   2          HD22      ASN   2  -7.698  -2.106   9.967
   18    H    ALA   3           HN       ALA   3 -10.278   0.872   6.025
   19    HA   ALA   3           HA       ALA   3 -11.723  -0.136   3.897
   20    HB1  ALA   3           HB1      ALA   3 -10.387   1.906   3.788
   21    HB2  ALA   3           HB2      ALA   3  -9.992   0.819   2.459
   22    HB3  ALA   3           HB3      ALA   3  -8.895   0.956   3.837
   23    H    ILE   4           HN       ILE   4  -8.879  -1.445   5.433
   24    HA   ILE   4           HA       ILE   4  -8.031  -3.206   3.352
   25    HB   ILE   4           HB       ILE   4  -7.440  -3.488   6.328
   26   HG12  ILE   4          HG12      ILE   4  -5.184  -2.341   5.631
   27   HG13  ILE   4          HG11      ILE   4  -6.089  -1.731   4.256
   28   HG21  ILE   4          HG21      ILE   4  -5.435  -4.734   5.634
   29   HG22  ILE   4          HG22      ILE   4  -5.897  -4.554   3.938
   30   HG23  ILE   4          HG23      ILE   4  -6.901  -5.504   5.038
   31   HD11  ILE   4          HD11      ILE   4  -6.615  -1.148   7.180
   32   HD12  ILE   4          HD12      ILE   4  -7.628  -0.575   5.851
   33   HD13  ILE   4          HD13      ILE   4  -5.945  -0.053   5.971
   34    H    ASP   5           HN       ASP   5 -10.024  -3.469   6.233
   35    HA   ASP   5           HA       ASP   5 -10.555  -6.275   6.101
   36    HB2  ASP   5           HB2      ASP   5 -10.613  -4.969   8.199
   37    HB3  ASP   5           HB1      ASP   5 -11.987  -4.040   7.602
   38    H    ILE   6           HN       ILE   6 -12.230  -3.409   4.927
   39    HA   ILE   6           HA       ILE   6 -14.635  -4.716   4.047
   40    HB   ILE   6           HB       ILE   6 -13.422  -2.034   3.215
   41   HG12  ILE   6          HG12      ILE   6 -15.572  -2.699   5.283
   42   HG13  ILE   6          HG11      ILE   6 -13.944  -2.127   5.624
   43   HG21  ILE   6          HG21      ILE   6 -15.671  -1.433   2.369
   44   HG22  ILE   6          HG22      ILE   6 -16.257  -3.058   2.740
   45   HG23  ILE   6          HG23      ILE   6 -15.018  -2.822   1.505
   46   HD11  ILE   6          HD11      ILE   6 -16.175  -0.589   4.310
   47   HD12  ILE   6          HD12      ILE   6 -14.524   0.006   4.498
   48   HD13  ILE   6          HD13      ILE   6 -15.502  -0.347   5.921
   49    H    ALA   7           HN       ALA   7 -11.535  -3.891   2.540
   50    HA   ALA   7           HA       ALA   7 -12.185  -4.635  -0.120
   51    HB1  ALA   7           HB1      ALA   7  -9.796  -4.614  -0.571
   52    HB2  ALA   7           HB2      ALA   7  -9.445  -4.598   1.167
   53    HB3  ALA   7           HB3      ALA   7 -10.249  -3.218   0.418
   54    H    ILE   8           HN       ILE   8 -11.142  -6.520   2.660
   55    HA   ILE   8           HA       ILE   8 -10.559  -9.013   1.478
   56    HB   ILE   8           HB       ILE   8 -12.034  -8.477   4.107
   57   HG12  ILE   8          HG12      ILE   8  -9.059  -9.002   3.655
   58   HG13  ILE   8          HG11      ILE   8  -9.768  -7.434   4.012
   59   HG21  ILE   8          HG21      ILE   8 -11.327 -10.757   4.789
   60   HG22  ILE   8          HG22      ILE   8 -10.670 -11.034   3.172
   61   HG23  ILE   8          HG23      ILE   8 -12.404 -10.786   3.398
   62   HD11  ILE   8          HD11      ILE   8 -10.486  -8.262   6.203
   63   HD12  ILE   8          HD12      ILE   8  -8.743  -8.393   5.969
   64   HD13  ILE   8          HD13      ILE   8  -9.756  -9.829   5.839
   65    H    ASN   9           HN       ASN   9 -13.625  -7.782   2.793
   66    HA   ASN   9           HA       ASN   9 -15.275  -9.918   1.938
   67    HB2  ASN   9           HB2      ASN   9 -16.074  -7.029   2.487
   68    HB3  ASN   9           HB1      ASN   9 -17.172  -8.404   2.425
   69   HD21  ASN   9          HD21      ASN   9 -16.762  -6.558   4.580
   70   HD22  ASN   9          HD22      ASN   9 -16.239  -7.472   5.944
   71    H    LYS  10           HN       LYS  10 -14.196  -7.002   0.341
   72    HA   LYS  10           HA       LYS  10 -16.166  -6.881  -1.714
   73    HB2  LYS  10           HB2      LYS  10 -14.641  -4.993  -0.803
   74    HB3  LYS  10           HB1      LYS  10 -13.382  -5.614  -1.865
   75    HG2  LYS  10           HG2      LYS  10 -16.103  -4.801  -2.943
   76    HG3  LYS  10           HG1      LYS  10 -14.835  -3.625  -2.648
   77    HD2  LYS  10           HD2      LYS  10 -13.335  -5.004  -4.177
   78    HD3  LYS  10           HD1      LYS  10 -14.777  -5.935  -4.612
   79    HE2  LYS  10           HE2      LYS  10 -14.292  -2.972  -5.048
   80    HE3  LYS  10           HE1      LYS  10 -14.417  -4.215  -6.290
   81    HZ1  LYS  10           HZ1      LYS  10 -16.575  -3.189  -4.538
   82    HZ2  LYS  10           HZ2      LYS  10 -16.755  -4.534  -5.547
   83    HZ3  LYS  10           HZ3      LYS  10 -16.436  -3.012  -6.213
   84    H    LEU  11           HN       LEU  11 -12.878  -8.273  -1.576
   85    HA   LEU  11           HA       LEU  11 -13.212  -9.450  -4.251
   86    HB2  LEU  11           HB2      LEU  11 -10.858  -9.773  -2.361
   87    HB3  LEU  11           HB1      LEU  11 -10.922 -10.251  -4.048
   88    HG   LEU  11           HG       LEU  11 -10.534  -7.508  -2.845
   89   HD11  LEU  11          HD11      LEU  11  -8.761  -7.330  -4.545
   90   HD12  LEU  11          HD12      LEU  11  -9.211  -8.911  -5.187
   91   HD13  LEU  11          HD13      LEU  11  -8.566  -8.771  -3.555
   92   HD21  LEU  11          HD21      LEU  11 -12.468  -7.142  -4.295
   93   HD22  LEU  11          HD22      LEU  11 -11.617  -7.885  -5.654
   94   HD23  LEU  11          HD23      LEU  11 -11.029  -6.372  -4.948
   95    H    GLY  12           HN       GLY  12 -14.080 -10.209  -1.113
   96    HA2  GLY  12           HA2      GLY  12 -15.503 -12.039  -0.644
   97    HA3  GLY  12           HA1      GLY  12 -14.677 -12.994  -1.865
   98    H    SER  13           HN       SER  13 -11.964 -12.358  -0.932
   99    HA   SER  13           HA       SER  13 -11.815 -13.522   1.756
  100    HB2  SER  13           HB2      SER  13 -10.454 -15.449   1.010
  101    HB3  SER  13           HB1      SER  13 -12.042 -15.486   0.242
  102    HG   SER  13           HG       SER  13 -10.992 -15.547  -1.564
  103    H    VAL  14           HN       VAL  14  -9.529 -13.792   2.455
  104    HA   VAL  14           HA       VAL  14  -7.930 -11.461   1.841
  105    HB   VAL  14           HB       VAL  14  -7.776 -13.725   3.870
  106   HG11  VAL  14          HG11      VAL  14  -5.557 -11.688   3.456
  107   HG12  VAL  14          HG12      VAL  14  -5.436 -13.427   3.191
  108   HG13  VAL  14          HG13      VAL  14  -5.699 -12.809   4.817
  109   HG21  VAL  14          HG21      VAL  14  -7.887 -10.698   4.088
  110   HG22  VAL  14          HG22      VAL  14  -7.800 -11.815   5.464
  111   HG23  VAL  14          HG23      VAL  14  -9.202 -11.843   4.401
  112    H    SER  15           HN       SER  15  -7.906 -14.876   1.064
  113    HA   SER  15           HA       SER  15  -5.247 -15.086   0.115
  114    HB2  SER  15           HB2      SER  15  -6.120 -17.153  -1.057
  115    HB3  SER  15           HB1      SER  15  -6.518 -17.090   0.660
  116    HG   SER  15           HG       SER  15  -8.586 -16.820   0.198
  117    H    ALA  16           HN       ALA  16  -8.315 -14.230  -1.426
  118    HA   ALA  16           HA       ALA  16  -7.282 -13.780  -4.073
  119    HB1  ALA  16           HB1      ALA  16  -9.848 -12.756  -2.795
  120    HB2  ALA  16           HB2      ALA  16  -9.671 -14.282  -3.666
  121    HB3  ALA  16           HB3      ALA  16  -9.481 -12.748  -4.518
  122    H    LEU  17           HN       LEU  17  -7.938 -11.704  -1.249
  123    HA   LEU  17           HA       LEU  17  -7.496  -9.205  -2.505
  124    HB2  LEU  17           HB2      LEU  17  -8.704  -9.412  -0.351
  125    HB3  LEU  17           HB1      LEU  17  -7.217  -9.926   0.436
  126    HG   LEU  17           HG       LEU  17  -6.204  -7.730   0.049
  127   HD11  LEU  17          HD11      LEU  17  -7.504  -5.824  -0.821
  128   HD12  LEU  17          HD12      LEU  17  -8.835  -6.914  -1.222
  129   HD13  LEU  17          HD13      LEU  17  -7.277  -7.077  -2.038
  130   HD21  LEU  17          HD21      LEU  17  -8.914  -7.410   1.351
  131   HD22  LEU  17          HD22      LEU  17  -7.482  -6.404   1.610
  132   HD23  LEU  17          HD23      LEU  17  -7.476  -8.093   2.109
  133    H    ALA  18           HN       ALA  18  -5.358 -11.263  -0.620
  134    HA   ALA  18           HA       ALA  18  -3.116  -9.522  -0.556
  135    HB1  ALA  18           HB1      ALA  18  -1.921 -11.448   0.380
  136    HB2  ALA  18           HB2      ALA  18  -3.242 -12.521  -0.097
  137    HB3  ALA  18           HB3      ALA  18  -3.518 -11.278   1.124
  138    H    ALA  19           HN       ALA  19  -4.065 -12.231  -2.651
  139    HA   ALA  19           HA       ALA  19  -1.739 -12.439  -4.238
  140    HB1  ALA  19           HB1      ALA  19  -3.214 -13.525  -5.904
  141    HB2  ALA  19           HB2      ALA  19  -4.636 -12.940  -5.035
  142    HB3  ALA  19           HB3      ALA  19  -3.558 -14.104  -4.270
  143    H    ALA  20           HN       ALA  20  -4.636 -10.421  -4.554
  144    HA   ALA  20           HA       ALA  20  -4.012  -9.154  -7.022
  145    HB1  ALA  20           HB1      ALA  20  -5.847  -8.216  -4.792
  146    HB2  ALA  20           HB2      ALA  20  -6.297  -9.280  -6.128
  147    HB3  ALA  20           HB3      ALA  20  -5.839  -7.602  -6.441
  148    H    LEU  21           HN       LEU  21  -3.453  -8.255  -3.644
  149    HA   LEU  21           HA       LEU  21  -2.297  -5.667  -4.200
  150    HB2  LEU  21           HB2      LEU  21  -2.407  -7.336  -1.667
  151    HB3  LEU  21           HB1      LEU  21  -1.750  -5.706  -1.732
  152    HG   LEU  21           HG       LEU  21  -4.643  -6.405  -2.403
  153   HD11  LEU  21          HD11      LEU  21  -3.502  -5.292   0.176
  154   HD12  LEU  21          HD12      LEU  21  -4.298  -6.855  -0.060
  155   HD13  LEU  21          HD13      LEU  21  -5.222  -5.366  -0.229
  156   HD21  LEU  21          HD21      LEU  21  -3.326  -3.713  -1.945
  157   HD22  LEU  21          HD22      LEU  21  -5.042  -3.992  -2.267
  158   HD23  LEU  21          HD23      LEU  21  -3.844  -4.361  -3.503
  159    H    GLY  22           HN       GLY  22  -1.129  -8.879  -4.243
  160    HA2  GLY  22           HA2      GLY  22   0.932  -9.733  -4.820
  161    HA3  GLY  22           HA1      GLY  22   1.572  -8.098  -4.890
  162    H    VAL  23           HN       VAL  23  -0.047  -9.201  -2.029
  163    HA   VAL  23           HA       VAL  23   2.500  -9.362  -0.523
  164    HB   VAL  23           HB       VAL  23   1.387  -8.306   1.378
  165   HG11  VAL  23          HG11      VAL  23   2.423  -6.789  -0.253
  166   HG12  VAL  23          HG12      VAL  23   1.004  -6.035   0.479
  167   HG13  VAL  23          HG13      VAL  23   0.903  -6.691  -1.157
  168   HG21  VAL  23          HG21      VAL  23  -0.909  -9.187   1.084
  169   HG22  VAL  23          HG22      VAL  23  -1.138  -8.162  -0.334
  170   HG23  VAL  23          HG23      VAL  23  -0.937  -7.435   1.258
  171    H    ASN  24           HN       ASN  24   1.815 -10.343   1.842
  172    HA   ASN  24           HA       ASN  24   0.826 -13.054   1.306
  173    HB2  ASN  24           HB2      ASN  24   2.930 -12.625   2.600
  174    HB3  ASN  24           HB1      ASN  24   1.980 -11.894   3.876
  175   HD21  ASN  24          HD21      ASN  24   2.599 -13.386   5.435
  176   HD22  ASN  24          HD22      ASN  24   2.130 -15.044   5.415
  177    H    GLN  25           HN       GLN  25  -0.574 -14.091   2.937
  178    HA   GLN  25           HA       GLN  25  -3.081 -12.723   3.076
  179    HB2  GLN  25           HB2      GLN  25  -2.220 -15.449   4.115
  180    HB3  GLN  25           HB1      GLN  25  -3.854 -14.841   4.306
  181    HG2  GLN  25           HG2      GLN  25  -3.929 -16.272   2.442
  182    HG3  GLN  25           HG1      GLN  25  -3.976 -14.638   1.785
  183   HE21  GLN  25          HE21      GLN  25  -2.182 -13.894   0.580
  184   HE22  GLN  25          HE22      GLN  25  -0.959 -14.951  -0.020
  185    H    SER  26           HN       SER  26  -0.736 -13.737   5.558
  186    HA   SER  26           HA       SER  26  -2.268 -12.869   7.806
  187    HB2  SER  26           HB2      SER  26  -0.426 -14.554   7.958
  188    HB3  SER  26           HB1      SER  26   0.749 -13.286   7.625
  189    HG   SER  26           HG       SER  26  -0.791 -12.483   9.645
  190    H    ALA  27           HN       ALA  27  -0.132 -11.243   5.590
  191    HA   ALA  27           HA       ALA  27   0.455  -8.868   7.003
  192    HB1  ALA  27           HB1      ALA  27   0.919  -7.874   4.799
  193    HB2  ALA  27           HB2      ALA  27   0.100  -9.222   4.002
  194    HB3  ALA  27           HB3      ALA  27   1.591  -9.503   4.901
  195    H    ILE  28           HN       ILE  28  -2.326  -9.828   5.056
  196    HA   ILE  28           HA       ILE  28  -3.655  -7.316   4.901
  197    HB   ILE  28           HB       ILE  28  -4.871 -10.114   4.778
  198   HG12  ILE  28          HG12      ILE  28  -3.072  -9.855   3.111
  199   HG13  ILE  28          HG11      ILE  28  -4.646  -9.954   2.332
  200   HG21  ILE  28          HG21      ILE  28  -6.673  -9.064   3.480
  201   HG22  ILE  28          HG22      ILE  28  -5.936  -7.477   3.727
  202   HG23  ILE  28          HG23      ILE  28  -6.574  -8.389   5.103
  203   HD11  ILE  28          HD11      ILE  28  -4.624  -7.500   2.061
  204   HD12  ILE  28          HD12      ILE  28  -3.287  -8.307   1.247
  205   HD13  ILE  28          HD13      ILE  28  -3.007  -7.465   2.770
  206    H    SER  29           HN       SER  29  -4.223 -10.170   6.949
  207    HA   SER  29           HA       SER  29  -6.232  -9.076   8.597
  208    HB2  SER  29           HB2      SER  29  -4.244 -11.313   9.192
  209    HB3  SER  29           HB1      SER  29  -5.753 -11.014  10.065
  210    HG   SER  29           HG       SER  29  -5.378 -12.361   7.767
  211    H    GLN  30           HN       GLN  30  -2.812  -8.703   8.597
  212    HA   GLN  30           HA       GLN  30  -2.508  -7.689  11.291
  213    HB2  GLN  30           HB2      GLN  30  -0.696  -8.927  10.125
  214    HB3  GLN  30           HB1      GLN  30  -0.618  -7.670   8.894
  215    HG2  GLN  30           HG2      GLN  30   0.115  -6.056  10.627
  216    HG3  GLN  30           HG1      GLN  30   0.079  -7.349  11.829
  217   HE21  GLN  30          HE21      GLN  30   1.716  -8.911  11.794
  218   HE22  GLN  30          HE22      GLN  30   3.147  -8.771  10.836
  219    H    TRP  31           HN       TRP  31  -2.798  -6.339   8.021
  220    HA   TRP  31           HA       TRP  31  -2.286  -3.613   8.716
  221    HB2  TRP  31           HB2      TRP  31  -3.664  -4.851   6.319
  222    HB3  TRP  31           HB1      TRP  31  -3.369  -3.123   6.475
  223    HD1  TRP  31           HD1      TRP  31  -0.245  -3.978   7.734
  224    HE1  TRP  31           HE1      TRP  31   1.517  -4.339   5.887
  225    HE3  TRP  31           HE3      TRP  31  -3.347  -4.738   3.731
  226    HZ2  TRP  31           HZ2      TRP  31   1.581  -4.896   3.137
  227    HZ3  TRP  31           HZ3      TRP  31  -2.363  -5.173   1.543
  228    HH2  TRP  31           HH2      TRP  31   0.041  -5.239   1.250
  229    H    ARG  32           HN       ARG  32  -5.183  -5.586   8.431
  230    HA   ARG  32           HA       ARG  32  -7.052  -3.433   8.773
  231    HB2  ARG  32           HB2      ARG  32  -8.748  -5.072   8.646
  232    HB3  ARG  32           HB1      ARG  32  -7.460  -5.729   7.645
  233    HG2  ARG  32           HG2      ARG  32  -6.782  -7.210   9.452
  234    HG3  ARG  32           HG1      ARG  32  -8.039  -6.542  10.492
  235    HD2  ARG  32           HD2      ARG  32  -9.746  -7.336   8.824
  236    HD3  ARG  32           HD1      ARG  32  -8.433  -8.122   7.935
  237    HE   ARG  32           HE       ARG  32  -8.155  -9.068  10.450
  238   HH11  ARG  32          HH11      ARG  32 -10.850  -9.031   8.193
  239   HH12  ARG  32          HH12      ARG  32 -11.553 -10.489   8.815
  240   HH21  ARG  32          HH21      ARG  32  -9.116 -10.955  11.299
  241   HH22  ARG  32          HH22      ARG  32 -10.563 -11.587  10.583
  242    H    ALA  33           HN       ALA  33  -5.270  -5.576  10.868
  243    HA   ALA  33           HA       ALA  33  -6.595  -4.770  13.293
  244    HB1  ALA  33           HB1      ALA  33  -5.462  -6.943  13.132
  245    HB2  ALA  33           HB2      ALA  33  -4.734  -5.972  14.411
  246    HB3  ALA  33           HB3      ALA  33  -3.914  -6.136  12.856
  247    H    ARG  34           HN       ARG  34  -3.831  -3.708  11.416
  248    HA   ARG  34           HA       ARG  34  -2.599  -1.955  13.300
  249    HB2  ARG  34           HB2      ARG  34  -1.435  -3.018  11.380
  250    HB3  ARG  34           HB1      ARG  34  -2.412  -2.087  10.262
  251    HG2  ARG  34           HG2      ARG  34  -0.861  -0.469  10.274
  252    HG3  ARG  34           HG1      ARG  34  -1.163  -0.184  11.983
  253    HD2  ARG  34           HD2      ARG  34   0.554  -1.797  12.600
  254    HD3  ARG  34           HD1      ARG  34   0.792  -2.243  10.911
  255    HE   ARG  34           HE       ARG  34   1.266   0.553  11.701
  256   HH11  ARG  34          HH11      ARG  34   4.257  -1.830  10.445
  257   HH12  ARG  34          HH12      ARG  34   2.708  -2.525  10.775
  258   HH21  ARG  34          HH21      ARG  34   3.324   1.432  11.257
  259   HH22  ARG  34          HH22      ARG  34   4.607   0.402  10.718
  260    H    GLY  35           HN       GLY  35  -5.200  -1.681  11.010
  261    HA2  GLY  35           HA2      GLY  35  -6.795  -0.009  10.791
  262    HA3  GLY  35           HA1      GLY  35  -5.831   1.061  11.794
  263    H    ARG  36           HN       ARG  36  -3.728  -0.145   9.572
  264    HA   ARG  36           HA       ARG  36  -4.089   1.721   7.411
  265    HB2  ARG  36           HB2      ARG  36  -2.065   3.143   8.047
  266    HB3  ARG  36           HB1      ARG  36  -3.485   3.390   9.050
  267    HG2  ARG  36           HG2      ARG  36  -2.397   1.700  10.689
  268    HG3  ARG  36           HG1      ARG  36  -0.920   1.963   9.763
  269    HD2  ARG  36           HD2      ARG  36  -0.986   4.359  10.314
  270    HD3  ARG  36           HD1      ARG  36  -2.516   4.137  11.171
  271    HE   ARG  36           HE       ARG  36  -0.263   2.541  12.107
  272   HH11  ARG  36          HH11      ARG  36  -2.124   5.485  12.624
  273   HH12  ARG  36          HH12      ARG  36  -1.569   5.674  14.257
  274   HH21  ARG  36          HH21      ARG  36  -0.135   4.145  15.179
  275   HH22  ARG  36          HH22      ARG  36   0.404   2.786  14.242
  276    H    VAL  37           HN       VAL  37  -2.324   1.600   5.875
  277    HA   VAL  37           HA       VAL  37  -0.743  -0.917   6.090
  278    HB   VAL  37           HB       VAL  37  -0.890  -1.165   3.682
  279   HG11  VAL  37          HG11      VAL  37  -2.800  -2.031   4.928
  280   HG12  VAL  37          HG12      VAL  37  -3.302  -1.462   3.338
  281   HG13  VAL  37          HG13      VAL  37  -3.635  -0.481   4.767
  282   HG21  VAL  37          HG21      VAL  37  -2.337   1.505   3.614
  283   HG22  VAL  37          HG22      VAL  37  -2.139   0.423   2.234
  284   HG23  VAL  37          HG23      VAL  37  -0.727   1.167   2.978
  285    HA   PRO  38           HA       PRO  38   3.092   1.448   5.218
  286    HB2  PRO  38           HB2      PRO  38   3.671  -0.765   3.229
  287    HB3  PRO  38           HB1      PRO  38   4.684  -0.137   4.549
  288    HG2  PRO  38           HG2      PRO  38   3.491  -2.463   4.829
  289    HG3  PRO  38           HG1      PRO  38   3.514  -1.315   6.189
  290    HD2  PRO  38           HD2      PRO  38   1.269  -1.909   4.264
  291    HD3  PRO  38           HD1      PRO  38   1.221  -1.724   6.034
  292    H    ALA  39           HN       ALA  39   4.331   2.332   3.290
  293    HA   ALA  39           HA       ALA  39   2.595   4.026   1.899
  294    HB1  ALA  39           HB1      ALA  39   4.863   4.655   2.557
  295    HB2  ALA  39           HB2      ALA  39   4.640   4.887   0.822
  296    HB3  ALA  39           HB3      ALA  39   5.541   3.490   1.412
  297    H    GLY  40           HN       GLY  40   1.569   3.859  -0.022
  298    HA2  GLY  40           HA2      GLY  40   1.197   3.461  -2.253
  299    HA3  GLY  40           HA1      GLY  40   2.733   2.617  -2.349
  300    H    ARG  41           HN       ARG  41  -0.403   2.157  -0.684
  301    HA   ARG  41           HA       ARG  41  -0.805  -0.415  -1.972
  302    HB2  ARG  41           HB2      ARG  41   0.673  -0.930  -0.013
  303    HB3  ARG  41           HB1      ARG  41  -0.542  -0.256   1.057
  304    HG2  ARG  41           HG2      ARG  41  -0.729  -2.636   1.160
  305    HG3  ARG  41           HG1      ARG  41  -2.136  -2.041   0.274
  306    HD2  ARG  41           HD2      ARG  41   0.373  -3.154  -1.033
  307    HD3  ARG  41           HD1      ARG  41  -1.090  -4.093  -0.716
  308    HE   ARG  41           HE       ARG  41  -2.220  -2.292  -2.178
  309   HH11  ARG  41          HH11      ARG  41   1.054  -3.464  -2.766
  310   HH12  ARG  41          HH12      ARG  41   0.991  -3.132  -4.463
  311   HH21  ARG  41          HH21      ARG  41  -0.924  -2.208  -5.388
  312   HH22  ARG  41          HH22      ARG  41  -2.279  -1.853  -4.376
  313    H    CYS  42           HN       CYS  42  -1.966   1.887   0.468
  314    HA   CYS  42           HA       CYS  42  -4.648   0.979   0.572
  315    HB2  CYS  42           HB2      CYS  42  -3.208   3.398   1.487
  316    HB3  CYS  42           HB1      CYS  42  -4.926   3.641   1.199
  317    H    ILE  43           HN       ILE  43  -3.007   2.844  -1.830
  318    HA   ILE  43           HA       ILE  43  -5.008   4.059  -3.274
  319    HB   ILE  43           HB       ILE  43  -2.665   2.404  -4.324
  320   HG12  ILE  43          HG12      ILE  43  -2.988   5.423  -3.976
  321   HG13  ILE  43          HG11      ILE  43  -2.031   4.368  -2.944
  322   HG21  ILE  43          HG21      ILE  43  -4.420   4.306  -5.934
  323   HG22  ILE  43          HG22      ILE  43  -4.326   2.554  -6.119
  324   HG23  ILE  43          HG23      ILE  43  -2.928   3.549  -6.506
  325   HD11  ILE  43          HD11      ILE  43  -1.491   4.992  -5.848
  326   HD12  ILE  43          HD12      ILE  43  -0.530   3.907  -4.838
  327   HD13  ILE  43          HD13      ILE  43  -0.627   5.624  -4.451
  328    H    ASP  44           HN       ASP  44  -4.055   0.613  -3.466
  329    HA   ASP  44           HA       ASP  44  -6.167   0.013  -5.369
  330    HB2  ASP  44           HB2      ASP  44  -3.877  -0.934  -5.585
  331    HB3  ASP  44           HB1      ASP  44  -4.109  -1.822  -4.084
  332    H    ILE  45           HN       ILE  45  -5.517  -0.542  -1.943
  333    HA   ILE  45           HA       ILE  45  -7.704  -2.268  -1.367
  334    HB   ILE  45           HB       ILE  45  -6.084  -0.341   0.348
  335   HG12  ILE  45          HG12      ILE  45  -6.135  -3.391   0.110
  336   HG13  ILE  45          HG11      ILE  45  -4.840  -2.308  -0.396
  337   HG21  ILE  45          HG21      ILE  45  -8.228  -2.243   1.350
  338   HG22  ILE  45          HG22      ILE  45  -8.309  -0.481   1.361
  339   HG23  ILE  45          HG23      ILE  45  -7.118  -1.307   2.359
  340   HD11  ILE  45          HD11      ILE  45  -4.426  -1.747   1.973
  341   HD12  ILE  45          HD12      ILE  45  -4.242  -3.466   1.631
  342   HD13  ILE  45          HD13      ILE  45  -5.695  -2.886   2.452
  343    H    GLU  46           HN       GLU  46  -7.415   1.268  -1.572
  344    HA   GLU  46           HA       GLU  46 -10.096   1.826  -0.690
  345    HB2  GLU  46           HB2      GLU  46  -8.187   3.452  -0.462
  346    HB3  GLU  46           HB1      GLU  46  -8.193   3.660  -2.207
  347    HG2  GLU  46           HG2      GLU  46 -10.502   4.542  -2.064
  348    HG3  GLU  46           HG1      GLU  46 -10.450   4.361  -0.309
  349    H    LEU  47           HN       LEU  47  -8.472   1.280  -3.759
  350    HA   LEU  47           HA       LEU  47 -10.493   1.885  -5.587
  351    HB2  LEU  47           HB2      LEU  47  -7.936   0.677  -5.659
  352    HB3  LEU  47           HB1      LEU  47  -8.986  -0.583  -6.273
  353    HG   LEU  47           HG       LEU  47  -8.666   2.216  -7.422
  354   HD11  LEU  47          HD11      LEU  47  -7.740  -0.470  -8.509
  355   HD12  LEU  47          HD12      LEU  47  -6.713   0.804  -7.842
  356   HD13  LEU  47          HD13      LEU  47  -7.603   1.087  -9.335
  357   HD21  LEU  47          HD21      LEU  47 -10.381  -0.076  -8.442
  358   HD22  LEU  47          HD22      LEU  47 -10.086   1.447  -9.290
  359   HD23  LEU  47          HD23      LEU  47 -10.961   1.451  -7.763
  360    H    TYR  48           HN       TYR  48 -10.201  -0.787  -3.321
  361    HA   TYR  48           HA       TYR  48 -12.507  -2.183  -4.442
  362    HB2  TYR  48           HB2      TYR  48 -10.935  -2.860  -1.933
  363    HB3  TYR  48           HB1      TYR  48 -12.109  -3.900  -2.762
  364    HD1  TYR  48           HD1      TYR  48  -8.971  -4.269  -2.117
  365    HD2  TYR  48           HD2      TYR  48 -11.187  -3.301  -5.647
  366    HE1  TYR  48           HE1      TYR  48  -7.165  -5.177  -3.519
  367    HE2  TYR  48           HE2      TYR  48  -9.386  -4.210  -7.027
  368    HH   TYR  48           HH       TYR  48  -6.769  -4.568  -6.656
  369    H    THR  49           HN       THR  49 -11.789   0.012  -1.761
  370    HA   THR  49           HA       THR  49 -14.556  -0.211  -0.787
  371    HB   THR  49           HB       THR  49 -13.901   1.414   0.960
  372    HG1  THR  49           HG1      THR  49 -12.212   2.413  -0.547
  373   HG21  THR  49          HG21      THR  49 -11.790  -0.754   0.634
  374   HG22  THR  49          HG22      THR  49 -13.409  -1.016   1.282
  375   HG23  THR  49          HG23      THR  49 -12.289   0.027   2.144
  376    H    ASP  50           HN       ASP  50 -15.095   0.271  -3.035
  377    HA   ASP  50           HA       ASP  50 -14.878   2.260  -4.720
  378    HB2  ASP  50           HB2      ASP  50 -17.620   1.282  -3.805
  379    HB3  ASP  50           HB1      ASP  50 -17.280   2.059  -5.348
  380    H    GLY  51           HN       GLY  51 -17.213   2.590  -2.066
  381    HA2  GLY  51           HA2      GLY  51 -16.520   5.407  -1.656
  382    HA3  GLY  51           HA1      GLY  51 -18.175   5.070  -2.170
  383    H    ARG  52           HN       ARG  52 -16.143   3.083  -0.050
  384    HA   ARG  52           HA       ARG  52 -18.241   3.154   2.011
  385    HB2  ARG  52           HB2      ARG  52 -15.786   1.382   1.743
  386    HB3  ARG  52           HB1      ARG  52 -17.013   1.226   2.995
  387    HG2  ARG  52           HG2      ARG  52 -17.506   0.853   0.020
  388    HG3  ARG  52           HG1      ARG  52 -17.214  -0.446   1.172
  389    HD2  ARG  52           HD2      ARG  52 -19.569  -0.386   0.867
  390    HD3  ARG  52           HD1      ARG  52 -19.267   0.350   2.435
  391    HE   ARG  52           HE       ARG  52 -20.088   2.351   1.665
  392   HH11  ARG  52          HH11      ARG  52 -20.514   1.278  -2.182
  393   HH12  ARG  52          HH12      ARG  52 -19.655   0.224  -1.105
  394   HH21  ARG  52          HH21      ARG  52 -21.377   3.242  -1.431
  395   HH22  ARG  52          HH22      ARG  52 -21.187   3.708   0.230
  396    H    VAL  53           HN       VAL  53 -14.656   3.418   1.854
  397    HA   VAL  53           HA       VAL  53 -14.574   5.443   3.925
  398    HB   VAL  53           HB       VAL  53 -14.811   3.384   5.281
  399   HG11  VAL  53          HG11      VAL  53 -13.858   1.753   3.737
  400   HG12  VAL  53          HG12      VAL  53 -13.091   1.638   5.319
  401   HG13  VAL  53          HG13      VAL  53 -12.244   2.426   3.986
  402   HG21  VAL  53          HG21      VAL  53 -13.504   5.202   6.279
  403   HG22  VAL  53          HG22      VAL  53 -12.024   4.590   5.533
  404   HG23  VAL  53          HG23      VAL  53 -12.845   3.642   6.775
  405    H    GLU  54           HN       GLU  54 -12.426   6.315   4.241
  406    HA   GLU  54           HA       GLU  54 -10.731   6.248   1.874
  407    HB2  GLU  54           HB2      GLU  54 -10.275   7.796   4.477
  408    HB3  GLU  54           HB1      GLU  54  -9.540   8.108   2.913
  409    HG2  GLU  54           HG2      GLU  54 -11.147   9.814   3.251
  410    HG3  GLU  54           HG1      GLU  54 -11.842   8.723   2.055
  411    H    CYS  55           HN       CYS  55  -8.871   4.993   1.733
  412    HA   CYS  55           HA       CYS  55  -8.011   3.466   4.093
  413    HB2  CYS  55           HB2      CYS  55  -8.308   2.434   1.762
  414    HB3  CYS  55           HB1      CYS  55  -6.831   3.271   1.301
  415    H    ARG  56           HN       ARG  56  -6.422   4.254   5.364
  416    HA   ARG  56           HA       ARG  56  -4.716   6.441   4.393
  417    HB2  ARG  56           HB2      ARG  56  -5.009   5.291   7.211
  418    HB3  ARG  56           HB1      ARG  56  -4.014   6.671   6.776
  419    HG2  ARG  56           HG2      ARG  56  -5.950   7.564   7.778
  420    HG3  ARG  56           HG1      ARG  56  -6.146   7.852   6.051
  421    HD2  ARG  56           HD2      ARG  56  -8.235   7.096   7.183
  422    HD3  ARG  56           HD1      ARG  56  -7.729   6.011   5.880
  423    HE   ARG  56           HE       ARG  56  -6.627   5.076   8.287
  424   HH11  ARG  56          HH11      ARG  56  -9.826   5.363   6.846
  425   HH12  ARG  56          HH12      ARG  56 -10.456   4.014   7.734
  426   HH21  ARG  56          HH21      ARG  56  -7.466   3.292   9.387
  427   HH22  ARG  56          HH22      ARG  56  -9.130   2.845   9.166
  428    H    GLU  57           HN       GLU  57  -2.901   5.767   3.372
  429    HA   GLU  57           HA       GLU  57  -1.330   3.520   4.451
  430    HB2  GLU  57           HB2      GLU  57   0.126   3.864   2.395
  431    HB3  GLU  57           HB1      GLU  57  -1.519   3.344   2.073
  432    HG2  GLU  57           HG2      GLU  57  -2.123   5.693   1.498
  433    HG3  GLU  57           HG1      GLU  57  -0.433   6.151   1.741
  434    H    LEU  58           HN       LEU  58   0.935   3.824   4.783
  435    HA   LEU  58           HA       LEU  58   1.476   6.234   6.294
  436    HB2  LEU  58           HB2      LEU  58   3.090   3.681   5.905
  437    HB3  LEU  58           HB1      LEU  58   3.509   4.973   7.023
  438    HG   LEU  58           HG       LEU  58   0.952   3.324   7.201
  439   HD11  LEU  58          HD11      LEU  58   1.942   2.168   9.113
  440   HD12  LEU  58          HD12      LEU  58   3.469   3.023   8.864
  441   HD13  LEU  58          HD13      LEU  58   2.881   1.885   7.648
  442   HD21  LEU  58          HD21      LEU  58   2.154   5.321   9.141
  443   HD22  LEU  58          HD22      LEU  58   0.737   4.315   9.452
  444   HD23  LEU  58          HD23      LEU  58   0.684   5.532   8.182
  445    H    ARG  59           HN       ARG  59   3.558   7.383   6.008
  446    HA   ARG  59           HA       ARG  59   3.840   8.158   3.250
  447    HB2  ARG  59           HB2      ARG  59   5.242   9.130   5.773
  448    HB3  ARG  59           HB1      ARG  59   5.439   9.863   4.168
  449    HG2  ARG  59           HG2      ARG  59   3.002  10.381   4.128
  450    HG3  ARG  59           HG1      ARG  59   2.836   9.673   5.739
  451    HD2  ARG  59           HD2      ARG  59   4.186  11.395   6.720
  452    HD3  ARG  59           HD1      ARG  59   4.668  12.012   5.136
  453    HE   ARG  59           HE       ARG  59   1.841  12.106   5.997
  454   HH11  ARG  59          HH11      ARG  59   4.746  13.810   4.959
  455   HH12  ARG  59          HH12      ARG  59   3.931  15.334   4.776
  456   HH21  ARG  59          HH21      ARG  59   1.675  15.503   5.228
  457   HH22  ARG  59          HH22      ARG  59   0.785  14.110   5.757
  458    HA   PRO  60           HA       PRO  60   7.365   5.735   2.031
  459    HB2  PRO  60           HB2      PRO  60   8.576   7.265   0.179
  460    HB3  PRO  60           HB1      PRO  60   6.876   6.782  -0.024
  461    HG2  PRO  60           HG2      PRO  60   7.978   9.374   1.048
  462    HG3  PRO  60           HG1      PRO  60   6.753   9.109  -0.209
  463    HD2  PRO  60           HD2      PRO  60   6.075   9.641   2.392
  464    HD3  PRO  60           HD1      PRO  60   5.073   8.628   1.319
  465    H    ASP  61           HN       ASP  61   7.982   6.695   4.516
  466    HA   ASP  61           HA       ASP  61  10.215   8.017   5.220
  467    HB2  ASP  61           HB2      ASP  61   8.780   6.830   6.824
  468    HB3  ASP  61           HB1      ASP  61   9.309   5.274   6.203
  469    H    VAL  62           HN       VAL  62  10.284   4.569   4.294
  470    HA   VAL  62           HA       VAL  62  12.956   4.978   3.077
  471    HB   VAL  62           HB       VAL  62  11.891   2.337   4.214
  472   HG11  VAL  62          HG11      VAL  62  14.635   3.004   3.070
  473   HG12  VAL  62          HG12      VAL  62  13.405   1.992   2.311
  474   HG13  VAL  62          HG13      VAL  62  14.171   1.464   3.808
  475   HG21  VAL  62          HG21      VAL  62  13.574   2.567   6.003
  476   HG22  VAL  62          HG22      VAL  62  12.421   3.900   6.043
  477   HG23  VAL  62          HG23      VAL  62  14.036   4.158   5.381
  478    H    PHE  63           HN       PHE  63  11.898   5.669   1.178
  479    HA   PHE  63           HA       PHE  63  10.191   3.828  -0.338
  480    HB2  PHE  63           HB2      PHE  63   9.812   6.307  -0.377
  481    HB3  PHE  63           HB1      PHE  63  11.395   6.536  -1.102
  482    HD1  PHE  63           HD1      PHE  63   8.191   4.662  -1.724
  483    HD2  PHE  63           HD2      PHE  63  11.484   6.763  -3.471
  484    HE1  PHE  63           HE1      PHE  63   7.175   4.418  -3.945
  485    HE2  PHE  63           HE2      PHE  63  10.451   6.513  -5.701
  486    HZ   PHE  63           HZ       PHE  63   8.295   5.336  -5.937
  487    H    GLY  64           HN       GLY  64  13.462   5.131  -0.377
  488    HA2  GLY  64           HA2      GLY  64  14.632   2.888  -1.647
  489    HA3  GLY  64           HA1      GLY  64  14.406   4.182  -2.824
  490    H    ALA  65           HN       ALA  65  15.031   6.411  -1.802
  491    HA   ALA  65           HA       ALA  65  17.258   6.503  -0.010
  492    HB1  ALA  65           HB1      ALA  65  18.453   5.598  -1.964
  493    HB2  ALA  65           HB2      ALA  65  18.965   7.255  -1.652
  494    HB3  ALA  65           HB3      ALA  65  17.849   6.909  -2.977
  Start of MODEL   12
    1    H1   MET   1           HT1      MET   1 -13.033  -3.915  10.777
    2    H2   MET   1           HT2      MET   1 -14.647  -4.349  11.017
    3    H3   MET   1           HT3      MET   1 -14.016  -2.991  11.802
    4    HA   MET   1           HA       MET   1 -14.347  -3.325   8.878
    5    HB2  MET   1           HB2      MET   1 -15.950  -1.645  10.863
    6    HB3  MET   1           HB1      MET   1 -16.078  -1.480   9.114
    7    HG2  MET   1           HG2      MET   1 -17.916  -2.816   9.950
    8    HG3  MET   1           HG1      MET   1 -16.853  -3.829   8.968
    9    HE1  MET   1           HE1      MET   1 -17.786  -6.129   9.922
   10    HE2  MET   1           HE2      MET   1 -18.996  -5.194  10.801
   11    HE3  MET   1           HE3      MET   1 -18.055  -6.426  11.639
   12    H    ASN   2           HN       ASN   2 -12.472  -2.591   8.192
   13    HA   ASN   2           HA       ASN   2 -11.926   0.263   8.340
   14    HB2  ASN   2           HB2      ASN   2  -9.454  -0.128   8.622
   15    HB3  ASN   2           HB1      ASN   2 -10.396  -0.491  10.059
   16   HD21  ASN   2          HD21      ASN   2  -9.008  -1.894  10.973
   17   HD22  ASN   2          HD22      ASN   2  -8.576  -3.420  10.301
   18    H    ALA   3           HN       ALA   3 -10.162   0.741   6.630
   19    HA   ALA   3           HA       ALA   3 -11.044   0.318   4.112
   20    HB1  ALA   3           HB1      ALA   3  -8.148   0.657   4.919
   21    HB2  ALA   3           HB2      ALA   3  -9.325   1.957   4.711
   22    HB3  ALA   3           HB3      ALA   3  -8.807   0.992   3.323
   23    H    ILE   4           HN       ILE   4  -8.694  -1.713   5.802
   24    HA   ILE   4           HA       ILE   4  -7.960  -3.319   3.541
   25    HB   ILE   4           HB       ILE   4  -7.557  -4.128   6.442
   26   HG12  ILE   4          HG12      ILE   4  -5.197  -2.978   6.108
   27   HG13  ILE   4          HG11      ILE   4  -6.033  -2.003   4.914
   28   HG21  ILE   4          HG21      ILE   4  -5.898  -4.719   3.983
   29   HG22  ILE   4          HG22      ILE   4  -7.017  -5.834   4.770
   30   HG23  ILE   4          HG23      ILE   4  -5.571  -5.298   5.623
   31   HD11  ILE   4          HD11      ILE   4  -6.638  -2.163   7.869
   32   HD12  ILE   4          HD12      ILE   4  -7.573  -1.212   6.712
   33   HD13  ILE   4          HD13      ILE   4  -5.872  -0.829   7.011
   34    H    ASP   5           HN       ASP   5 -10.151  -3.611   6.284
   35    HA   ASP   5           HA       ASP   5 -10.993  -6.303   5.961
   36    HB2  ASP   5           HB2      ASP   5 -11.186  -5.080   8.098
   37    HB3  ASP   5           HB1      ASP   5 -12.360  -3.984   7.382
   38    H    ILE   6           HN       ILE   6 -12.160  -3.258   4.709
   39    HA   ILE   6           HA       ILE   6 -14.654  -4.307   3.688
   40    HB   ILE   6           HB       ILE   6 -13.267  -1.623   3.256
   41   HG12  ILE   6          HG12      ILE   6 -13.945  -1.903   5.582
   42   HG13  ILE   6          HG11      ILE   6 -15.004  -0.736   4.816
   43   HG21  ILE   6          HG21      ILE   6 -15.407  -0.787   2.357
   44   HG22  ILE   6          HG22      ILE   6 -16.095  -2.411   2.450
   45   HG23  ILE   6          HG23      ILE   6 -14.749  -2.079   1.357
   46   HD11  ILE   6          HD11      ILE   6 -15.684  -3.609   5.449
   47   HD12  ILE   6          HD12      ILE   6 -16.760  -2.454   4.661
   48   HD13  ILE   6          HD13      ILE   6 -16.234  -2.179   6.321
   49    H    ALA   7           HN       ALA   7 -11.373  -3.773   2.484
   50    HA   ALA   7           HA       ALA   7 -11.976  -4.376  -0.269
   51    HB1  ALA   7           HB1      ALA   7  -9.294  -4.543   1.140
   52    HB2  ALA   7           HB2      ALA   7  -9.953  -3.113   0.344
   53    HB3  ALA   7           HB3      ALA   7  -9.572  -4.553  -0.609
   54    H    ILE   8           HN       ILE   8 -11.007  -6.284   2.559
   55    HA   ILE   8           HA       ILE   8 -10.786  -8.861   1.426
   56    HB   ILE   8           HB       ILE   8 -11.926  -8.055   4.154
   57   HG12  ILE   8          HG12      ILE   8  -9.134  -9.089   3.489
   58   HG13  ILE   8          HG11      ILE   8  -9.534  -7.390   3.676
   59   HG21  ILE   8          HG21      ILE   8 -11.498 -10.380   4.903
   60   HG22  ILE   8          HG22      ILE   8 -11.038 -10.831   3.259
   61   HG23  ILE   8          HG23      ILE   8 -12.693 -10.326   3.607
   62   HD11  ILE   8          HD11      ILE   8 -10.152  -7.805   6.007
   63   HD12  ILE   8          HD12      ILE   8  -8.482  -8.240   5.650
   64   HD13  ILE   8          HD13      ILE   8  -9.704  -9.501   5.808
   65    H    ASN   9           HN       ASN   9 -13.562  -7.114   2.719
   66    HA   ASN   9           HA       ASN   9 -15.606  -8.983   2.269
   67    HB2  ASN   9           HB2      ASN   9 -15.758  -6.991   3.769
   68    HB3  ASN   9           HB1      ASN   9 -15.771  -5.931   2.367
   69   HD21  ASN   9          HD21      ASN   9 -17.635  -8.136   4.320
   70   HD22  ASN   9          HD22      ASN   9 -19.165  -7.802   3.587
   71    H    LYS  10           HN       LYS  10 -14.318  -6.348   0.251
   72    HA   LYS  10           HA       LYS  10 -16.333  -6.474  -1.781
   73    HB2  LYS  10           HB2      LYS  10 -14.985  -4.418  -1.180
   74    HB3  LYS  10           HB1      LYS  10 -13.582  -5.134  -1.954
   75    HG2  LYS  10           HG2      LYS  10 -16.112  -4.799  -3.569
   76    HG3  LYS  10           HG1      LYS  10 -15.145  -3.373  -3.215
   77    HD2  LYS  10           HD2      LYS  10 -13.198  -4.365  -4.319
   78    HD3  LYS  10           HD1      LYS  10 -14.082  -5.870  -4.591
   79    HE2  LYS  10           HE2      LYS  10 -14.839  -3.174  -5.778
   80    HE3  LYS  10           HE1      LYS  10 -13.953  -4.441  -6.627
   81    HZ1  LYS  10           HZ1      LYS  10 -15.869  -5.904  -6.316
   82    HZ2  LYS  10           HZ2      LYS  10 -16.267  -4.521  -7.204
   83    HZ3  LYS  10           HZ3      LYS  10 -16.724  -4.644  -5.577
   84    H    LEU  11           HN       LEU  11 -13.121  -7.914  -1.375
   85    HA   LEU  11           HA       LEU  11 -13.278  -9.243  -4.001
   86    HB2  LEU  11           HB2      LEU  11 -11.043  -9.362  -1.945
   87    HB3  LEU  11           HB1      LEU  11 -10.987 -10.015  -3.572
   88    HG   LEU  11           HG       LEU  11 -10.860  -7.120  -2.694
   89   HD11  LEU  11          HD11      LEU  11  -8.852  -7.070  -4.154
   90   HD12  LEU  11          HD12      LEU  11  -9.080  -8.789  -4.490
   91   HD13  LEU  11          HD13      LEU  11  -8.730  -8.246  -2.850
   92   HD21  LEU  11          HD21      LEU  11 -11.410  -8.000  -5.538
   93   HD22  LEU  11          HD22      LEU  11 -11.053  -6.355  -4.990
   94   HD23  LEU  11          HD23      LEU  11 -12.532  -7.148  -4.471
   95    H    GLY  12           HN       GLY  12 -14.534  -9.822  -1.036
   96    HA2  GLY  12           HA2      GLY  12 -15.783 -11.645  -0.361
   97    HA3  GLY  12           HA1      GLY  12 -15.071 -12.614  -1.639
   98    H    SER  13           HN       SER  13 -12.312 -11.588  -0.391
   99    HA   SER  13           HA       SER  13 -12.029 -13.257   1.927
  100    HB2  SER  13           HB2      SER  13 -10.655 -15.040   0.765
  101    HB3  SER  13           HB1      SER  13 -12.364 -15.059   0.327
  102    HG   SER  13           HG       SER  13 -11.650 -13.652  -1.489
  103    H    VAL  14           HN       VAL  14  -9.783 -13.593   2.567
  104    HA   VAL  14           HA       VAL  14  -8.040 -11.324   2.034
  105    HB   VAL  14           HB       VAL  14  -7.970 -13.663   3.991
  106   HG11  VAL  14          HG11      VAL  14  -5.618 -13.320   3.355
  107   HG12  VAL  14          HG12      VAL  14  -5.906 -12.784   5.007
  108   HG13  VAL  14          HG13      VAL  14  -5.754 -11.596   3.708
  109   HG21  VAL  14          HG21      VAL  14  -9.434 -11.809   4.560
  110   HG22  VAL  14          HG22      VAL  14  -8.109 -10.653   4.345
  111   HG23  VAL  14          HG23      VAL  14  -8.061 -11.837   5.669
  112    H    SER  15           HN       SER  15  -8.259 -14.721   1.184
  113    HA   SER  15           HA       SER  15  -5.663 -15.163   0.191
  114    HB2  SER  15           HB2      SER  15  -6.777 -17.009  -1.140
  115    HB3  SER  15           HB1      SER  15  -7.203 -17.020   0.575
  116    HG   SER  15           HG       SER  15  -9.075 -17.253  -0.652
  117    H    ALA  16           HN       ALA  16  -8.633 -14.013  -1.363
  118    HA   ALA  16           HA       ALA  16  -7.559 -13.469  -3.944
  119    HB1  ALA  16           HB1      ALA  16  -9.998 -12.271  -2.583
  120    HB2  ALA  16           HB2      ALA  16  -9.971 -13.738  -3.565
  121    HB3  ALA  16           HB3      ALA  16  -9.629 -12.174  -4.305
  122    H    LEU  17           HN       LEU  17  -8.084 -11.431  -1.048
  123    HA   LEU  17           HA       LEU  17  -7.398  -8.961  -2.203
  124    HB2  LEU  17           HB2      LEU  17  -8.603  -9.137  -0.040
  125    HB3  LEU  17           HB1      LEU  17  -7.145  -9.762   0.724
  126    HG   LEU  17           HG       LEU  17  -5.989  -7.644   0.335
  127   HD11  LEU  17          HD11      LEU  17  -7.155  -5.638  -0.512
  128   HD12  LEU  17          HD12      LEU  17  -8.572  -6.619  -0.894
  129   HD13  LEU  17          HD13      LEU  17  -7.047  -6.897  -1.739
  130   HD21  LEU  17          HD21      LEU  17  -8.637  -7.170   1.704
  131   HD22  LEU  17          HD22      LEU  17  -7.165  -6.211   1.896
  132   HD23  LEU  17          HD23      LEU  17  -7.192  -7.892   2.421
  133    H    ALA  18           HN       ALA  18  -5.405 -11.261  -0.422
  134    HA   ALA  18           HA       ALA  18  -3.022  -9.731  -0.331
  135    HB1  ALA  18           HB1      ALA  18  -3.524 -11.539   1.238
  136    HB2  ALA  18           HB2      ALA  18  -1.978 -11.818   0.428
  137    HB3  ALA  18           HB3      ALA  18  -3.414 -12.724  -0.067
  138    H    ALA  19           HN       ALA  19  -4.223 -12.223  -2.563
  139    HA   ALA  19           HA       ALA  19  -1.923 -12.494  -4.203
  140    HB1  ALA  19           HB1      ALA  19  -3.468 -13.459  -5.862
  141    HB2  ALA  19           HB2      ALA  19  -4.848 -12.839  -4.949
  142    HB3  ALA  19           HB3      ALA  19  -3.808 -14.073  -4.243
  143    H    ALA  20           HN       ALA  20  -4.720 -10.330  -4.364
  144    HA   ALA  20           HA       ALA  20  -4.094  -9.008  -6.805
  145    HB1  ALA  20           HB1      ALA  20  -5.811  -8.067  -4.485
  146    HB2  ALA  20           HB2      ALA  20  -6.361  -9.021  -5.866
  147    HB3  ALA  20           HB3      ALA  20  -5.799  -7.365  -6.103
  148    H    LEU  21           HN       LEU  21  -3.264  -8.396  -3.430
  149    HA   LEU  21           HA       LEU  21  -1.973  -5.827  -3.965
  150    HB2  LEU  21           HB2      LEU  21  -2.320  -7.466  -1.430
  151    HB3  LEU  21           HB1      LEU  21  -1.528  -5.898  -1.472
  152    HG   LEU  21           HG       LEU  21  -4.435  -6.391  -2.229
  153   HD11  LEU  21          HD11      LEU  21  -3.283  -5.215   0.306
  154   HD12  LEU  21          HD12      LEU  21  -4.196  -6.720   0.132
  155   HD13  LEU  21          HD13      LEU  21  -4.994  -5.173  -0.150
  156   HD21  LEU  21          HD21      LEU  21  -3.493  -4.506  -3.432
  157   HD22  LEU  21          HD22      LEU  21  -2.921  -3.793  -1.924
  158   HD23  LEU  21          HD23      LEU  21  -4.654  -3.955  -2.229
  159    H    GLY  22           HN       GLY  22  -1.061  -9.078  -4.110
  160    HA2  GLY  22           HA2      GLY  22   0.938 -10.110  -4.598
  161    HA3  GLY  22           HA1      GLY  22   1.653  -8.515  -4.790
  162    H    VAL  23           HN       VAL  23   0.109  -9.766  -1.890
  163    HA   VAL  23           HA       VAL  23   2.668  -9.890  -0.419
  164    HB   VAL  23           HB       VAL  23   1.514  -8.934   1.581
  165   HG11  VAL  23          HG11      VAL  23   2.781  -7.416   0.125
  166   HG12  VAL  23          HG12      VAL  23   1.406  -6.587   0.857
  167   HG13  VAL  23          HG13      VAL  23   1.329  -7.098  -0.831
  168   HG21  VAL  23          HG21      VAL  23  -0.862  -8.448  -0.269
  169   HG22  VAL  23          HG22      VAL  23  -0.719  -7.855   1.387
  170   HG23  VAL  23          HG23      VAL  23  -0.815  -9.587   1.081
  171    H    ASN  24           HN       ASN  24   2.147 -10.951   1.863
  172    HA   ASN  24           HA       ASN  24   0.848 -13.510   1.523
  173    HB2  ASN  24           HB2      ASN  24   2.260 -12.180   3.838
  174    HB3  ASN  24           HB1      ASN  24   1.287 -13.614   4.130
  175   HD21  ASN  24          HD21      ASN  24   1.912 -15.598   3.141
  176   HD22  ASN  24          HD22      ASN  24   3.545 -15.858   2.639
  177    H    GLN  25           HN       GLN  25  -0.722 -14.276   2.944
  178    HA   GLN  25           HA       GLN  25  -3.064 -12.609   3.226
  179    HB2  GLN  25           HB2      GLN  25  -2.596 -15.544   3.995
  180    HB3  GLN  25           HB1      GLN  25  -4.157 -14.730   4.023
  181    HG2  GLN  25           HG2      GLN  25  -4.062 -16.059   2.022
  182    HG3  GLN  25           HG1      GLN  25  -3.973 -14.364   1.554
  183   HE21  GLN  25          HE21      GLN  25  -2.916 -14.628  -0.399
  184   HE22  GLN  25          HE22      GLN  25  -1.328 -15.291  -0.556
  185    H    SER  26           HN       SER  26  -0.555 -13.943   5.213
  186    HA   SER  26           HA       SER  26  -1.419 -13.268   7.805
  187    HB2  SER  26           HB2      SER  26   1.442 -13.383   6.733
  188    HB3  SER  26           HB1      SER  26   0.938 -13.603   8.408
  189    HG   SER  26           HG       SER  26  -0.400 -15.421   7.335
  190    H    ALA  27           HN       ALA  27   0.278 -11.433   5.284
  191    HA   ALA  27           HA       ALA  27   0.994  -9.128   6.777
  192    HB1  ALA  27           HB1      ALA  27   2.023  -9.678   4.608
  193    HB2  ALA  27           HB2      ALA  27   1.350  -8.048   4.586
  194    HB3  ALA  27           HB3      ALA  27   0.491  -9.368   3.785
  195    H    ILE  28           HN       ILE  28  -1.807  -9.881   4.744
  196    HA   ILE  28           HA       ILE  28  -3.277  -7.496   4.950
  197    HB   ILE  28           HB       ILE  28  -4.358 -10.349   4.753
  198   HG12  ILE  28          HG12      ILE  28  -2.755  -9.871   2.948
  199   HG13  ILE  28          HG11      ILE  28  -4.390 -10.008   2.314
  200   HG21  ILE  28          HG21      ILE  28  -6.135  -8.776   5.352
  201   HG22  ILE  28          HG22      ILE  28  -6.343  -9.350   3.698
  202   HG23  ILE  28          HG23      ILE  28  -5.696  -7.735   3.992
  203   HD11  ILE  28          HD11      ILE  28  -4.531  -7.564   2.190
  204   HD12  ILE  28          HD12      ILE  28  -3.193  -8.209   1.243
  205   HD13  ILE  28          HD13      ILE  28  -2.879  -7.447   2.801
  206    H    SER  29           HN       SER  29  -3.311 -10.407   6.971
  207    HA   SER  29           HA       SER  29  -5.334  -9.683   8.775
  208    HB2  SER  29           HB2      SER  29  -4.452 -11.984   8.488
  209    HB3  SER  29           HB1      SER  29  -2.929 -11.497   9.230
  210    HG   SER  29           HG       SER  29  -3.813 -11.788  11.095
  211    H    GLN  30           HN       GLN  30  -1.882  -8.914   8.734
  212    HA   GLN  30           HA       GLN  30  -1.760  -7.694  11.344
  213    HB2  GLN  30           HB2      GLN  30   0.106  -7.557   8.940
  214    HB3  GLN  30           HB1      GLN  30   0.450  -6.759  10.475
  215    HG2  GLN  30           HG2      GLN  30   0.515  -8.910  11.628
  216    HG3  GLN  30           HG1      GLN  30   0.050  -9.746  10.142
  217   HE21  GLN  30          HE21      GLN  30   1.587 -10.003   8.493
  218   HE22  GLN  30          HE22      GLN  30   3.276  -9.746   8.752
  219    H    TRP  31           HN       TRP  31  -2.147  -6.472   8.025
  220    HA   TRP  31           HA       TRP  31  -1.989  -3.704   8.574
  221    HB2  TRP  31           HB2      TRP  31  -3.353  -5.209   6.309
  222    HB3  TRP  31           HB1      TRP  31  -3.188  -3.455   6.351
  223    HD1  TRP  31           HD1      TRP  31   0.015  -4.248   7.648
  224    HE1  TRP  31           HE1      TRP  31   1.784  -4.517   5.799
  225    HE3  TRP  31           HE3      TRP  31  -3.066  -4.868   3.595
  226    HZ2  TRP  31           HZ2      TRP  31   1.879  -4.950   3.042
  227    HZ3  TRP  31           HZ3      TRP  31  -2.044  -5.193   1.391
  228    HH2  TRP  31           HH2      TRP  31   0.377  -5.232   1.121
  229    H    ARG  32           HN       ARG  32  -4.673  -5.953   8.532
  230    HA   ARG  32           HA       ARG  32  -6.755  -4.015   8.920
  231    HB2  ARG  32           HB2      ARG  32  -7.215  -6.167   7.796
  232    HB3  ARG  32           HB1      ARG  32  -6.780  -7.053   9.257
  233    HG2  ARG  32           HG2      ARG  32  -8.680  -6.115  10.446
  234    HG3  ARG  32           HG1      ARG  32  -9.080  -5.079   9.077
  235    HD2  ARG  32           HD2      ARG  32 -10.593  -6.966   9.157
  236    HD3  ARG  32           HD1      ARG  32  -9.575  -7.089   7.724
  237    HE   ARG  32           HE       ARG  32  -8.347  -8.601   9.698
  238   HH11  ARG  32          HH11      ARG  32 -11.579 -10.401   8.062
  239   HH12  ARG  32          HH12      ARG  32 -11.412  -8.676   7.931
  240   HH21  ARG  32          HH21      ARG  32  -8.603 -10.853   9.880
  241   HH22  ARG  32          HH22      ARG  32  -9.979 -11.632   9.166
  242    H    ALA  33           HN       ALA  33  -4.829  -6.141  11.002
  243    HA   ALA  33           HA       ALA  33  -6.256  -5.558  13.405
  244    HB1  ALA  33           HB1      ALA  33  -3.422  -6.626  13.044
  245    HB2  ALA  33           HB2      ALA  33  -4.892  -7.592  13.189
  246    HB3  ALA  33           HB3      ALA  33  -4.335  -6.630  14.557
  247    H    ARG  34           HN       ARG  34  -3.780  -3.969  11.605
  248    HA   ARG  34           HA       ARG  34  -2.911  -2.126  13.684
  249    HB2  ARG  34           HB2      ARG  34  -1.384  -3.067  11.947
  250    HB3  ARG  34           HB1      ARG  34  -2.276  -2.179  10.712
  251    HG2  ARG  34           HG2      ARG  34  -1.597  -0.104  11.536
  252    HG3  ARG  34           HG1      ARG  34  -1.103  -0.769  13.080
  253    HD2  ARG  34           HD2      ARG  34   0.846  -0.214  11.851
  254    HD3  ARG  34           HD1      ARG  34   0.756  -1.967  11.888
  255    HE   ARG  34           HE       ARG  34  -0.490  -1.150   9.550
  256   HH11  ARG  34          HH11      ARG  34   2.765  -1.016  10.879
  257   HH12  ARG  34          HH12      ARG  34   3.531  -1.027   9.323
  258   HH21  ARG  34          HH21      ARG  34   0.519  -1.120   7.524
  259   HH22  ARG  34          HH22      ARG  34   2.251  -1.089   7.417
  260    H    GLY  35           HN       GLY  35  -5.118  -2.195  10.970
  261    HA2  GLY  35           HA2      GLY  35  -6.904  -0.809  10.435
  262    HA3  GLY  35           HA1      GLY  35  -6.400   0.314  11.689
  263    H    ARG  36           HN       ARG  36  -3.683  -0.262   9.939
  264    HA   ARG  36           HA       ARG  36  -4.155   1.620   7.739
  265    HB2  ARG  36           HB2      ARG  36  -2.056   2.930   8.415
  266    HB3  ARG  36           HB1      ARG  36  -3.466   3.189   9.421
  267    HG2  ARG  36           HG2      ARG  36  -2.498   1.495  11.046
  268    HG3  ARG  36           HG1      ARG  36  -1.017   1.547  10.093
  269    HD2  ARG  36           HD2      ARG  36  -0.811   3.972  10.567
  270    HD3  ARG  36           HD1      ARG  36  -2.304   3.908  11.507
  271    HE   ARG  36           HE       ARG  36  -0.973   2.165  12.896
  272   HH11  ARG  36          HH11      ARG  36   0.417   5.094  11.503
  273   HH12  ARG  36          HH12      ARG  36   1.636   5.227  12.728
  274   HH21  ARG  36          HH21      ARG  36   0.654   2.372  14.474
  275   HH22  ARG  36          HH22      ARG  36   1.771   3.696  14.401
  276    H    VAL  37           HN       VAL  37  -2.491   1.580   6.127
  277    HA   VAL  37           HA       VAL  37  -0.978  -0.981   6.050
  278    HB   VAL  37           HB       VAL  37  -1.322  -0.976   3.581
  279   HG11  VAL  37          HG11      VAL  37  -3.687  -1.619   3.578
  280   HG12  VAL  37          HG12      VAL  37  -3.908  -0.856   5.154
  281   HG13  VAL  37          HG13      VAL  37  -2.847  -2.256   4.989
  282   HG21  VAL  37          HG21      VAL  37  -1.622   1.439   3.212
  283   HG22  VAL  37          HG22      VAL  37  -3.168   1.394   4.060
  284   HG23  VAL  37          HG23      VAL  37  -2.970   0.530   2.532
  285    HA   PRO  38           HA       PRO  38   2.909   1.141   4.891
  286    HB2  PRO  38           HB2      PRO  38   2.792  -0.741   2.498
  287    HB3  PRO  38           HB1      PRO  38   4.152  -0.391   3.588
  288    HG2  PRO  38           HG2      PRO  38   2.819  -2.640   3.857
  289    HG3  PRO  38           HG1      PRO  38   3.299  -1.717   5.301
  290    HD2  PRO  38           HD2      PRO  38   0.601  -1.921   4.001
  291    HD3  PRO  38           HD1      PRO  38   1.022  -1.854   5.725
  292    H    ALA  39           HN       ALA  39   3.569   2.774   3.503
  293    HA   ALA  39           HA       ALA  39   1.724   4.354   2.192
  294    HB1  ALA  39           HB1      ALA  39   4.715   4.269   1.745
  295    HB2  ALA  39           HB2      ALA  39   3.874   5.179   2.995
  296    HB3  ALA  39           HB3      ALA  39   3.644   5.596   1.296
  297    H    GLY  40           HN       GLY  40   0.952   4.517   0.129
  298    HA2  GLY  40           HA2      GLY  40   0.910   4.301  -2.202
  299    HA3  GLY  40           HA1      GLY  40   2.221   3.138  -2.127
  300    H    ARG  41           HN       ARG  41   0.899   1.349  -0.174
  301    HA   ARG  41           HA       ARG  41  -0.355  -0.319  -2.119
  302    HB2  ARG  41           HB2      ARG  41   0.998  -1.172  -0.177
  303    HB3  ARG  41           HB1      ARG  41  -0.307  -0.713   0.907
  304    HG2  ARG  41           HG2      ARG  41  -0.620  -3.015   0.617
  305    HG3  ARG  41           HG1      ARG  41  -1.792  -2.318  -0.492
  306    HD2  ARG  41           HD2      ARG  41   0.941  -3.393  -1.272
  307    HD3  ARG  41           HD1      ARG  41  -0.580  -4.267  -1.431
  308    HE   ARG  41           HE       ARG  41  -1.067  -2.041  -2.920
  309   HH11  ARG  41          HH11      ARG  41   1.965  -4.157  -4.607
  310   HH12  ARG  41          HH12      ARG  41   1.621  -4.365  -2.922
  311   HH21  ARG  41          HH21      ARG  41  -0.556  -1.803  -5.162
  312   HH22  ARG  41          HH22      ARG  41   0.744  -2.720  -5.863
  313    H    CYS  42           HN       CYS  42  -1.673   1.930   0.182
  314    HA   CYS  42           HA       CYS  42  -4.349   0.990   0.356
  315    HB2  CYS  42           HB2      CYS  42  -3.648   2.605   1.958
  316    HB3  CYS  42           HB1      CYS  42  -3.140   3.728   0.708
  317    H    ILE  43           HN       ILE  43  -2.690   2.653  -2.242
  318    HA   ILE  43           HA       ILE  43  -4.783   3.867  -3.651
  319    HB   ILE  43           HB       ILE  43  -2.355   2.339  -4.693
  320   HG12  ILE  43          HG12      ILE  43  -1.698   4.280  -3.405
  321   HG13  ILE  43          HG11      ILE  43  -1.414   4.635  -5.100
  322   HG21  ILE  43          HG21      ILE  43  -4.203   4.101  -6.326
  323   HG22  ILE  43          HG22      ILE  43  -3.985   2.358  -6.490
  324   HG23  ILE  43          HG23      ILE  43  -2.656   3.446  -6.875
  325   HD11  ILE  43          HD11      ILE  43  -2.293   6.572  -3.989
  326   HD12  ILE  43          HD12      ILE  43  -3.687   5.668  -3.402
  327   HD13  ILE  43          HD13      ILE  43  -3.496   5.974  -5.130
  328    H    ASP  44           HN       ASP  44  -3.697   0.524  -3.604
  329    HA   ASP  44           HA       ASP  44  -5.540  -0.531  -5.514
  330    HB2  ASP  44           HB2      ASP  44  -3.944  -1.942  -3.339
  331    HB3  ASP  44           HB1      ASP  44  -4.635  -2.685  -4.770
  332    H    ILE  45           HN       ILE  45  -5.339  -0.605  -1.971
  333    HA   ILE  45           HA       ILE  45  -7.674  -2.127  -1.482
  334    HB   ILE  45           HB       ILE  45  -6.064  -0.261   0.314
  335   HG12  ILE  45          HG12      ILE  45  -6.242  -3.298   0.033
  336   HG13  ILE  45          HG11      ILE  45  -4.843  -2.275  -0.262
  337   HG21  ILE  45          HG21      ILE  45  -8.382  -0.284   1.156
  338   HG22  ILE  45          HG22      ILE  45  -7.290  -1.118   2.260
  339   HG23  ILE  45          HG23      ILE  45  -8.351  -2.049   1.200
  340   HD11  ILE  45          HD11      ILE  45  -6.071  -2.939   2.431
  341   HD12  ILE  45          HD12      ILE  45  -4.736  -1.805   2.174
  342   HD13  ILE  45          HD13      ILE  45  -4.531  -3.507   1.769
  343    H    GLU  46           HN       GLU  46  -7.209   1.288  -2.149
  344    HA   GLU  46           HA       GLU  46  -9.847   2.124  -1.259
  345    HB2  GLU  46           HB2      GLU  46  -7.712   3.586  -1.220
  346    HB3  GLU  46           HB1      GLU  46  -7.937   3.782  -2.953
  347    HG2  GLU  46           HG2      GLU  46 -10.196   4.733  -2.498
  348    HG3  GLU  46           HG1      GLU  46  -9.860   4.631  -0.770
  349    H    LEU  47           HN       LEU  47  -8.345   1.002  -4.187
  350    HA   LEU  47           HA       LEU  47 -10.394   1.624  -6.048
  351    HB2  LEU  47           HB2      LEU  47  -7.928   0.146  -6.020
  352    HB3  LEU  47           HB1      LEU  47  -9.140  -0.978  -6.593
  353    HG   LEU  47           HG       LEU  47  -8.681   1.756  -7.840
  354   HD11  LEU  47          HD11      LEU  47  -7.543  -0.905  -8.775
  355   HD12  LEU  47          HD12      LEU  47  -6.627   0.436  -8.081
  356   HD13  LEU  47          HD13      LEU  47  -7.435   0.636  -9.631
  357   HD21  LEU  47          HD21      LEU  47 -10.193  -0.676  -8.866
  358   HD22  LEU  47          HD22      LEU  47  -9.950   0.835  -9.746
  359   HD23  LEU  47          HD23      LEU  47 -10.910   0.826  -8.271
  360    H    TYR  48           HN       TYR  48 -10.008  -0.830  -3.569
  361    HA   TYR  48           HA       TYR  48 -12.488  -2.230  -4.283
  362    HB2  TYR  48           HB2      TYR  48 -10.676  -2.830  -1.911
  363    HB3  TYR  48           HB1      TYR  48 -11.854  -3.905  -2.676
  364    HD1  TYR  48           HD1      TYR  48  -8.570  -3.938  -2.173
  365    HD2  TYR  48           HD2      TYR  48 -11.166  -3.610  -5.557
  366    HE1  TYR  48           HE1      TYR  48  -6.793  -4.827  -3.628
  367    HE2  TYR  48           HE2      TYR  48  -9.393  -4.497  -6.999
  368    HH   TYR  48           HH       TYR  48  -6.480  -5.847  -5.746
  369    H    THR  49           HN       THR  49 -11.403   0.223  -2.055
  370    HA   THR  49           HA       THR  49 -14.079   0.279  -0.776
  371    HB   THR  49           HB       THR  49 -13.098   1.474   1.121
  372    HG1  THR  49           HG1      THR  49 -11.492   2.719   0.370
  373   HG21  THR  49          HG21      THR  49 -11.576  -0.214   2.038
  374   HG22  THR  49          HG22      THR  49 -11.284  -0.873   0.428
  375   HG23  THR  49          HG23      THR  49 -12.883  -1.006   1.161
  376    H    ASP  50           HN       ASP  50 -14.416   1.133  -3.081
  377    HA   ASP  50           HA       ASP  50 -13.408   3.755  -3.781
  378    HB2  ASP  50           HB2      ASP  50 -13.692   1.815  -5.367
  379    HB3  ASP  50           HB1      ASP  50 -15.434   2.008  -5.244
  380    H    GLY  51           HN       GLY  51 -14.899   4.047  -1.460
  381    HA2  GLY  51           HA2      GLY  51 -16.300   6.235  -1.426
  382    HA3  GLY  51           HA1      GLY  51 -17.508   5.212  -2.192
  383    H    ARG  52           HN       ARG  52 -16.326   2.932  -0.437
  384    HA   ARG  52           HA       ARG  52 -18.385   3.007   1.532
  385    HB2  ARG  52           HB2      ARG  52 -17.038   0.995   0.328
  386    HB3  ARG  52           HB1      ARG  52 -16.086   1.054   1.796
  387    HG2  ARG  52           HG2      ARG  52 -19.103   0.670   1.766
  388    HG3  ARG  52           HG1      ARG  52 -17.962  -0.665   1.699
  389    HD2  ARG  52           HD2      ARG  52 -18.661  -0.529   3.955
  390    HD3  ARG  52           HD1      ARG  52 -17.047   0.173   3.928
  391    HE   ARG  52           HE       ARG  52 -17.931   2.136   4.655
  392   HH11  ARG  52          HH11      ARG  52 -21.816   1.417   3.877
  393   HH12  ARG  52          HH12      ARG  52 -20.634   0.267   3.350
  394   HH21  ARG  52          HH21      ARG  52 -19.510   3.620   5.306
  395   HH22  ARG  52          HH22      ARG  52 -21.186   3.305   4.981
  396    H    VAL  53           HN       VAL  53 -14.813   3.107   1.809
  397    HA   VAL  53           HA       VAL  53 -14.973   4.823   4.172
  398    HB   VAL  53           HB       VAL  53 -14.895   2.610   5.196
  399   HG11  VAL  53          HG11      VAL  53 -13.086   0.991   4.845
  400   HG12  VAL  53          HG12      VAL  53 -12.387   2.022   3.593
  401   HG13  VAL  53          HG13      VAL  53 -13.977   1.294   3.353
  402   HG21  VAL  53          HG21      VAL  53 -13.631   4.368   6.350
  403   HG22  VAL  53          HG22      VAL  53 -12.173   3.956   5.446
  404   HG23  VAL  53          HG23      VAL  53 -12.859   2.800   6.592
  405    H    GLU  54           HN       GLU  54 -13.387   6.329   4.172
  406    HA   GLU  54           HA       GLU  54 -11.673   6.640   1.905
  407    HB2  GLU  54           HB2      GLU  54 -11.767   8.149   4.557
  408    HB3  GLU  54           HB1      GLU  54 -10.745   8.612   3.202
  409    HG2  GLU  54           HG2      GLU  54 -12.745   8.980   1.806
  410    HG3  GLU  54           HG1      GLU  54 -13.771   8.487   3.147
  411    H    CYS  55           HN       CYS  55 -10.283   4.960   1.715
  412    HA   CYS  55           HA       CYS  55  -8.685   3.838   3.780
  413    HB2  CYS  55           HB2      CYS  55  -9.140   2.532   1.787
  414    HB3  CYS  55           HB1      CYS  55  -8.429   3.758   0.749
  415    H    ARG  56           HN       ARG  56  -6.502   4.162   4.265
  416    HA   ARG  56           HA       ARG  56  -5.074   6.427   3.116
  417    HB2  ARG  56           HB2      ARG  56  -4.658   7.510   5.313
  418    HB3  ARG  56           HB1      ARG  56  -6.352   7.541   4.868
  419    HG2  ARG  56           HG2      ARG  56  -5.199   5.542   6.844
  420    HG3  ARG  56           HG1      ARG  56  -5.876   7.100   7.314
  421    HD2  ARG  56           HD2      ARG  56  -8.045   6.407   6.257
  422    HD3  ARG  56           HD1      ARG  56  -7.341   4.823   5.947
  423    HE   ARG  56           HE       ARG  56  -7.014   4.875   8.528
  424   HH11  ARG  56          HH11      ARG  56  -9.828   6.052   6.757
  425   HH12  ARG  56          HH12      ARG  56 -10.926   5.728   8.071
  426   HH21  ARG  56          HH21      ARG  56  -8.458   4.453  10.205
  427   HH22  ARG  56          HH22      ARG  56 -10.149   4.821  10.014
  428    H    GLU  57           HN       GLU  57  -2.893   6.261   3.301
  429    HA   GLU  57           HA       GLU  57  -1.820   3.815   4.566
  430    HB2  GLU  57           HB2      GLU  57   0.049   4.131   2.725
  431    HB3  GLU  57           HB1      GLU  57  -1.452   3.317   2.344
  432    HG2  GLU  57           HG2      GLU  57  -0.878   4.730   0.509
  433    HG3  GLU  57           HG1      GLU  57  -2.295   5.401   1.299
  434    H    LEU  58           HN       LEU  58   0.450   3.927   5.112
  435    HA   LEU  58           HA       LEU  58   1.089   6.082   6.823
  436    HB2  LEU  58           HB2      LEU  58   2.766   3.758   5.823
  437    HB3  LEU  58           HB1      LEU  58   3.262   4.845   7.116
  438    HG   LEU  58           HG       LEU  58   0.758   3.122   7.219
  439   HD11  LEU  58          HD11      LEU  58   1.927   1.664   8.785
  440   HD12  LEU  58          HD12      LEU  58   3.429   2.562   8.525
  441   HD13  LEU  58          HD13      LEU  58   2.694   1.658   7.196
  442   HD21  LEU  58          HD21      LEU  58   2.115   4.781   9.361
  443   HD22  LEU  58          HD22      LEU  58   0.771   3.672   9.639
  444   HD23  LEU  58          HD23      LEU  58   0.545   5.083   8.610
  445    H    ARG  59           HN       ARG  59   3.304   7.241   6.688
  446    HA   ARG  59           HA       ARG  59   3.124   8.969   4.483
  447    HB2  ARG  59           HB2      ARG  59   5.004  10.171   5.381
  448    HB3  ARG  59           HB1      ARG  59   3.965   9.658   6.721
  449    HG2  ARG  59           HG2      ARG  59   5.524   7.828   7.266
  450    HG3  ARG  59           HG1      ARG  59   6.548   8.287   5.904
  451    HD2  ARG  59           HD2      ARG  59   6.858  10.540   7.002
  452    HD3  ARG  59           HD1      ARG  59   6.011   9.907   8.417
  453    HE   ARG  59           HE       ARG  59   8.695   9.239   7.487
  454   HH11  ARG  59          HH11      ARG  59   7.229   7.619  10.860
  455   HH12  ARG  59          HH12      ARG  59   6.156   8.474   9.806
  456   HH21  ARG  59          HH21      ARG  59  10.054   8.037   8.834
  457   HH22  ARG  59          HH22      ARG  59   9.438   7.363  10.313
  458    HA   PRO  60           HA       PRO  60   5.943   7.130   1.478
  459    HB2  PRO  60           HB2      PRO  60   6.502   9.290  -0.062
  460    HB3  PRO  60           HB1      PRO  60   4.854   8.628   0.012
  461    HG2  PRO  60           HG2      PRO  60   5.987  11.018   1.409
  462    HG3  PRO  60           HG1      PRO  60   4.421  10.790   0.634
  463    HD2  PRO  60           HD2      PRO  60   4.826  10.591   3.379
  464    HD3  PRO  60           HD1      PRO  60   3.468   9.852   2.485
  465    H    ASP  61           HN       ASP  61   7.422   6.707   3.211
  466    HA   ASP  61           HA       ASP  61   9.310   8.665   4.172
  467    HB2  ASP  61           HB2      ASP  61   8.084   6.999   5.631
  468    HB3  ASP  61           HB1      ASP  61   9.074   5.724   4.930
  469    H    VAL  62           HN       VAL  62   9.705   7.935   1.400
  470    HA   VAL  62           HA       VAL  62  11.359   7.787  -0.098
  471    HB   VAL  62           HB       VAL  62  13.288   7.955   2.277
  472   HG11  VAL  62          HG11      VAL  62  14.929   8.810   0.620
  473   HG12  VAL  62          HG12      VAL  62  13.783   8.506  -0.688
  474   HG13  VAL  62          HG13      VAL  62  14.437   7.158   0.247
  475   HG21  VAL  62          HG21      VAL  62  12.136  10.185   0.540
  476   HG22  VAL  62          HG22      VAL  62  13.341  10.383   1.814
  477   HG23  VAL  62          HG23      VAL  62  11.710   9.855   2.222
  478    H    PHE  63           HN       PHE  63  10.603   5.770  -0.646
  479    HA   PHE  63           HA       PHE  63  12.535   3.644  -0.627
  480    HB2  PHE  63           HB2      PHE  63  11.143   1.901   0.352
  481    HB3  PHE  63           HB1      PHE  63  11.195   3.216   1.519
  482    HD1  PHE  63           HD1      PHE  63   9.044   1.094  -0.447
  483    HD2  PHE  63           HD2      PHE  63   9.197   4.860   1.575
  484    HE1  PHE  63           HE1      PHE  63   6.590   1.220  -0.489
  485    HE2  PHE  63           HE2      PHE  63   6.742   4.972   1.531
  486    HZ   PHE  63           HZ       PHE  63   5.441   3.156   0.497
  487    H    GLY  64           HN       GLY  64  11.782   1.903  -2.186
  488    HA2  GLY  64           HA2      GLY  64   9.587   1.565  -3.648
  489    HA3  GLY  64           HA1      GLY  64  10.179   3.052  -4.377
  490    H    ALA  65           HN       ALA  65  12.968   2.309  -4.001
  491    HA   ALA  65           HA       ALA  65  13.585  -0.066  -5.451
  492    HB1  ALA  65           HB1      ALA  65  14.402   0.991  -7.539
  493    HB2  ALA  65           HB2      ALA  65  13.768   2.553  -7.005
  494    HB3  ALA  65           HB3      ALA  65  12.668   1.214  -7.344
  Start of MODEL   13
    1    H1   MET   1           HT1      MET   1 -14.347  -1.872  12.438
    2    H2   MET   1           HT2      MET   1 -13.868  -0.269  12.177
    3    H3   MET   1           HT3      MET   1 -12.762  -1.530  11.962
    4    HA   MET   1           HA       MET   1 -13.988  -2.385  10.119
    5    HB2  MET   1           HB2      MET   1 -16.244  -1.722  10.862
    6    HB3  MET   1           HB1      MET   1 -15.849  -0.024  10.646
    7    HG2  MET   1           HG2      MET   1 -15.823  -0.248   8.269
    8    HG3  MET   1           HG1      MET   1 -15.854  -2.006   8.362
    9    HE1  MET   1           HE1      MET   1 -19.518  -2.752   9.489
   10    HE2  MET   1           HE2      MET   1 -18.104  -2.631  10.535
   11    HE3  MET   1           HE3      MET   1 -17.979  -3.441   8.973
   12    H    ASN   2           HN       ASN   2 -11.954  -1.932   9.305
   13    HA   ASN   2           HA       ASN   2 -11.362   0.797   8.325
   14    HB2  ASN   2           HB2      ASN   2  -8.991  -0.030   8.150
   15    HB3  ASN   2           HB1      ASN   2  -9.628  -0.021   9.788
   16   HD21  ASN   2          HD21      ASN   2  -8.431  -1.565  10.700
   17   HD22  ASN   2          HD22      ASN   2  -8.359  -3.214  10.194
   18    H    ALA   3           HN       ALA   3 -10.212   0.940   6.316
   19    HA   ALA   3           HA       ALA   3 -11.507   0.047   4.082
   20    HB1  ALA   3           HB1      ALA   3  -9.994   1.972   4.125
   21    HB2  ALA   3           HB2      ALA   3  -9.585   0.878   2.805
   22    HB3  ALA   3           HB3      ALA   3  -8.602   0.897   4.274
   23    H    ILE   4           HN       ILE   4  -8.705  -1.439   5.660
   24    HA   ILE   4           HA       ILE   4  -7.951  -3.233   3.619
   25    HB   ILE   4           HB       ILE   4  -7.560  -3.716   6.601
   26   HG12  ILE   4          HG12      ILE   4  -5.158  -2.756   6.071
   27   HG13  ILE   4          HG11      ILE   4  -5.941  -1.986   4.702
   28   HG21  ILE   4          HG21      ILE   4  -5.636  -5.109   5.941
   29   HG22  ILE   4          HG22      ILE   4  -6.003  -4.806   4.242
   30   HG23  ILE   4          HG23      ILE   4  -7.140  -5.712   5.240
   31   HD11  ILE   4          HD11      ILE   4  -5.699  -0.464   6.573
   32   HD12  ILE   4          HD12      ILE   4  -6.612  -1.554   7.614
   33   HD13  ILE   4          HD13      ILE   4  -7.410  -0.763   6.254
   34    H    ASP   5           HN       ASP   5 -10.260  -3.471   6.266
   35    HA   ASP   5           HA       ASP   5 -10.958  -6.226   5.985
   36    HB2  ASP   5           HB2      ASP   5 -11.263  -4.953   8.115
   37    HB3  ASP   5           HB1      ASP   5 -12.511  -3.971   7.355
   38    H    ILE   6           HN       ILE   6 -12.433  -3.168   4.906
   39    HA   ILE   6           HA       ILE   6 -14.803  -4.269   3.803
   40    HB   ILE   6           HB       ILE   6 -13.396  -1.628   3.203
   41   HG12  ILE   6          HG12      ILE   6 -14.103  -1.855   5.553
   42   HG13  ILE   6          HG11      ILE   6 -15.080  -0.640   4.741
   43   HG21  ILE   6          HG21      ILE   6 -16.228  -2.441   2.410
   44   HG22  ILE   6          HG22      ILE   6 -14.880  -2.146   1.309
   45   HG23  ILE   6          HG23      ILE   6 -15.548  -0.818   2.255
   46   HD11  ILE   6          HD11      ILE   6 -16.912  -2.281   4.541
   47   HD12  ILE   6          HD12      ILE   6 -16.444  -1.985   6.214
   48   HD13  ILE   6          HD13      ILE   6 -15.928  -3.465   5.405
   49    H    ALA   7           HN       ALA   7 -11.562  -3.817   2.518
   50    HA   ALA   7           HA       ALA   7 -12.139  -4.437  -0.212
   51    HB1  ALA   7           HB1      ALA   7  -9.730  -4.704  -0.474
   52    HB2  ALA   7           HB2      ALA   7  -9.515  -4.706   1.285
   53    HB3  ALA   7           HB3      ALA   7 -10.095  -3.254   0.467
   54    H    ILE   8           HN       ILE   8 -11.226  -6.397   2.618
   55    HA   ILE   8           HA       ILE   8 -10.966  -8.938   1.390
   56    HB   ILE   8           HB       ILE   8 -11.986  -8.289   4.201
   57   HG12  ILE   8          HG12      ILE   8  -9.151  -9.055   3.379
   58   HG13  ILE   8          HG11      ILE   8  -9.682  -7.395   3.593
   59   HG21  ILE   8          HG21      ILE   8 -11.309 -10.597   4.824
   60   HG22  ILE   8          HG22      ILE   8 -10.907 -10.934   3.140
   61   HG23  ILE   8          HG23      ILE   8 -12.578 -10.599   3.596
   62   HD11  ILE   8          HD11      ILE   8 -10.159  -7.858   5.945
   63   HD12  ILE   8          HD12      ILE   8  -8.477  -8.164   5.519
   64   HD13  ILE   8          HD13      ILE   8  -9.592  -9.515   5.724
   65    H    ASN   9           HN       ASN   9 -13.787  -7.221   2.739
   66    HA   ASN   9           HA       ASN   9 -15.710  -9.257   2.302
   67    HB2  ASN   9           HB2      ASN   9 -16.052  -6.240   2.589
   68    HB3  ASN   9           HB1      ASN   9 -17.416  -7.337   2.425
   69   HD21  ASN   9          HD21      ASN   9 -15.111  -6.013   4.570
   70   HD22  ASN   9          HD22      ASN   9 -15.610  -6.860   5.990
   71    H    LYS  10           HN       LYS  10 -14.631  -6.498   0.285
   72    HA   LYS  10           HA       LYS  10 -16.663  -6.824  -1.677
   73    HB2  LYS  10           HB2      LYS  10 -15.411  -4.655  -1.356
   74    HB3  LYS  10           HB1      LYS  10 -13.998  -5.381  -2.138
   75    HG2  LYS  10           HG2      LYS  10 -15.333  -5.769  -4.185
   76    HG3  LYS  10           HG1      LYS  10 -16.752  -5.068  -3.403
   77    HD2  LYS  10           HD2      LYS  10 -15.599  -2.898  -3.246
   78    HD3  LYS  10           HD1      LYS  10 -14.160  -3.602  -3.997
   79    HE2  LYS  10           HE2      LYS  10 -16.893  -3.296  -5.290
   80    HE3  LYS  10           HE1      LYS  10 -15.460  -2.323  -5.630
   81    HZ1  LYS  10           HZ1      LYS  10 -15.653  -5.252  -6.069
   82    HZ2  LYS  10           HZ2      LYS  10 -14.352  -4.257  -6.484
   83    HZ3  LYS  10           HZ3      LYS  10 -15.836  -4.078  -7.272
   84    H    LEU  11           HN       LEU  11 -13.277  -7.916  -1.516
   85    HA   LEU  11           HA       LEU  11 -13.423  -9.200  -4.115
   86    HB2  LEU  11           HB2      LEU  11 -11.218  -9.486  -2.038
   87    HB3  LEU  11           HB1      LEU  11 -11.142  -9.961  -3.724
   88    HG   LEU  11           HG       LEU  11 -10.981  -7.194  -2.530
   89   HD11  LEU  11          HD11      LEU  11  -9.038  -6.970  -4.043
   90   HD12  LEU  11          HD12      LEU  11  -9.314  -8.615  -4.622
   91   HD13  LEU  11          HD13      LEU  11  -8.887  -8.333  -2.937
   92   HD21  LEU  11          HD21      LEU  11 -11.738  -7.694  -5.425
   93   HD22  LEU  11          HD22      LEU  11 -11.273  -6.138  -4.726
   94   HD23  LEU  11          HD23      LEU  11 -12.747  -6.934  -4.188
   95    H    GLY  12           HN       GLY  12 -14.288 -10.047  -0.929
   96    HA2  GLY  12           HA2      GLY  12 -15.663 -11.894  -0.469
   97    HA3  GLY  12           HA1      GLY  12 -14.909 -12.794  -1.776
   98    H    SER  13           HN       SER  13 -12.147 -11.906  -0.731
   99    HA   SER  13           HA       SER  13 -11.844 -13.324   1.772
  100    HB2  SER  13           HB2      SER  13 -10.439 -15.188   0.785
  101    HB3  SER  13           HB1      SER  13 -12.130 -15.256   0.292
  102    HG   SER  13           HG       SER  13 -11.483 -14.132  -1.633
  103    H    VAL  14           HN       VAL  14  -9.559 -13.611   2.394
  104    HA   VAL  14           HA       VAL  14  -7.931 -11.296   1.769
  105    HB   VAL  14           HB       VAL  14  -7.600 -13.614   3.730
  106   HG11  VAL  14          HG11      VAL  14  -5.657 -11.305   3.342
  107   HG12  VAL  14          HG12      VAL  14  -5.335 -13.002   2.979
  108   HG13  VAL  14          HG13      VAL  14  -5.597 -12.493   4.647
  109   HG21  VAL  14          HG21      VAL  14  -7.860 -11.835   5.432
  110   HG22  VAL  14          HG22      VAL  14  -9.254 -11.916   4.353
  111   HG23  VAL  14          HG23      VAL  14  -8.049 -10.637   4.138
  112    H    SER  15           HN       SER  15  -7.976 -14.749   1.052
  113    HA   SER  15           HA       SER  15  -5.433 -15.038  -0.102
  114    HB2  SER  15           HB2      SER  15  -6.577 -16.949  -1.391
  115    HB3  SER  15           HB1      SER  15  -6.725 -17.005   0.367
  116    HG   SER  15           HG       SER  15  -8.716 -17.353  -0.877
  117    H    ALA  16           HN       ALA  16  -8.517 -13.908  -1.425
  118    HA   ALA  16           HA       ALA  16  -7.608 -13.360  -4.086
  119    HB1  ALA  16           HB1      ALA  16 -10.019 -12.248  -2.604
  120    HB2  ALA  16           HB2      ALA  16  -9.987 -13.723  -3.574
  121    HB3  ALA  16           HB3      ALA  16  -9.739 -12.158  -4.347
  122    H    LEU  17           HN       LEU  17  -7.932 -11.412  -1.120
  123    HA   LEU  17           HA       LEU  17  -7.456  -8.888  -2.308
  124    HB2  LEU  17           HB2      LEU  17  -8.584  -9.116  -0.125
  125    HB3  LEU  17           HB1      LEU  17  -7.098  -9.724   0.595
  126    HG   LEU  17           HG       LEU  17  -5.999  -7.570   0.273
  127   HD11  LEU  17          HD11      LEU  17  -7.192  -5.573  -0.550
  128   HD12  LEU  17          HD12      LEU  17  -8.586  -6.572  -0.969
  129   HD13  LEU  17          HD13      LEU  17  -7.046  -6.808  -1.798
  130   HD21  LEU  17          HD21      LEU  17  -8.675  -7.178   1.616
  131   HD22  LEU  17          HD22      LEU  17  -7.218  -6.208   1.864
  132   HD23  LEU  17          HD23      LEU  17  -7.236  -7.903   2.340
  133    H    ALA  18           HN       ALA  18  -5.334 -10.828  -0.248
  134    HA   ALA  18           HA       ALA  18  -2.973  -9.401  -0.493
  135    HB1  ALA  18           HB1      ALA  18  -3.414 -11.096   1.226
  136    HB2  ALA  18           HB2      ALA  18  -1.887 -11.401   0.399
  137    HB3  ALA  18           HB3      ALA  18  -3.315 -12.371   0.011
  138    H    ALA  19           HN       ALA  19  -4.278 -11.974  -2.579
  139    HA   ALA  19           HA       ALA  19  -2.043 -12.362  -4.266
  140    HB1  ALA  19           HB1      ALA  19  -3.665 -13.228  -5.909
  141    HB2  ALA  19           HB2      ALA  19  -4.992 -12.539  -4.965
  142    HB3  ALA  19           HB3      ALA  19  -4.009 -13.837  -4.289
  143    H    ALA  20           HN       ALA  20  -4.783 -10.102  -4.495
  144    HA   ALA  20           HA       ALA  20  -3.937  -8.766  -6.892
  145    HB1  ALA  20           HB1      ALA  20  -5.957  -7.898  -4.793
  146    HB2  ALA  20           HB2      ALA  20  -6.304  -8.872  -6.222
  147    HB3  ALA  20           HB3      ALA  20  -5.776  -7.200  -6.406
  148    H    LEU  21           HN       LEU  21  -3.138  -8.396  -3.531
  149    HA   LEU  21           HA       LEU  21  -1.947  -5.724  -3.883
  150    HB2  LEU  21           HB2      LEU  21  -2.284  -7.470  -1.412
  151    HB3  LEU  21           HB1      LEU  21  -1.535  -5.879  -1.404
  152    HG   LEU  21           HG       LEU  21  -4.440  -6.463  -2.104
  153   HD11  LEU  21          HD11      LEU  21  -3.232  -5.184   0.354
  154   HD12  LEU  21          HD12      LEU  21  -4.121  -6.707   0.247
  155   HD13  LEU  21          HD13      LEU  21  -4.960  -5.185  -0.040
  156   HD21  LEU  21          HD21      LEU  21  -3.000  -3.808  -1.950
  157   HD22  LEU  21          HD22      LEU  21  -4.742  -4.029  -2.167
  158   HD23  LEU  21          HD23      LEU  21  -3.623  -4.591  -3.405
  159    H    GLY  22           HN       GLY  22  -1.065  -8.955  -4.169
  160    HA2  GLY  22           HA2      GLY  22   0.914  -9.976  -4.729
  161    HA3  GLY  22           HA1      GLY  22   1.646  -8.382  -4.820
  162    H    VAL  23           HN       VAL  23   0.096  -9.435  -1.887
  163    HA   VAL  23           HA       VAL  23   2.700  -9.708  -0.500
  164    HB   VAL  23           HB       VAL  23   1.665  -8.694   1.501
  165   HG11  VAL  23          HG11      VAL  23   2.815  -7.201  -0.067
  166   HG12  VAL  23          HG12      VAL  23   1.468  -6.366   0.709
  167   HG13  VAL  23          HG13      VAL  23   1.312  -6.938  -0.953
  168   HG21  VAL  23          HG21      VAL  23  -0.688  -9.402   1.165
  169   HG22  VAL  23          HG22      VAL  23  -0.843  -8.289  -0.194
  170   HG23  VAL  23          HG23      VAL  23  -0.600  -7.661   1.438
  171    H    ASN  24           HN       ASN  24   2.254 -10.707   1.791
  172    HA   ASN  24           HA       ASN  24   1.058 -13.313   1.430
  173    HB2  ASN  24           HB2      ASN  24   3.136 -12.987   2.775
  174    HB3  ASN  24           HB1      ASN  24   2.227 -12.074   3.963
  175   HD21  ASN  24          HD21      ASN  24   2.687 -13.521   5.644
  176   HD22  ASN  24          HD22      ASN  24   2.064 -15.129   5.701
  177    H    GLN  25           HN       GLN  25  -0.482 -14.146   2.892
  178    HA   GLN  25           HA       GLN  25  -2.864 -12.507   3.007
  179    HB2  GLN  25           HB2      GLN  25  -2.402 -15.408   3.838
  180    HB3  GLN  25           HB1      GLN  25  -3.969 -14.613   3.861
  181    HG2  GLN  25           HG2      GLN  25  -3.881 -15.928   1.871
  182    HG3  GLN  25           HG1      GLN  25  -3.742 -14.238   1.381
  183   HE21  GLN  25          HE21      GLN  25  -1.785 -13.556   0.386
  184   HE22  GLN  25          HE22      GLN  25  -0.563 -14.665  -0.101
  185    H    SER  26           HN       SER  26  -0.547 -13.791   5.313
  186    HA   SER  26           HA       SER  26  -1.884 -12.940   7.697
  187    HB2  SER  26           HB2      SER  26   1.055 -13.606   7.235
  188    HB3  SER  26           HB1      SER  26   0.248 -13.505   8.801
  189    HG   SER  26           HG       SER  26  -1.193 -15.201   7.915
  190    H    ALA  27           HN       ALA  27   0.240 -11.367   5.373
  191    HA   ALA  27           HA       ALA  27   1.004  -9.095   6.888
  192    HB1  ALA  27           HB1      ALA  27   1.411  -7.982   4.733
  193    HB2  ALA  27           HB2      ALA  27   0.524  -9.258   3.890
  194    HB3  ALA  27           HB3      ALA  27   2.036  -9.631   4.717
  195    H    ILE  28           HN       ILE  28  -1.834  -9.825   4.919
  196    HA   ILE  28           HA       ILE  28  -3.209  -7.358   5.097
  197    HB   ILE  28           HB       ILE  28  -4.387 -10.166   4.823
  198   HG12  ILE  28          HG12      ILE  28  -2.698  -9.724   3.087
  199   HG13  ILE  28          HG11      ILE  28  -4.311  -9.779   2.386
  200   HG21  ILE  28          HG21      ILE  28  -6.301  -9.071   3.716
  201   HG22  ILE  28          HG22      ILE  28  -5.597  -7.488   4.044
  202   HG23  ILE  28          HG23      ILE  28  -6.125  -8.514   5.383
  203   HD11  ILE  28          HD11      ILE  28  -4.345  -7.326   2.330
  204   HD12  ILE  28          HD12      ILE  28  -3.017  -8.018   1.402
  205   HD13  ILE  28          HD13      ILE  28  -2.704  -7.306   2.984
  206    H    SER  29           HN       SER  29  -3.297 -10.290   7.085
  207    HA   SER  29           HA       SER  29  -5.282  -9.600   8.931
  208    HB2  SER  29           HB2      SER  29  -2.784 -11.265   9.438
  209    HB3  SER  29           HB1      SER  29  -4.303 -11.355  10.325
  210    HG   SER  29           HG       SER  29  -5.274 -11.949   8.260
  211    H    GLN  30           HN       GLN  30  -1.829  -8.874   8.848
  212    HA   GLN  30           HA       GLN  30  -1.604  -7.600  11.390
  213    HB2  GLN  30           HB2      GLN  30   0.330  -8.582  10.210
  214    HB3  GLN  30           HB1      GLN  30   0.159  -7.408   8.909
  215    HG2  GLN  30           HG2      GLN  30   0.620  -5.595  10.599
  216    HG3  GLN  30           HG1      GLN  30   0.965  -6.854  11.784
  217   HE21  GLN  30          HE21      GLN  30   2.056  -5.279   8.871
  218   HE22  GLN  30          HE22      GLN  30   3.654  -5.936   8.880
  219    H    TRP  31           HN       TRP  31  -2.117  -6.425   8.079
  220    HA   TRP  31           HA       TRP  31  -1.834  -3.647   8.593
  221    HB2  TRP  31           HB2      TRP  31  -3.204  -5.146   6.327
  222    HB3  TRP  31           HB1      TRP  31  -3.005  -3.395   6.350
  223    HD1  TRP  31           HD1      TRP  31   0.159  -4.363   7.715
  224    HE1  TRP  31           HE1      TRP  31   1.952  -4.618   5.888
  225    HE3  TRP  31           HE3      TRP  31  -2.883  -4.683   3.620
  226    HZ2  TRP  31           HZ2      TRP  31   2.057  -4.918   3.077
  227    HZ3  TRP  31           HZ3      TRP  31  -1.872  -4.943   1.411
  228    HH2  TRP  31           HH2      TRP  31   0.539  -5.057   1.139
  229    H    ARG  32           HN       ARG  32  -4.585  -5.817   8.539
  230    HA   ARG  32           HA       ARG  32  -6.613  -3.832   8.896
  231    HB2  ARG  32           HB2      ARG  32  -7.131  -5.987   7.854
  232    HB3  ARG  32           HB1      ARG  32  -6.636  -6.856   9.305
  233    HG2  ARG  32           HG2      ARG  32  -8.507  -5.954  10.554
  234    HG3  ARG  32           HG1      ARG  32  -8.958  -4.897   9.213
  235    HD2  ARG  32           HD2      ARG  32 -10.414  -6.880   9.379
  236    HD3  ARG  32           HD1      ARG  32  -9.543  -6.823   7.845
  237    HE   ARG  32           HE       ARG  32  -8.035  -8.396   9.578
  238   HH11  ARG  32          HH11      ARG  32 -11.253 -10.271   8.035
  239   HH12  ARG  32          HH12      ARG  32 -11.215  -8.531   8.064
  240   HH21  ARG  32          HH21      ARG  32  -9.467 -11.479   8.877
  241   HH22  ARG  32          HH22      ARG  32  -8.090 -10.660   9.536
  242    H    ALA  33           HN       ALA  33  -4.807  -6.041  11.015
  243    HA   ALA  33           HA       ALA  33  -6.129  -5.288  13.416
  244    HB1  ALA  33           HB1      ALA  33  -4.909  -7.414  13.216
  245    HB2  ALA  33           HB2      ALA  33  -4.286  -6.472  14.569
  246    HB3  ALA  33           HB3      ALA  33  -3.380  -6.550  13.051
  247    H    ARG  34           HN       ARG  34  -3.610  -3.833  11.546
  248    HA   ARG  34           HA       ARG  34  -2.671  -1.984  13.580
  249    HB2  ARG  34           HB2      ARG  34  -1.138  -2.744  11.833
  250    HB3  ARG  34           HB1      ARG  34  -2.247  -2.239  10.566
  251    HG2  ARG  34           HG2      ARG  34  -0.498  -0.643  10.625
  252    HG3  ARG  34           HG1      ARG  34  -1.907   0.134  11.325
  253    HD2  ARG  34           HD2      ARG  34  -0.998  -0.278  13.593
  254    HD3  ARG  34           HD1      ARG  34   0.443  -1.015  12.883
  255    HE   ARG  34           HE       ARG  34  -0.349   1.832  12.654
  256   HH11  ARG  34          HH11      ARG  34   2.177  -0.611  12.517
  257   HH12  ARG  34          HH12      ARG  34   3.449   0.557  12.351
  258   HH21  ARG  34          HH21      ARG  34   1.300   3.327  12.425
  259   HH22  ARG  34          HH22      ARG  34   2.946   2.796  12.296
  260    H    GLY  35           HN       GLY  35  -4.953  -2.070  10.900
  261    HA2  GLY  35           HA2      GLY  35  -6.907  -0.799  10.638
  262    HA3  GLY  35           HA1      GLY  35  -6.298   0.381  11.788
  263    H    ARG  36           HN       ARG  36  -3.766  -0.166   9.822
  264    HA   ARG  36           HA       ARG  36  -4.445   1.582   7.605
  265    HB2  ARG  36           HB2      ARG  36  -3.960   3.132   9.533
  266    HB3  ARG  36           HB1      ARG  36  -2.366   2.418   9.689
  267    HG2  ARG  36           HG2      ARG  36  -1.676   3.322   7.556
  268    HG3  ARG  36           HG1      ARG  36  -3.324   3.845   7.186
  269    HD2  ARG  36           HD2      ARG  36  -3.213   5.406   9.150
  270    HD3  ARG  36           HD1      ARG  36  -1.521   4.945   9.377
  271    HE   ARG  36           HE       ARG  36  -2.090   5.902   6.718
  272   HH11  ARG  36          HH11      ARG  36  -0.650   8.491   9.452
  273   HH12  ARG  36          HH12      ARG  36  -1.305   6.972   9.979
  274   HH21  ARG  36          HH21      ARG  36  -1.198   7.891   6.043
  275   HH22  ARG  36          HH22      ARG  36  -0.591   9.010   7.225
  276    H    VAL  37           HN       VAL  37  -3.110   1.129   5.879
  277    HA   VAL  37           HA       VAL  37  -1.156  -1.025   6.168
  278    HB   VAL  37           HB       VAL  37  -1.022  -1.002   3.685
  279   HG11  VAL  37          HG11      VAL  37  -3.307  -1.751   3.218
  280   HG12  VAL  37          HG12      VAL  37  -3.878  -0.981   4.699
  281   HG13  VAL  37          HG13      VAL  37  -2.755  -2.338   4.785
  282   HG21  VAL  37          HG21      VAL  37  -1.338   1.408   3.255
  283   HG22  VAL  37          HG22      VAL  37  -3.017   1.304   3.783
  284   HG23  VAL  37          HG23      VAL  37  -2.494   0.453   2.326
  285    HA   PRO  38           HA       PRO  38   2.562   1.651   5.678
  286    HB2  PRO  38           HB2      PRO  38   3.595  -0.593   3.938
  287    HB3  PRO  38           HB1      PRO  38   4.335   0.165   5.367
  288    HG2  PRO  38           HG2      PRO  38   3.286  -2.263   5.558
  289    HG3  PRO  38           HG1      PRO  38   3.061  -1.081   6.871
  290    HD2  PRO  38           HD2      PRO  38   1.117  -1.870   4.698
  291    HD3  PRO  38           HD1      PRO  38   0.834  -1.657   6.442
  292    H    ALA  39           HN       ALA  39   3.907   2.492   3.813
  293    HA   ALA  39           HA       ALA  39   2.225   3.876   2.075
  294    HB1  ALA  39           HB1      ALA  39   4.396   4.743   2.834
  295    HB2  ALA  39           HB2      ALA  39   4.276   4.784   1.074
  296    HB3  ALA  39           HB3      ALA  39   5.232   3.527   1.861
  297    H    GLY  40           HN       GLY  40   1.837   3.781  -0.124
  298    HA2  GLY  40           HA2      GLY  40   1.681   3.053  -2.273
  299    HA3  GLY  40           HA1      GLY  40   3.155   2.133  -2.032
  300    H    ARG  41           HN       ARG  41  -0.218   1.955  -0.755
  301    HA   ARG  41           HA       ARG  41  -0.735  -0.487  -2.185
  302    HB2  ARG  41           HB2      ARG  41   0.662  -1.183  -0.111
  303    HB3  ARG  41           HB1      ARG  41  -0.768  -0.800   0.833
  304    HG2  ARG  41           HG2      ARG  41  -0.884  -3.120   0.494
  305    HG3  ARG  41           HG1      ARG  41  -2.028  -2.463  -0.671
  306    HD2  ARG  41           HD2      ARG  41   0.824  -3.290  -1.332
  307    HD3  ARG  41           HD1      ARG  41  -0.592  -4.310  -1.572
  308    HE   ARG  41           HE       ARG  41  -1.156  -2.007  -2.994
  309   HH11  ARG  41          HH11      ARG  41   1.434  -4.415  -3.096
  310   HH12  ARG  41          HH12      ARG  41   1.746  -4.179  -4.781
  311   HH21  ARG  41          HH21      ARG  41   0.577  -2.650  -5.962
  312   HH22  ARG  41          HH22      ARG  41  -0.649  -1.683  -5.204
  313    H    CYS  42           HN       CYS  42  -1.784   1.959   0.084
  314    HA   CYS  42           HA       CYS  42  -4.479   1.188   0.444
  315    HB2  CYS  42           HB2      CYS  42  -3.619   2.919   1.836
  316    HB3  CYS  42           HB1      CYS  42  -3.181   3.915   0.453
  317    H    ILE  43           HN       ILE  43  -2.850   2.712  -2.239
  318    HA   ILE  43           HA       ILE  43  -4.882   3.821  -3.771
  319    HB   ILE  43           HB       ILE  43  -2.477   2.181  -4.727
  320   HG12  ILE  43          HG12      ILE  43  -2.772   5.203  -4.349
  321   HG13  ILE  43          HG11      ILE  43  -1.883   4.131  -3.273
  322   HG21  ILE  43          HG21      ILE  43  -4.182   4.152  -6.304
  323   HG22  ILE  43          HG22      ILE  43  -4.102   2.410  -6.559
  324   HG23  ILE  43          HG23      ILE  43  -2.689   3.411  -6.889
  325   HD11  ILE  43          HD11      ILE  43  -0.314   3.635  -5.089
  326   HD12  ILE  43          HD12      ILE  43  -0.387   5.354  -4.705
  327   HD13  ILE  43          HD13      ILE  43  -1.199   4.739  -6.144
  328    H    ASP  44           HN       ASP  44  -3.835   0.458  -3.532
  329    HA   ASP  44           HA       ASP  44  -5.674  -0.575  -5.486
  330    HB2  ASP  44           HB2      ASP  44  -4.105  -2.131  -3.397
  331    HB3  ASP  44           HB1      ASP  44  -4.771  -2.752  -4.907
  332    H    ILE  45           HN       ILE  45  -5.440  -0.758  -1.928
  333    HA   ILE  45           HA       ILE  45  -7.800  -2.219  -1.466
  334    HB   ILE  45           HB       ILE  45  -6.283  -0.304   0.367
  335   HG12  ILE  45          HG12      ILE  45  -6.318  -3.344   0.057
  336   HG13  ILE  45          HG11      ILE  45  -4.955  -2.261  -0.190
  337   HG21  ILE  45          HG21      ILE  45  -8.502  -2.216   1.185
  338   HG22  ILE  45          HG22      ILE  45  -8.639  -0.457   1.145
  339   HG23  ILE  45          HG23      ILE  45  -7.526  -1.226   2.274
  340   HD11  ILE  45          HD11      ILE  45  -4.673  -3.492   1.855
  341   HD12  ILE  45          HD12      ILE  45  -6.247  -2.964   2.458
  342   HD13  ILE  45          HD13      ILE  45  -4.940  -1.792   2.240
  343    H    GLU  46           HN       GLU  46  -7.293   1.194  -2.114
  344    HA   GLU  46           HA       GLU  46  -9.928   2.062  -1.304
  345    HB2  GLU  46           HB2      GLU  46  -7.952   3.583  -1.188
  346    HB3  GLU  46           HB1      GLU  46  -7.860   3.588  -2.948
  347    HG2  GLU  46           HG2      GLU  46  -9.993   4.706  -3.120
  348    HG3  GLU  46           HG1      GLU  46 -10.290   4.522  -1.391
  349    H    LEU  47           HN       LEU  47  -8.491   0.821  -4.276
  350    HA   LEU  47           HA       LEU  47 -10.581   1.402  -6.096
  351    HB2  LEU  47           HB2      LEU  47  -8.925  -1.137  -5.778
  352    HB3  LEU  47           HB1      LEU  47 -10.012  -0.873  -7.125
  353    HG   LEU  47           HG       LEU  47  -7.657   0.977  -6.578
  354   HD11  LEU  47          HD11      LEU  47  -7.672  -1.477  -8.383
  355   HD12  LEU  47          HD12      LEU  47  -6.766  -1.301  -6.879
  356   HD13  LEU  47          HD13      LEU  47  -6.373  -0.285  -8.262
  357   HD21  LEU  47          HD21      LEU  47  -9.301   0.440  -9.072
  358   HD22  LEU  47          HD22      LEU  47  -7.956   1.582  -8.945
  359   HD23  LEU  47          HD23      LEU  47  -9.436   1.861  -8.032
  360    H    TYR  48           HN       TYR  48 -10.204  -1.098  -3.607
  361    HA   TYR  48           HA       TYR  48 -12.842  -2.255  -4.169
  362    HB2  TYR  48           HB2      TYR  48 -11.171  -3.272  -1.878
  363    HB3  TYR  48           HB1      TYR  48 -12.193  -4.166  -3.013
  364    HD1  TYR  48           HD1      TYR  48  -9.013  -4.232  -2.007
  365    HD2  TYR  48           HD2      TYR  48 -11.070  -3.379  -5.655
  366    HE1  TYR  48           HE1      TYR  48  -6.988  -4.778  -3.282
  367    HE2  TYR  48           HE2      TYR  48  -9.038  -3.904  -6.925
  368    HH   TYR  48           HH       TYR  48  -6.292  -5.402  -5.470
  369    H    THR  49           HN       THR  49 -11.755   0.266  -2.278
  370    HA   THR  49           HA       THR  49 -14.178   0.146  -0.568
  371    HB   THR  49           HB       THR  49 -12.986   1.271   1.253
  372    HG1  THR  49           HG1      THR  49 -10.457   0.969   0.126
  373   HG21  THR  49          HG21      THR  49 -11.381  -1.126   0.301
  374   HG22  THR  49          HG22      THR  49 -12.880  -1.191   1.230
  375   HG23  THR  49          HG23      THR  49 -11.432  -0.495   1.949
  376    H    ASP  50           HN       ASP  50 -14.044   1.168  -3.114
  377    HA   ASP  50           HA       ASP  50 -13.092   3.502  -3.916
  378    HB2  ASP  50           HB2      ASP  50 -14.374   2.112  -5.407
  379    HB3  ASP  50           HB1      ASP  50 -15.854   2.364  -4.485
  380    H    GLY  51           HN       GLY  51 -16.462   3.598  -2.799
  381    HA2  GLY  51           HA2      GLY  51 -15.959   6.117  -1.305
  382    HA3  GLY  51           HA1      GLY  51 -17.397   5.870  -2.295
  383    H    ARG  52           HN       ARG  52 -15.894   3.329  -0.462
  384    HA   ARG  52           HA       ARG  52 -18.288   2.867   1.150
  385    HB2  ARG  52           HB2      ARG  52 -15.641   1.335   1.137
  386    HB3  ARG  52           HB1      ARG  52 -17.166   0.777   1.810
  387    HG2  ARG  52           HG2      ARG  52 -16.641   1.265  -1.136
  388    HG3  ARG  52           HG1      ARG  52 -16.564  -0.311  -0.351
  389    HD2  ARG  52           HD2      ARG  52 -18.960  -0.186   0.173
  390    HD3  ARG  52           HD1      ARG  52 -19.047   1.434  -0.525
  391    HE   ARG  52           HE       ARG  52 -18.333   0.336  -2.670
  392   HH11  ARG  52          HH11      ARG  52 -20.885  -2.519  -1.490
  393   HH12  ARG  52          HH12      ARG  52 -20.201  -1.457  -0.307
  394   HH21  ARG  52          HH21      ARG  52 -20.305  -2.291  -3.714
  395   HH22  ARG  52          HH22      ARG  52 -19.185  -1.052  -4.187
  396    H    VAL  53           HN       VAL  53 -14.820   3.407   1.586
  397    HA   VAL  53           HA       VAL  53 -15.139   4.884   4.057
  398    HB   VAL  53           HB       VAL  53 -15.092   2.618   4.982
  399   HG11  VAL  53          HG11      VAL  53 -14.159   1.421   3.059
  400   HG12  VAL  53          HG12      VAL  53 -13.313   0.988   4.545
  401   HG13  VAL  53          HG13      VAL  53 -12.562   2.097   3.395
  402   HG21  VAL  53          HG21      VAL  53 -13.809   4.287   6.256
  403   HG22  VAL  53          HG22      VAL  53 -12.351   3.888   5.349
  404   HG23  VAL  53          HG23      VAL  53 -13.077   2.689   6.423
  405    H    GLU  54           HN       GLU  54 -13.447   6.310   4.326
  406    HA   GLU  54           HA       GLU  54 -11.672   6.837   2.146
  407    HB2  GLU  54           HB2      GLU  54 -11.672   7.988   4.970
  408    HB3  GLU  54           HB1      GLU  54 -10.783   8.646   3.601
  409    HG2  GLU  54           HG2      GLU  54 -12.868   9.205   2.461
  410    HG3  GLU  54           HG1      GLU  54 -13.808   8.452   3.747
  411    H    CYS  55           HN       CYS  55 -10.041   5.485   1.747
  412    HA   CYS  55           HA       CYS  55  -8.769   3.856   3.771
  413    HB2  CYS  55           HB2      CYS  55  -9.145   2.828   1.640
  414    HB3  CYS  55           HB1      CYS  55  -8.389   4.163   0.773
  415    H    ARG  56           HN       ARG  56  -6.730   4.102   4.655
  416    HA   ARG  56           HA       ARG  56  -5.023   6.327   3.687
  417    HB2  ARG  56           HB2      ARG  56  -5.556   5.575   6.587
  418    HB3  ARG  56           HB1      ARG  56  -4.158   6.522   6.104
  419    HG2  ARG  56           HG2      ARG  56  -5.639   8.169   6.796
  420    HG3  ARG  56           HG1      ARG  56  -5.906   8.160   5.056
  421    HD2  ARG  56           HD2      ARG  56  -7.957   6.837   5.361
  422    HD3  ARG  56           HD1      ARG  56  -7.662   6.757   7.103
  423    HE   ARG  56           HE       ARG  56  -7.731   9.462   6.254
  424   HH11  ARG  56          HH11      ARG  56 -11.277   7.808   7.198
  425   HH12  ARG  56          HH12      ARG  56  -9.926   6.772   6.846
  426   HH21  ARG  56          HH21      ARG  56  -9.526  10.781   6.671
  427   HH22  ARG  56          HH22      ARG  56 -11.049  10.070   7.095
  428    H    GLU  57           HN       GLU  57  -3.071   5.689   3.061
  429    HA   GLU  57           HA       GLU  57  -1.738   3.377   4.347
  430    HB2  GLU  57           HB2      GLU  57   0.046   3.721   2.584
  431    HB3  GLU  57           HB1      GLU  57  -1.520   3.266   1.934
  432    HG2  GLU  57           HG2      GLU  57  -1.948   5.629   1.342
  433    HG3  GLU  57           HG1      GLU  57  -0.358   6.064   1.962
  434    H    LEU  58           HN       LEU  58   0.475   3.702   5.025
  435    HA   LEU  58           HA       LEU  58   0.980   6.168   6.419
  436    HB2  LEU  58           HB2      LEU  58   2.534   3.573   6.093
  437    HB3  LEU  58           HB1      LEU  58   3.184   4.935   6.995
  438    HG   LEU  58           HG       LEU  58   0.493   3.724   7.725
  439   HD11  LEU  58          HD11      LEU  58   1.545   2.305   9.398
  440   HD12  LEU  58          HD12      LEU  58   3.152   2.808   8.860
  441   HD13  LEU  58          HD13      LEU  58   2.110   1.878   7.783
  442   HD21  LEU  58          HD21      LEU  58   0.979   5.931   8.650
  443   HD22  LEU  58          HD22      LEU  58   2.500   5.344   9.326
  444   HD23  LEU  58          HD23      LEU  58   0.965   4.719   9.931
  445    H    ARG  59           HN       ARG  59   3.033   7.349   6.066
  446    HA   ARG  59           HA       ARG  59   3.419   7.829   3.210
  447    HB2  ARG  59           HB2      ARG  59   4.432   9.371   5.649
  448    HB3  ARG  59           HB1      ARG  59   4.628   9.867   3.954
  449    HG2  ARG  59           HG2      ARG  59   2.147   9.947   3.724
  450    HG3  ARG  59           HG1      ARG  59   1.982   9.519   5.424
  451    HD2  ARG  59           HD2      ARG  59   3.089  11.627   6.067
  452    HD3  ARG  59           HD1      ARG  59   3.286  12.046   4.358
  453    HE   ARG  59           HE       ARG  59   0.553  11.496   5.047
  454   HH11  ARG  59          HH11      ARG  59   1.804  15.322   5.133
  455   HH12  ARG  59          HH12      ARG  59   2.986  14.054   5.121
  456   HH21  ARG  59          HH21      ARG  59  -0.962  13.156   5.040
  457   HH22  ARG  59          HH22      ARG  59  -0.450  14.815   5.084
  458    HA   PRO  60           HA       PRO  60   7.246   5.669   2.823
  459    HB2  PRO  60           HB2      PRO  60   8.639   7.081   0.974
  460    HB3  PRO  60           HB1      PRO  60   7.070   6.347   0.578
  461    HG2  PRO  60           HG2      PRO  60   7.658   9.199   1.347
  462    HG3  PRO  60           HG1      PRO  60   6.686   8.584  -0.012
  463    HD2  PRO  60           HD2      PRO  60   5.538   9.406   2.334
  464    HD3  PRO  60           HD1      PRO  60   4.859   8.092   1.334
  465    H    ASP  61           HN       ASP  61   7.290   7.971   4.988
  466    HA   ASP  61           HA       ASP  61   8.686   8.957   6.458
  467    HB2  ASP  61           HB2      ASP  61  10.582   6.734   5.552
  468    HB3  ASP  61           HB1      ASP  61  10.853   7.751   6.959
  469    H    VAL  62           HN       VAL  62  11.422   9.510   6.482
  470    HA   VAL  62           HA       VAL  62  11.922  10.966   3.939
  471    HB   VAL  62           HB       VAL  62  13.048  11.668   6.698
  472   HG11  VAL  62          HG11      VAL  62  13.799  13.777   5.616
  473   HG12  VAL  62          HG12      VAL  62  13.230  13.177   4.057
  474   HG13  VAL  62          HG13      VAL  62  14.552  12.356   4.888
  475   HG21  VAL  62          HG21      VAL  62  10.793  13.032   5.170
  476   HG22  VAL  62          HG22      VAL  62  11.518  13.628   6.665
  477   HG23  VAL  62          HG23      VAL  62  10.634  12.103   6.664
  478    H    PHE  63           HN       PHE  63  12.719   8.939   3.105
  479    HA   PHE  63           HA       PHE  63  15.289   7.941   4.140
  480    HB2  PHE  63           HB2      PHE  63  13.487   6.922   1.894
  481    HB3  PHE  63           HB1      PHE  63  15.027   6.189   2.328
  482    HD1  PHE  63           HD1      PHE  63  11.696   5.555   2.583
  483    HD2  PHE  63           HD2      PHE  63  15.089   5.922   5.163
  484    HE1  PHE  63           HE1      PHE  63  10.601   4.105   4.244
  485    HE2  PHE  63           HE2      PHE  63  13.980   4.472   6.815
  486    HZ   PHE  63           HZ       PHE  63  11.738   3.561   6.358
  487    H    GLY  64           HN       GLY  64  16.936   7.411   2.424
  488    HA2  GLY  64           HA2      GLY  64  17.075   9.144   0.073
  489    HA3  GLY  64           HA1      GLY  64  18.283   9.428   1.333
  490    H    ALA  65           HN       ALA  65  20.158   8.384   0.967
  491    HA   ALA  65           HA       ALA  65  20.264   5.578   0.342
  492    HB1  ALA  65           HB1      ALA  65  21.287   7.513  -1.779
  493    HB2  ALA  65           HB2      ALA  65  19.879   6.462  -1.934
  494    HB3  ALA  65           HB3      ALA  65  21.492   5.759  -1.797
  Start of MODEL   14
    1    H1   MET   1           HT1      MET   1 -16.066   0.813  10.739
    2    H2   MET   1           HT2      MET   1 -15.797   1.274   9.134
    3    H3   MET   1           HT3      MET   1 -14.972   2.050  10.386
    4    HA   MET   1           HA       MET   1 -13.759   0.090  10.932
    5    HB2  MET   1           HB2      MET   1 -14.029  -1.995   9.729
    6    HB3  MET   1           HB1      MET   1 -15.621  -1.495  10.282
    7    HG2  MET   1           HG2      MET   1 -14.523  -1.281   7.477
    8    HG3  MET   1           HG1      MET   1 -15.778  -2.377   8.045
    9    HE1  MET   1           HE1      MET   1 -18.826   0.034   8.565
   10    HE2  MET   1           HE2      MET   1 -17.706  -0.522   9.809
   11    HE3  MET   1           HE3      MET   1 -18.277  -1.642   8.568
   12    H    ASN   2           HN       ASN   2 -11.798  -0.578   9.701
   13    HA   ASN   2           HA       ASN   2 -10.935   1.470   7.888
   14    HB2  ASN   2           HB2      ASN   2  -8.789   0.174   7.771
   15    HB3  ASN   2           HB1      ASN   2  -9.296   0.553   9.404
   16   HD21  ASN   2          HD21      ASN   2  -9.929  -1.141  10.766
   17   HD22  ASN   2          HD22      ASN   2  -9.568  -2.783  10.386
   18    H    ALA   3           HN       ALA   3 -10.162   1.201   5.796
   19    HA   ALA   3           HA       ALA   3 -11.875  -0.175   4.038
   20    HB1  ALA   3           HB1      ALA   3  -9.261   1.209   3.424
   21    HB2  ALA   3           HB2      ALA   3 -10.845   1.974   3.507
   22    HB3  ALA   3           HB3      ALA   3 -10.513   0.776   2.259
   23    H    ILE   4           HN       ILE   4  -8.816  -1.179   5.448
   24    HA   ILE   4           HA       ILE   4  -8.046  -3.099   3.492
   25    HB   ILE   4           HB       ILE   4  -7.495  -3.285   6.493
   26   HG12  ILE   4          HG12      ILE   4  -5.147  -2.392   5.799
   27   HG13  ILE   4          HG11      ILE   4  -5.925  -1.832   4.326
   28   HG21  ILE   4          HG21      ILE   4  -5.607  -4.747   5.884
   29   HG22  ILE   4          HG22      ILE   4  -6.053  -4.626   4.181
   30   HG23  ILE   4          HG23      ILE   4  -7.138  -5.419   5.323
   31   HD11  ILE   4          HD11      ILE   4  -7.372  -0.368   5.668
   32   HD12  ILE   4          HD12      ILE   4  -5.662  -0.055   5.969
   33   HD13  ILE   4          HD13      ILE   4  -6.608  -0.971   7.142
   34    H    ASP   5           HN       ASP   5 -10.063  -3.182   6.350
   35    HA   ASP   5           HA       ASP   5 -10.967  -5.829   6.427
   36    HB2  ASP   5           HB2      ASP   5 -11.262  -4.310   8.292
   37    HB3  ASP   5           HB1      ASP   5 -12.180  -3.176   7.319
   38    H    ILE   6           HN       ILE   6 -12.427  -2.970   4.812
   39    HA   ILE   6           HA       ILE   6 -14.649  -4.441   3.711
   40    HB   ILE   6           HB       ILE   6 -13.641  -1.609   3.134
   41   HG12  ILE   6          HG12      ILE   6 -14.455  -1.961   5.439
   42   HG13  ILE   6          HG11      ILE   6 -15.529  -0.889   4.550
   43   HG21  ILE   6          HG21      ILE   6 -15.846  -1.165   2.076
   44   HG22  ILE   6          HG22      ILE   6 -16.279  -2.869   2.226
   45   HG23  ILE   6          HG23      ILE   6 -14.942  -2.384   1.181
   46   HD11  ILE   6          HD11      ILE   6 -17.099  -2.774   4.225
   47   HD12  ILE   6          HD12      ILE   6 -16.802  -2.415   5.923
   48   HD13  ILE   6          HD13      ILE   6 -16.025  -3.808   5.174
   49    H    ALA   7           HN       ALA   7 -11.403  -3.800   2.625
   50    HA   ALA   7           HA       ALA   7 -11.797  -4.348  -0.162
   51    HB1  ALA   7           HB1      ALA   7  -9.265  -4.571   1.507
   52    HB2  ALA   7           HB2      ALA   7  -9.824  -3.132   0.651
   53    HB3  ALA   7           HB3      ALA   7  -9.351  -4.567  -0.257
   54    H    ILE   8           HN       ILE   8 -11.059  -6.303   2.695
   55    HA   ILE   8           HA       ILE   8 -10.821  -8.865   1.488
   56    HB   ILE   8           HB       ILE   8 -12.001  -8.180   4.234
   57   HG12  ILE   8          HG12      ILE   8  -9.107  -8.910   3.589
   58   HG13  ILE   8          HG11      ILE   8  -9.669  -7.269   3.860
   59   HG21  ILE   8          HG21      ILE   8 -12.528 -10.478   3.561
   60   HG22  ILE   8          HG22      ILE   8 -11.354 -10.482   4.874
   61   HG23  ILE   8          HG23      ILE   8 -10.823 -10.797   3.222
   62   HD11  ILE   8          HD11      ILE   8  -8.580  -8.155   5.816
   63   HD12  ILE   8          HD12      ILE   8  -9.709  -9.506   5.875
   64   HD13  ILE   8          HD13      ILE   8 -10.286  -7.859   6.152
   65    H    ASN   9           HN       ASN   9 -13.572  -6.983   2.656
   66    HA   ASN   9           HA       ASN   9 -15.621  -8.896   2.266
   67    HB2  ASN   9           HB2      ASN   9 -15.963  -7.027   3.769
   68    HB3  ASN   9           HB1      ASN   9 -15.681  -5.858   2.488
   69   HD21  ASN   9          HD21      ASN   9 -17.959  -8.235   3.737
   70   HD22  ASN   9          HD22      ASN   9 -19.345  -7.608   2.918
   71    H    LYS  10           HN       LYS  10 -14.163  -6.473   0.118
   72    HA   LYS  10           HA       LYS  10 -16.183  -6.636  -1.930
   73    HB2  LYS  10           HB2      LYS  10 -14.553  -4.657  -1.449
   74    HB3  LYS  10           HB1      LYS  10 -13.352  -5.551  -2.367
   75    HG2  LYS  10           HG2      LYS  10 -15.899  -5.320  -3.850
   76    HG3  LYS  10           HG1      LYS  10 -15.286  -3.746  -3.368
   77    HD2  LYS  10           HD2      LYS  10 -14.402  -4.103  -5.521
   78    HD3  LYS  10           HD1      LYS  10 -13.057  -4.428  -4.433
   79    HE2  LYS  10           HE2      LYS  10 -13.380  -6.831  -4.712
   80    HE3  LYS  10           HE1      LYS  10 -14.811  -6.550  -5.707
   81    HZ1  LYS  10           HZ1      LYS  10 -12.038  -5.713  -6.396
   82    HZ2  LYS  10           HZ2      LYS  10 -13.411  -5.454  -7.346
   83    HZ3  LYS  10           HZ3      LYS  10 -12.870  -7.026  -7.057
   84    H    LEU  11           HN       LEU  11 -12.792  -7.775  -1.685
   85    HA   LEU  11           HA       LEU  11 -12.779  -9.416  -3.985
   86    HB2  LEU  11           HB2      LEU  11 -11.114  -9.223  -1.469
   87    HB3  LEU  11           HB1      LEU  11 -10.846 -10.565  -2.562
   88    HG   LEU  11           HG       LEU  11  -9.270  -8.628  -2.832
   89   HD11  LEU  11          HD11      LEU  11  -9.221  -8.677  -5.286
   90   HD12  LEU  11          HD12      LEU  11 -10.860  -9.335  -5.311
   91   HD13  LEU  11          HD13      LEU  11  -9.540 -10.279  -4.620
   92   HD21  LEU  11          HD21      LEU  11  -9.966  -6.621  -4.074
   93   HD22  LEU  11          HD22      LEU  11 -10.773  -6.741  -2.512
   94   HD23  LEU  11          HD23      LEU  11 -11.648  -7.153  -3.987
   95    H    GLY  12           HN       GLY  12 -14.028  -9.908  -0.775
   96    HA2  GLY  12           HA2      GLY  12 -15.489 -11.537  -0.018
   97    HA3  GLY  12           HA1      GLY  12 -15.162 -12.508  -1.445
   98    H    SER  13           HN       SER  13 -12.151 -11.785  -0.492
   99    HA   SER  13           HA       SER  13 -11.766 -13.522   1.760
  100    HB2  SER  13           HB2      SER  13 -10.403 -15.238   0.542
  101    HB3  SER  13           HB1      SER  13 -12.093 -15.247   0.045
  102    HG   SER  13           HG       SER  13 -11.551 -14.570  -1.885
  103    H    VAL  14           HN       VAL  14  -9.582 -13.656   2.441
  104    HA   VAL  14           HA       VAL  14  -7.952 -11.322   1.862
  105    HB   VAL  14           HB       VAL  14  -7.773 -13.608   3.873
  106   HG11  VAL  14          HG11      VAL  14  -5.642 -11.474   3.494
  107   HG12  VAL  14          HG12      VAL  14  -5.442 -13.203   3.222
  108   HG13  VAL  14          HG13      VAL  14  -5.737 -12.599   4.851
  109   HG21  VAL  14          HG21      VAL  14  -8.023 -10.593   4.148
  110   HG22  VAL  14          HG22      VAL  14  -7.928 -11.735   5.504
  111   HG23  VAL  14          HG23      VAL  14  -9.303 -11.791   4.402
  112    H    SER  15           HN       SER  15  -7.997 -14.717   1.045
  113    HA   SER  15           HA       SER  15  -5.353 -15.041   0.134
  114    HB2  SER  15           HB2      SER  15  -6.402 -16.980  -1.192
  115    HB3  SER  15           HB1      SER  15  -6.659 -16.999   0.557
  116    HG   SER  15           HG       SER  15  -8.481 -16.435  -1.515
  117    H    ALA  16           HN       ALA  16  -8.330 -13.996  -1.516
  118    HA   ALA  16           HA       ALA  16  -7.115 -13.568  -4.097
  119    HB1  ALA  16           HB1      ALA  16  -9.529 -14.041  -3.860
  120    HB2  ALA  16           HB2      ALA  16  -9.255 -12.517  -4.701
  121    HB3  ALA  16           HB3      ALA  16  -9.754 -12.512  -3.006
  122    H    LEU  17           HN       LEU  17  -7.850 -11.545  -1.277
  123    HA   LEU  17           HA       LEU  17  -7.366  -9.019  -2.457
  124    HB2  LEU  17           HB2      LEU  17  -8.629  -9.306  -0.340
  125    HB3  LEU  17           HB1      LEU  17  -7.157  -9.827   0.471
  126    HG   LEU  17           HG       LEU  17  -6.156  -7.610   0.140
  127   HD11  LEU  17          HD11      LEU  17  -7.469  -5.708  -0.702
  128   HD12  LEU  17          HD12      LEU  17  -8.792  -6.797  -1.125
  129   HD13  LEU  17          HD13      LEU  17  -7.234  -6.933  -1.946
  130   HD21  LEU  17          HD21      LEU  17  -8.873  -7.396   1.432
  131   HD22  LEU  17          HD22      LEU  17  -7.476  -6.348   1.714
  132   HD23  LEU  17          HD23      LEU  17  -7.410  -8.047   2.178
  133    H    ALA  18           HN       ALA  18  -5.316 -11.063  -0.435
  134    HA   ALA  18           HA       ALA  18  -2.987  -9.512  -0.386
  135    HB1  ALA  18           HB1      ALA  18  -3.479 -11.362   1.164
  136    HB2  ALA  18           HB2      ALA  18  -1.895 -11.554   0.411
  137    HB3  ALA  18           HB3      ALA  18  -3.260 -12.528  -0.144
  138    H    ALA  19           HN       ALA  19  -4.068 -12.030  -2.633
  139    HA   ALA  19           HA       ALA  19  -1.781 -12.169  -4.290
  140    HB1  ALA  19           HB1      ALA  19  -3.287 -13.226  -5.923
  141    HB2  ALA  19           HB2      ALA  19  -4.692 -12.675  -5.003
  142    HB3  ALA  19           HB3      ALA  19  -3.581 -13.849  -4.298
  143    H    ALA  20           HN       ALA  20  -4.578 -10.009  -4.277
  144    HA   ALA  20           HA       ALA  20  -3.955  -8.640  -6.750
  145    HB1  ALA  20           HB1      ALA  20  -5.902  -7.917  -4.532
  146    HB2  ALA  20           HB2      ALA  20  -6.270  -8.880  -5.963
  147    HB3  ALA  20           HB3      ALA  20  -5.842  -7.178  -6.135
  148    H    LEU  21           HN       LEU  21  -2.990  -8.326  -3.450
  149    HA   LEU  21           HA       LEU  21  -1.940  -5.580  -3.799
  150    HB2  LEU  21           HB2      LEU  21  -2.387  -7.272  -1.306
  151    HB3  LEU  21           HB1      LEU  21  -1.682  -5.660  -1.296
  152    HG   LEU  21           HG       LEU  21  -4.505  -6.304  -2.237
  153   HD11  LEU  21          HD11      LEU  21  -3.566  -5.095   0.373
  154   HD12  LEU  21          HD12      LEU  21  -4.372  -6.651   0.132
  155   HD13  LEU  21          HD13      LEU  21  -5.246  -5.156  -0.178
  156   HD21  LEU  21          HD21      LEU  21  -3.589  -4.354  -3.376
  157   HD22  LEU  21          HD22      LEU  21  -3.155  -3.624  -1.829
  158   HD23  LEU  21          HD23      LEU  21  -4.855  -3.875  -2.245
  159    H    GLY  22           HN       GLY  22  -0.923  -8.711  -4.123
  160    HA2  GLY  22           HA2      GLY  22   1.134  -9.581  -4.671
  161    HA3  GLY  22           HA1      GLY  22   1.813  -7.971  -4.509
  162    H    VAL  23           HN       VAL  23   0.122  -9.193  -1.774
  163    HA   VAL  23           HA       VAL  23   2.648  -9.745  -0.318
  164    HB   VAL  23           HB       VAL  23   1.548  -8.873   1.730
  165   HG11  VAL  23          HG11      VAL  23   2.908  -7.316   0.418
  166   HG12  VAL  23          HG12      VAL  23   1.548  -6.465   1.157
  167   HG13  VAL  23          HG13      VAL  23   1.505  -6.871  -0.561
  168   HG21  VAL  23          HG21      VAL  23  -0.795  -8.132  -0.080
  169   HG22  VAL  23          HG22      VAL  23  -0.624  -7.666   1.615
  170   HG23  VAL  23          HG23      VAL  23  -0.809  -9.363   1.187
  171    H    ASN  24           HN       ASN  24   2.172 -11.055   1.752
  172    HA   ASN  24           HA       ASN  24   0.657 -13.430   1.157
  173    HB2  ASN  24           HB2      ASN  24   1.573 -14.329   3.237
  174    HB3  ASN  24           HB1      ASN  24   2.860 -13.564   2.325
  175   HD21  ASN  24          HD21      ASN  24   2.594 -14.154   5.226
  176   HD22  ASN  24          HD22      ASN  24   2.878 -12.641   6.013
  177    H    GLN  25           HN       GLN  25  -0.678 -14.332   2.996
  178    HA   GLN  25           HA       GLN  25  -2.991 -12.650   3.191
  179    HB2  GLN  25           HB2      GLN  25  -2.442 -15.499   4.132
  180    HB3  GLN  25           HB1      GLN  25  -3.997 -14.704   4.353
  181    HG2  GLN  25           HG2      GLN  25  -4.132 -16.104   2.398
  182    HG3  GLN  25           HG1      GLN  25  -4.186 -14.420   1.886
  183   HE21  GLN  25          HE21      GLN  25  -3.435 -14.760  -0.196
  184   HE22  GLN  25          HE22      GLN  25  -1.826 -15.281  -0.543
  185    H    SER  26           HN       SER  26  -0.450 -13.597   5.367
  186    HA   SER  26           HA       SER  26  -1.677 -12.882   7.841
  187    HB2  SER  26           HB2      SER  26   0.269 -14.430   7.679
  188    HB3  SER  26           HB1      SER  26   1.286 -13.097   7.140
  189    HG   SER  26           HG       SER  26   1.332 -12.307   9.130
  190    H    ALA  27           HN       ALA  27   0.170 -11.098   5.391
  191    HA   ALA  27           HA       ALA  27   0.699  -8.725   6.833
  192    HB1  ALA  27           HB1      ALA  27   1.770  -9.178   4.673
  193    HB2  ALA  27           HB2      ALA  27   0.948  -7.620   4.640
  194    HB3  ALA  27           HB3      ALA  27   0.218  -9.019   3.843
  195    H    ILE  28           HN       ILE  28  -2.117  -9.787   4.983
  196    HA   ILE  28           HA       ILE  28  -3.512  -7.311   4.923
  197    HB   ILE  28           HB       ILE  28  -4.664 -10.140   4.757
  198   HG12  ILE  28          HG12      ILE  28  -2.882  -9.790   3.069
  199   HG13  ILE  28          HG11      ILE  28  -4.465  -9.929   2.313
  200   HG21  ILE  28          HG21      ILE  28  -5.796  -7.497   3.777
  201   HG22  ILE  28          HG22      ILE  28  -6.403  -8.455   5.134
  202   HG23  ILE  28          HG23      ILE  28  -6.502  -9.091   3.493
  203   HD11  ILE  28          HD11      ILE  28  -4.542  -7.486   2.066
  204   HD12  ILE  28          HD12      ILE  28  -3.165  -8.216   1.246
  205   HD13  ILE  28          HD13      ILE  28  -2.930  -7.378   2.780
  206    H    SER  29           HN       SER  29  -3.912 -10.211   6.979
  207    HA   SER  29           HA       SER  29  -5.964  -9.207   8.639
  208    HB2  SER  29           HB2      SER  29  -5.267 -11.120  10.153
  209    HB3  SER  29           HB1      SER  29  -5.555 -11.587   8.477
  210    HG   SER  29           HG       SER  29  -2.945 -10.867   9.178
  211    H    GLN  30           HN       GLN  30  -2.474  -8.855   8.745
  212    HA   GLN  30           HA       GLN  30  -2.215  -7.690  11.352
  213    HB2  GLN  30           HB2      GLN  30  -0.398  -8.719   9.768
  214    HB3  GLN  30           HB1      GLN  30  -0.371  -7.154   8.980
  215    HG2  GLN  30           HG2      GLN  30   0.273  -7.634  11.910
  216    HG3  GLN  30           HG1      GLN  30   1.471  -7.523  10.627
  217   HE21  GLN  30          HE21      GLN  30  -0.690  -5.749  12.673
  218   HE22  GLN  30          HE22      GLN  30  -0.107  -4.177  12.279
  219    H    TRP  31           HN       TRP  31  -2.443  -6.362   8.041
  220    HA   TRP  31           HA       TRP  31  -2.332  -3.606   8.669
  221    HB2  TRP  31           HB2      TRP  31  -3.526  -5.030   6.259
  222    HB3  TRP  31           HB1      TRP  31  -3.318  -3.287   6.365
  223    HD1  TRP  31           HD1      TRP  31  -0.153  -4.100   7.737
  224    HE1  TRP  31           HE1      TRP  31   1.654  -4.393   5.904
  225    HE3  TRP  31           HE3      TRP  31  -3.173  -4.783   3.649
  226    HZ2  TRP  31           HZ2      TRP  31   1.762  -4.852   3.131
  227    HZ3  TRP  31           HZ3      TRP  31  -2.150  -5.125   1.458
  228    HH2  TRP  31           HH2      TRP  31   0.269  -5.159   1.202
  229    H    ARG  32           HN       ARG  32  -4.923  -5.892   8.707
  230    HA   ARG  32           HA       ARG  32  -7.152  -4.104   8.490
  231    HB2  ARG  32           HB2      ARG  32  -7.152  -6.584   7.938
  232    HB3  ARG  32           HB1      ARG  32  -7.014  -6.931   9.654
  233    HG2  ARG  32           HG2      ARG  32  -9.225  -5.727   9.964
  234    HG3  ARG  32           HG1      ARG  32  -9.347  -5.660   8.202
  235    HD2  ARG  32           HD2      ARG  32  -9.023  -8.226   8.260
  236    HD3  ARG  32           HD1      ARG  32  -9.338  -8.103   9.994
  237    HE   ARG  32           HE       ARG  32 -11.380  -6.778   8.623
  238   HH11  ARG  32          HH11      ARG  32 -11.806 -10.790   8.743
  239   HH12  ARG  32          HH12      ARG  32 -10.240 -10.088   9.008
  240   HH21  ARG  32          HH21      ARG  32 -13.630  -9.418   8.310
  241   HH22  ARG  32          HH22      ARG  32 -13.432  -7.693   8.251
  242    H    ALA  33           HN       ALA  33  -5.625  -5.932  11.135
  243    HA   ALA  33           HA       ALA  33  -7.048  -4.733  13.276
  244    HB1  ALA  33           HB1      ALA  33  -5.931  -6.912  13.495
  245    HB2  ALA  33           HB2      ALA  33  -5.332  -5.790  14.716
  246    HB3  ALA  33           HB3      ALA  33  -4.353  -6.145  13.287
  247    H    ARG  34           HN       ARG  34  -4.240  -3.822  11.461
  248    HA   ARG  34           HA       ARG  34  -3.171  -1.854  13.274
  249    HB2  ARG  34           HB2      ARG  34  -1.802  -3.218  11.790
  250    HB3  ARG  34           HB1      ARG  34  -2.572  -2.506  10.380
  251    HG2  ARG  34           HG2      ARG  34  -1.421  -0.514  10.574
  252    HG3  ARG  34           HG1      ARG  34  -1.189  -0.670  12.315
  253    HD2  ARG  34           HD2      ARG  34   0.535  -2.289  12.037
  254    HD3  ARG  34           HD1      ARG  34   0.117  -2.545  10.354
  255    HE   ARG  34           HE       ARG  34   1.062   0.130  10.949
  256   HH11  ARG  34          HH11      ARG  34   3.551  -2.623   9.369
  257   HH12  ARG  34          HH12      ARG  34   2.037  -3.138  10.039
  258   HH21  ARG  34          HH21      ARG  34   4.152  -0.435   9.414
  259   HH22  ARG  34          HH22      ARG  34   3.108   0.753  10.122
  260    H    GLY  35           HN       GLY  35  -5.385  -1.914  10.563
  261    HA2  GLY  35           HA2      GLY  35  -6.705  -0.340   9.528
  262    HA3  GLY  35           HA1      GLY  35  -6.389   0.729  10.886
  263    H    ARG  36           HN       ARG  36  -3.672  -0.519   9.206
  264    HA   ARG  36           HA       ARG  36  -3.189   1.795   7.527
  265    HB2  ARG  36           HB2      ARG  36  -1.843   1.425  10.198
  266    HB3  ARG  36           HB1      ARG  36  -0.819   1.957   8.873
  267    HG2  ARG  36           HG2      ARG  36  -1.609   4.073   8.948
  268    HG3  ARG  36           HG1      ARG  36  -3.296   3.562   9.043
  269    HD2  ARG  36           HD2      ARG  36  -1.369   3.622  11.399
  270    HD3  ARG  36           HD1      ARG  36  -2.544   4.884  11.018
  271    HE   ARG  36           HE       ARG  36  -3.104   2.195  12.024
  272   HH11  ARG  36          HH11      ARG  36  -4.421   5.296  11.000
  273   HH12  ARG  36          HH12      ARG  36  -5.975   4.995  11.706
  274   HH21  ARG  36          HH21      ARG  36  -5.177   1.803  12.889
  275   HH22  ARG  36          HH22      ARG  36  -6.401   3.029  12.767
  276    H    VAL  37           HN       VAL  37  -1.758   1.367   5.943
  277    HA   VAL  37           HA       VAL  37  -0.351  -1.254   5.902
  278    HB   VAL  37           HB       VAL  37  -0.766  -1.434   3.527
  279   HG11  VAL  37          HG11      VAL  37  -2.646  -2.164   4.929
  280   HG12  VAL  37          HG12      VAL  37  -3.217  -1.544   3.384
  281   HG13  VAL  37          HG13      VAL  37  -3.362  -0.553   4.837
  282   HG21  VAL  37          HG21      VAL  37  -2.021   1.334   3.621
  283   HG22  VAL  37          HG22      VAL  37  -2.007   0.269   2.212
  284   HG23  VAL  37          HG23      VAL  37  -0.494   0.899   2.854
  285    HA   PRO  38           HA       PRO  38   3.538   0.993   4.744
  286    HB2  PRO  38           HB2      PRO  38   3.539  -1.138   2.563
  287    HB3  PRO  38           HB1      PRO  38   4.878  -0.582   3.596
  288    HG2  PRO  38           HG2      PRO  38   3.699  -2.853   4.159
  289    HG3  PRO  38           HG1      PRO  38   4.068  -1.716   5.480
  290    HD2  PRO  38           HD2      PRO  38   1.427  -2.262   4.141
  291    HD3  PRO  38           HD1      PRO  38   1.786  -1.985   5.860
  292    H    ALA  39           HN       ALA  39   4.310   2.341   3.061
  293    HA   ALA  39           HA       ALA  39   2.473   3.989   1.849
  294    HB1  ALA  39           HB1      ALA  39   4.791   4.638   2.334
  295    HB2  ALA  39           HB2      ALA  39   4.383   4.996   0.655
  296    HB3  ALA  39           HB3      ALA  39   5.375   3.586   1.039
  297    H    GLY  40           HN       GLY  40   1.338   3.964  -0.040
  298    HA2  GLY  40           HA2      GLY  40   0.716   3.617  -2.222
  299    HA3  GLY  40           HA1      GLY  40   2.298   2.912  -2.528
  300    H    ARG  41           HN       ARG  41  -0.567   2.067  -0.551
  301    HA   ARG  41           HA       ARG  41  -0.970  -0.374  -2.099
  302    HB2  ARG  41           HB2      ARG  41   0.623  -0.953  -0.198
  303    HB3  ARG  41           HB1      ARG  41  -0.654  -0.536   0.926
  304    HG2  ARG  41           HG2      ARG  41  -0.807  -2.855   0.783
  305    HG3  ARG  41           HG1      ARG  41  -2.074  -2.320  -0.319
  306    HD2  ARG  41           HD2      ARG  41   0.711  -3.246  -1.098
  307    HD3  ARG  41           HD1      ARG  41  -0.779  -4.174  -1.262
  308    HE   ARG  41           HE       ARG  41  -1.344  -1.993  -2.759
  309   HH11  ARG  41          HH11      ARG  41   1.823  -3.895  -4.413
  310   HH12  ARG  41          HH12      ARG  41   1.469  -4.153  -2.734
  311   HH21  ARG  41          HH21      ARG  41  -0.798  -1.656  -4.957
  312   HH22  ARG  41          HH22      ARG  41   0.550  -2.496  -5.659
  313    H    CYS  42           HN       CYS  42  -2.035   1.791   0.481
  314    HA   CYS  42           HA       CYS  42  -4.744   0.939   0.569
  315    HB2  CYS  42           HB2      CYS  42  -3.264   3.354   1.518
  316    HB3  CYS  42           HB1      CYS  42  -5.010   3.485   1.387
  317    H    ILE  43           HN       ILE  43  -3.002   2.802  -1.767
  318    HA   ILE  43           HA       ILE  43  -5.049   4.101  -3.164
  319    HB   ILE  43           HB       ILE  43  -2.646   2.581  -4.293
  320   HG12  ILE  43          HG12      ILE  43  -2.000   4.352  -2.665
  321   HG13  ILE  43          HG11      ILE  43  -1.437   4.706  -4.289
  322   HG21  ILE  43          HG21      ILE  43  -4.362   4.697  -5.643
  323   HG22  ILE  43          HG22      ILE  43  -4.260   2.987  -6.071
  324   HG23  ILE  43          HG23      ILE  43  -2.860   4.032  -6.291
  325   HD11  ILE  43          HD11      ILE  43  -3.798   5.992  -2.910
  326   HD12  ILE  43          HD12      ILE  43  -3.257   6.341  -4.554
  327   HD13  ILE  43          HD13      ILE  43  -2.213   6.710  -3.185
  328    H    ASP  44           HN       ASP  44  -3.904   0.714  -3.346
  329    HA   ASP  44           HA       ASP  44  -5.787  -0.137  -5.354
  330    HB2  ASP  44           HB2      ASP  44  -4.289  -1.975  -3.445
  331    HB3  ASP  44           HB1      ASP  44  -4.847  -2.328  -5.075
  332    H    ILE  45           HN       ILE  45  -5.498  -0.511  -1.853
  333    HA   ILE  45           HA       ILE  45  -7.743  -2.136  -1.371
  334    HB   ILE  45           HB       ILE  45  -6.180  -0.226   0.414
  335   HG12  ILE  45          HG12      ILE  45  -6.289  -3.275   0.219
  336   HG13  ILE  45          HG11      ILE  45  -4.960  -2.238  -0.291
  337   HG21  ILE  45          HG21      ILE  45  -8.398  -2.085   1.328
  338   HG22  ILE  45          HG22      ILE  45  -8.452  -0.322   1.332
  339   HG23  ILE  45          HG23      ILE  45  -7.317  -1.166   2.380
  340   HD11  ILE  45          HD11      ILE  45  -4.582  -1.612   2.065
  341   HD12  ILE  45          HD12      ILE  45  -4.422  -3.342   1.774
  342   HD13  ILE  45          HD13      ILE  45  -5.878  -2.714   2.555
  343    H    GLU  46           HN       GLU  46  -7.425   1.390  -1.655
  344    HA   GLU  46           HA       GLU  46 -10.124   1.963  -0.807
  345    HB2  GLU  46           HB2      GLU  46  -8.156   3.552  -0.545
  346    HB3  GLU  46           HB1      GLU  46  -8.227   3.838  -2.280
  347    HG2  GLU  46           HG2      GLU  46 -10.502   4.744  -2.038
  348    HG3  GLU  46           HG1      GLU  46 -10.453   4.420  -0.301
  349    H    LEU  47           HN       LEU  47  -8.442   1.432  -3.859
  350    HA   LEU  47           HA       LEU  47 -10.461   1.988  -5.715
  351    HB2  LEU  47           HB2      LEU  47  -7.895   0.740  -5.708
  352    HB3  LEU  47           HB1      LEU  47  -8.958  -0.476  -6.381
  353    HG   LEU  47           HG       LEU  47  -8.665   2.351  -7.474
  354   HD11  LEU  47          HD11      LEU  47  -7.348   1.351  -9.294
  355   HD12  LEU  47          HD12      LEU  47  -7.423  -0.228  -8.508
  356   HD13  LEU  47          HD13      LEU  47  -6.563   1.108  -7.735
  357   HD21  LEU  47          HD21      LEU  47 -10.847   1.375  -8.003
  358   HD22  LEU  47          HD22      LEU  47 -10.075  -0.086  -8.629
  359   HD23  LEU  47          HD23      LEU  47  -9.852   1.460  -9.456
  360    H    TYR  48           HN       TYR  48 -10.117  -0.653  -3.431
  361    HA   TYR  48           HA       TYR  48 -12.337  -2.224  -4.525
  362    HB2  TYR  48           HB2      TYR  48 -10.771  -2.771  -1.958
  363    HB3  TYR  48           HB1      TYR  48 -11.801  -3.905  -2.845
  364    HD1  TYR  48           HD1      TYR  48  -8.691  -3.997  -1.995
  365    HD2  TYR  48           HD2      TYR  48 -10.756  -3.280  -5.670
  366    HE1  TYR  48           HE1      TYR  48  -6.721  -4.752  -3.259
  367    HE2  TYR  48           HE2      TYR  48  -8.789  -4.035  -6.919
  368    HH   TYR  48           HH       TYR  48  -6.293  -4.173  -6.509
  369    H    THR  49           HN       THR  49 -11.754   0.188  -2.120
  370    HA   THR  49           HA       THR  49 -14.478  -0.151  -0.996
  371    HB   THR  49           HB       THR  49 -13.692   1.023   1.001
  372    HG1  THR  49           HG1      THR  49 -12.179   2.453   0.190
  373   HG21  THR  49          HG21      THR  49 -12.059  -0.585   1.854
  374   HG22  THR  49          HG22      THR  49 -11.621  -1.066   0.216
  375   HG23  THR  49          HG23      THR  49 -13.227  -1.435   0.842
  376    H    ASP  50           HN       ASP  50 -14.815   0.709  -3.202
  377    HA   ASP  50           HA       ASP  50 -14.184   3.416  -3.915
  378    HB2  ASP  50           HB2      ASP  50 -14.304   1.495  -5.506
  379    HB3  ASP  50           HB1      ASP  50 -16.034   1.364  -5.216
  380    H    GLY  51           HN       GLY  51 -15.594   3.623  -1.518
  381    HA2  GLY  51           HA2      GLY  51 -17.148   5.727  -1.596
  382    HA3  GLY  51           HA1      GLY  51 -18.313   4.543  -2.166
  383    H    ARG  52           HN       ARG  52 -16.574   2.726  -0.124
  384    HA   ARG  52           HA       ARG  52 -18.589   2.958   1.958
  385    HB2  ARG  52           HB2      ARG  52 -17.368   0.787   0.898
  386    HB3  ARG  52           HB1      ARG  52 -16.236   1.062   2.205
  387    HG2  ARG  52           HG2      ARG  52 -19.213   0.504   2.499
  388    HG3  ARG  52           HG1      ARG  52 -17.907  -0.642   2.776
  389    HD2  ARG  52           HD2      ARG  52 -18.472   0.002   4.939
  390    HD3  ARG  52           HD1      ARG  52 -17.110   1.066   4.589
  391    HE   ARG  52           HE       ARG  52 -18.874   2.791   4.019
  392   HH11  ARG  52          HH11      ARG  52 -20.716   1.187   7.225
  393   HH12  ARG  52          HH12      ARG  52 -19.533   0.253   6.367
  394   HH21  ARG  52          HH21      ARG  52 -21.234   3.318   6.517
  395   HH22  ARG  52          HH22      ARG  52 -20.439   4.001   5.133
  396    H    VAL  53           HN       VAL  53 -15.006   2.955   1.896
  397    HA   VAL  53           HA       VAL  53 -14.800   5.095   3.824
  398    HB   VAL  53           HB       VAL  53 -15.153   3.191   5.361
  399   HG11  VAL  53          HG11      VAL  53 -14.419   1.369   3.915
  400   HG12  VAL  53          HG12      VAL  53 -13.632   1.286   5.490
  401   HG13  VAL  53          HG13      VAL  53 -12.738   1.891   4.093
  402   HG21  VAL  53          HG21      VAL  53 -13.639   4.975   6.134
  403   HG22  VAL  53          HG22      VAL  53 -12.256   4.117   5.451
  404   HG23  VAL  53          HG23      VAL  53 -13.156   3.413   6.797
  405    H    GLU  54           HN       GLU  54 -12.607   5.916   3.941
  406    HA   GLU  54           HA       GLU  54 -10.947   5.276   1.620
  407    HB2  GLU  54           HB2      GLU  54 -10.749   7.491   3.704
  408    HB3  GLU  54           HB1      GLU  54  -9.651   7.309   2.338
  409    HG2  GLU  54           HG2      GLU  54 -11.498   7.661   0.765
  410    HG3  GLU  54           HG1      GLU  54 -12.634   7.777   2.108
  411    H    CYS  55           HN       CYS  55  -8.747   4.657   1.766
  412    HA   CYS  55           HA       CYS  55  -8.142   3.092   4.197
  413    HB2  CYS  55           HB2      CYS  55  -8.150   1.999   1.909
  414    HB3  CYS  55           HB1      CYS  55  -6.729   2.951   1.508
  415    H    ARG  56           HN       ARG  56  -6.449   3.576   5.508
  416    HA   ARG  56           HA       ARG  56  -4.804   5.950   4.899
  417    HB2  ARG  56           HB2      ARG  56  -5.562   4.523   7.469
  418    HB3  ARG  56           HB1      ARG  56  -4.123   5.532   7.430
  419    HG2  ARG  56           HG2      ARG  56  -6.016   6.794   8.316
  420    HG3  ARG  56           HG1      ARG  56  -5.461   7.488   6.795
  421    HD2  ARG  56           HD2      ARG  56  -7.364   6.210   5.663
  422    HD3  ARG  56           HD1      ARG  56  -7.968   5.848   7.283
  423    HE   ARG  56           HE       ARG  56  -7.528   8.640   6.965
  424   HH11  ARG  56          HH11      ARG  56 -11.145   7.240   5.871
  425   HH12  ARG  56          HH12      ARG  56  -9.826   6.129   6.037
  426   HH21  ARG  56          HH21      ARG  56  -9.238  10.075   6.680
  427   HH22  ARG  56          HH22      ARG  56 -10.809   9.486   6.239
  428    H    GLU  57           HN       GLU  57  -2.966   5.486   3.844
  429    HA   GLU  57           HA       GLU  57  -1.286   3.200   4.686
  430    HB2  GLU  57           HB2      GLU  57   0.058   3.682   2.616
  431    HB3  GLU  57           HB1      GLU  57  -1.599   3.206   2.290
  432    HG2  GLU  57           HG2      GLU  57  -2.188   5.582   1.900
  433    HG3  GLU  57           HG1      GLU  57  -0.503   6.027   2.171
  434    H    LEU  58           HN       LEU  58   1.029   3.626   4.872
  435    HA   LEU  58           HA       LEU  58   1.471   6.094   6.393
  436    HB2  LEU  58           HB2      LEU  58   2.991   3.454   6.332
  437    HB3  LEU  58           HB1      LEU  58   3.433   4.835   7.333
  438    HG   LEU  58           HG       LEU  58   0.808   3.306   7.549
  439   HD11  LEU  58          HD11      LEU  58   1.670   2.397   9.634
  440   HD12  LEU  58          HD12      LEU  58   3.222   3.201   9.370
  441   HD13  LEU  58          HD13      LEU  58   2.684   1.929   8.271
  442   HD21  LEU  58          HD21      LEU  58   1.923   5.526   9.290
  443   HD22  LEU  58          HD22      LEU  58   0.465   4.589   9.630
  444   HD23  LEU  58          HD23      LEU  58   0.528   5.628   8.210
  445    H    ARG  59           HN       ARG  59   2.407   7.672   5.354
  446    HA   ARG  59           HA       ARG  59   3.178   7.617   2.706
  447    HB2  ARG  59           HB2      ARG  59   3.966   9.915   3.046
  448    HB3  ARG  59           HB1      ARG  59   2.453   9.651   3.926
  449    HG2  ARG  59           HG2      ARG  59   3.703   9.362   6.028
  450    HG3  ARG  59           HG1      ARG  59   5.223   9.625   5.168
  451    HD2  ARG  59           HD2      ARG  59   2.980  11.609   5.597
  452    HD3  ARG  59           HD1      ARG  59   4.605  11.668   6.282
  453    HE   ARG  59           HE       ARG  59   3.849  12.199   3.481
  454   HH11  ARG  59          HH11      ARG  59   6.329  12.352   5.977
  455   HH12  ARG  59          HH12      ARG  59   7.363  13.381   5.036
  456   HH21  ARG  59          HH21      ARG  59   6.728  14.055   2.936
  457   HH22  ARG  59          HH22      ARG  59   5.209  13.538   2.271
  458    HA   PRO  60           HA       PRO  60   7.342   6.193   2.396
  459    HB2  PRO  60           HB2      PRO  60   8.494   7.849   0.520
  460    HB3  PRO  60           HB1      PRO  60   7.232   6.668   0.112
  461    HG2  PRO  60           HG2      PRO  60   6.937   9.614   0.649
  462    HG3  PRO  60           HG1      PRO  60   6.265   8.640  -0.684
  463    HD2  PRO  60           HD2      PRO  60   4.759   9.278   1.465
  464    HD3  PRO  60           HD1      PRO  60   4.604   7.693   0.660
  465    H    ASP  61           HN       ASP  61   6.927   9.547   3.283
  466    HA   ASP  61           HA       ASP  61   8.188  11.181   4.214
  467    HB2  ASP  61           HB2      ASP  61   9.368   8.785   5.713
  468    HB3  ASP  61           HB1      ASP  61   9.624  10.463   6.178
  469    H    VAL  62           HN       VAL  62   9.031  10.802   1.799
  470    HA   VAL  62           HA       VAL  62  10.629  11.062   0.254
  471    HB   VAL  62           HB       VAL  62  12.616  11.364   2.565
  472   HG11  VAL  62          HG11      VAL  62  14.176  12.310   0.892
  473   HG12  VAL  62          HG12      VAL  62  13.035  11.936  -0.399
  474   HG13  VAL  62          HG13      VAL  62  13.781  10.631   0.525
  475   HG21  VAL  62          HG21      VAL  62  11.267  13.491   0.840
  476   HG22  VAL  62          HG22      VAL  62  12.477  13.795   2.088
  477   HG23  VAL  62          HG23      VAL  62  10.902  13.143   2.533
  478    H    PHE  63           HN       PHE  63  10.979   9.359  -0.973
  479    HA   PHE  63           HA       PHE  63  12.692   7.123  -0.186
  480    HB2  PHE  63           HB2      PHE  63  10.440   6.400   0.556
  481    HB3  PHE  63           HB1      PHE  63   9.775   6.758  -1.028
  482    HD1  PHE  63           HD1      PHE  63  12.266   4.544   0.700
  483    HD2  PHE  63           HD2      PHE  63   9.676   5.046  -2.669
  484    HE1  PHE  63           HE1      PHE  63  12.698   2.219   0.013
  485    HE2  PHE  63           HE2      PHE  63  10.117   2.722  -3.346
  486    HZ   PHE  63           HZ       PHE  63  11.622   1.306  -2.007
  487    H    GLY  64           HN       GLY  64  13.417   5.900  -2.043
  488    HA2  GLY  64           HA2      GLY  64  13.941   5.514  -4.255
  489    HA3  GLY  64           HA1      GLY  64  12.642   6.593  -4.735
  490    H    ALA  65           HN       ALA  65  15.500   7.193  -2.700
  491    HA   ALA  65           HA       ALA  65  16.238   9.608  -4.061
  492    HB1  ALA  65           HB1      ALA  65  17.770   7.984  -1.992
  493    HB2  ALA  65           HB2      ALA  65  16.667   9.319  -1.660
  494    HB3  ALA  65           HB3      ALA  65  18.177   9.619  -2.520
  Start of MODEL   15
    1    H1   MET   1           HT1      MET   1 -14.761  -2.325  12.386
    2    H2   MET   1           HT2      MET   1 -14.063  -0.794  12.529
    3    H3   MET   1           HT3      MET   1 -13.078  -2.155  12.351
    4    HA   MET   1           HA       MET   1 -13.885  -2.542  10.149
    5    HB2  MET   1           HB2      MET   1 -16.193  -1.684  10.510
    6    HB3  MET   1           HB1      MET   1 -15.581  -0.038  10.594
    7    HG2  MET   1           HG2      MET   1 -14.871  -0.169   8.249
    8    HG3  MET   1           HG1      MET   1 -15.426  -1.840   8.163
    9    HE1  MET   1           HE1      MET   1 -16.510   1.952   8.401
   10    HE2  MET   1           HE2      MET   1 -17.175   1.301   9.901
   11    HE3  MET   1           HE3      MET   1 -18.256   1.806   8.606
   12    H    ASN   2           HN       ASN   2 -12.279  -2.023   8.848
   13    HA   ASN   2           HA       ASN   2 -11.379   0.770   8.513
   14    HB2  ASN   2           HB2      ASN   2  -8.998  -0.131   8.231
   15    HB3  ASN   2           HB1      ASN   2  -9.607  -0.110   9.877
   16   HD21  ASN   2          HD21      ASN   2  -9.994  -2.070  10.905
   17   HD22  ASN   2          HD22      ASN   2  -9.359  -3.553  10.303
   18    H    ALA   3           HN       ALA   3 -10.085   0.923   6.418
   19    HA   ALA   3           HA       ALA   3 -11.735   0.059   4.312
   20    HB1  ALA   3           HB1      ALA   3 -10.466   2.129   4.236
   21    HB2  ALA   3           HB2      ALA   3 -10.122   1.128   2.827
   22    HB3  ALA   3           HB3      ALA   3  -8.951   1.224   4.150
   23    H    ILE   4           HN       ILE   4  -8.798  -1.293   5.606
   24    HA   ILE   4           HA       ILE   4  -8.127  -3.049   3.474
   25    HB   ILE   4           HB       ILE   4  -7.550  -3.592   6.413
   26   HG12  ILE   4          HG12      ILE   4  -5.211  -2.552   5.799
   27   HG13  ILE   4          HG11      ILE   4  -6.090  -1.733   4.517
   28   HG21  ILE   4          HG21      ILE   4  -7.157  -5.509   4.935
   29   HG22  ILE   4          HG22      ILE   4  -5.638  -4.903   5.593
   30   HG23  ILE   4          HG23      ILE   4  -6.089  -4.528   3.927
   31   HD11  ILE   4          HD11      ILE   4  -5.780  -0.298   6.433
   32   HD12  ILE   4          HD12      ILE   4  -6.573  -1.467   7.488
   33   HD13  ILE   4          HD13      ILE   4  -7.499  -0.641   6.229
   34    H    ASP   5           HN       ASP   5 -10.006  -3.400   6.452
   35    HA   ASP   5           HA       ASP   5 -10.944  -6.020   6.323
   36    HB2  ASP   5           HB2      ASP   5 -11.160  -4.500   8.277
   37    HB3  ASP   5           HB1      ASP   5 -12.336  -3.530   7.410
   38    H    ILE   6           HN       ILE   6 -12.380  -3.063   5.002
   39    HA   ILE   6           HA       ILE   6 -14.743  -4.258   3.938
   40    HB   ILE   6           HB       ILE   6 -13.397  -1.567   3.467
   41   HG12  ILE   6          HG12      ILE   6 -14.328  -1.921   5.737
   42   HG13  ILE   6          HG11      ILE   6 -15.210  -0.667   4.878
   43   HG21  ILE   6          HG21      ILE   6 -15.484  -0.769   2.386
   44   HG22  ILE   6          HG22      ILE   6 -16.114  -2.419   2.393
   45   HG23  ILE   6          HG23      ILE   6 -14.681  -2.020   1.442
   46   HD11  ILE   6          HD11      ILE   6 -17.032  -2.260   4.437
   47   HD12  ILE   6          HD12      ILE   6 -16.714  -2.087   6.161
   48   HD13  ILE   6          HD13      ILE   6 -16.141  -3.516   5.302
   49    H    ALA   7           HN       ALA   7 -11.519  -3.683   2.577
   50    HA   ALA   7           HA       ALA   7 -12.225  -4.316  -0.149
   51    HB1  ALA   7           HB1      ALA   7  -9.833  -4.360  -0.604
   52    HB2  ALA   7           HB2      ALA   7  -9.480  -4.346   1.133
   53    HB3  ALA   7           HB3      ALA   7 -10.245  -2.948   0.380
   54    H    ILE   8           HN       ILE   8 -11.039  -6.180   2.607
   55    HA   ILE   8           HA       ILE   8 -10.683  -8.727   1.435
   56    HB   ILE   8           HB       ILE   8 -11.757  -8.003   4.207
   57   HG12  ILE   8          HG12      ILE   8  -8.906  -8.799   3.474
   58   HG13  ILE   8          HG11      ILE   8  -9.440  -7.127   3.528
   59   HG21  ILE   8          HG21      ILE   8 -11.042 -10.278   4.920
   60   HG22  ILE   8          HG22      ILE   8 -10.640 -10.672   3.245
   61   HG23  ILE   8          HG23      ILE   8 -12.312 -10.337   3.702
   62   HD11  ILE   8          HD11      ILE   8  -9.344  -9.052   5.827
   63   HD12  ILE   8          HD12      ILE   8  -9.982  -7.408   5.909
   64   HD13  ILE   8          HD13      ILE   8  -8.282  -7.679   5.529
   65    H    ASN   9           HN       ASN   9 -13.516  -7.170   2.866
   66    HA   ASN   9           HA       ASN   9 -15.422  -9.220   2.415
   67    HB2  ASN   9           HB2      ASN   9 -15.852  -6.219   2.748
   68    HB3  ASN   9           HB1      ASN   9 -17.092  -7.459   2.931
   69   HD21  ASN   9          HD21      ASN   9 -16.042  -5.443   4.829
   70   HD22  ASN   9          HD22      ASN   9 -15.504  -6.320   6.216
   71    H    LYS  10           HN       LYS  10 -14.241  -6.571   0.436
   72    HA   LYS  10           HA       LYS  10 -16.359  -6.602  -1.497
   73    HB2  LYS  10           HB2      LYS  10 -14.479  -4.742  -0.848
   74    HB3  LYS  10           HB1      LYS  10 -13.654  -5.437  -2.236
   75    HG2  LYS  10           HG2      LYS  10 -16.509  -4.766  -2.766
   76    HG3  LYS  10           HG1      LYS  10 -15.540  -3.382  -2.284
   77    HD2  LYS  10           HD2      LYS  10 -15.504  -3.455  -4.660
   78    HD3  LYS  10           HD1      LYS  10 -13.909  -3.954  -4.104
   79    HE2  LYS  10           HE2      LYS  10 -14.461  -6.294  -4.570
   80    HE3  LYS  10           HE1      LYS  10 -16.095  -5.836  -5.059
   81    HZ1  LYS  10           HZ1      LYS  10 -13.606  -4.894  -6.379
   82    HZ2  LYS  10           HZ2      LYS  10 -15.192  -4.603  -6.894
   83    HZ3  LYS  10           HZ3      LYS  10 -14.561  -6.171  -6.932
   84    H    LEU  11           HN       LEU  11 -13.036  -7.934  -1.404
   85    HA   LEU  11           HA       LEU  11 -13.339  -9.147  -4.037
   86    HB2  LEU  11           HB2      LEU  11 -11.000  -9.446  -2.127
   87    HB3  LEU  11           HB1      LEU  11 -11.040  -9.916  -3.819
   88    HG   LEU  11           HG       LEU  11 -10.795  -7.148  -2.618
   89   HD11  LEU  11          HD11      LEU  11  -8.935  -6.933  -4.228
   90   HD12  LEU  11          HD12      LEU  11  -9.274  -8.558  -4.831
   91   HD13  LEU  11          HD13      LEU  11  -8.734  -8.325  -3.170
   92   HD21  LEU  11          HD21      LEU  11 -12.652  -6.894  -4.187
   93   HD22  LEU  11          HD22      LEU  11 -11.705  -7.657  -5.469
   94   HD23  LEU  11          HD23      LEU  11 -11.209  -6.098  -4.799
   95    H    GLY  12           HN       GLY  12 -14.160 -10.042  -0.888
   96    HA2  GLY  12           HA2      GLY  12 -15.520 -11.965  -0.517
   97    HA3  GLY  12           HA1      GLY  12 -14.635 -12.824  -1.769
   98    H    SER  13           HN       SER  13 -11.956 -11.991  -0.729
   99    HA   SER  13           HA       SER  13 -11.740 -13.170   1.920
  100    HB2  SER  13           HB2      SER  13 -10.302 -15.076   1.175
  101    HB3  SER  13           HB1      SER  13 -11.945 -15.193   0.535
  102    HG   SER  13           HG       SER  13 -11.236 -14.829  -1.433
  103    H    VAL  14           HN       VAL  14  -9.426 -13.455   2.548
  104    HA   VAL  14           HA       VAL  14  -7.801 -11.149   1.876
  105    HB   VAL  14           HB       VAL  14  -7.659 -13.384   3.941
  106   HG11  VAL  14          HG11      VAL  14  -5.438 -11.364   3.467
  107   HG12  VAL  14          HG12      VAL  14  -5.322 -13.111   3.288
  108   HG13  VAL  14          HG13      VAL  14  -5.581 -12.414   4.884
  109   HG21  VAL  14          HG21      VAL  14  -7.786 -10.357   4.136
  110   HG22  VAL  14          HG22      VAL  14  -7.729 -11.474   5.513
  111   HG23  VAL  14          HG23      VAL  14  -9.108 -11.501   4.420
  112    H    SER  15           HN       SER  15  -7.837 -14.607   1.226
  113    HA   SER  15           HA       SER  15  -5.267 -14.818   0.076
  114    HB2  SER  15           HB2      SER  15  -6.400 -16.824  -1.167
  115    HB3  SER  15           HB1      SER  15  -6.305 -16.872   0.594
  116    HG   SER  15           HG       SER  15  -8.559 -16.156  -0.986
  117    H    ALA  16           HN       ALA  16  -8.398 -13.787  -1.213
  118    HA   ALA  16           HA       ALA  16  -7.524 -13.376  -3.927
  119    HB1  ALA  16           HB1      ALA  16  -9.898 -13.758  -3.384
  120    HB2  ALA  16           HB2      ALA  16  -9.691 -12.213  -4.208
  121    HB3  ALA  16           HB3      ALA  16  -9.947 -12.254  -2.461
  122    H    LEU  17           HN       LEU  17  -7.866 -11.309  -1.044
  123    HA   LEU  17           HA       LEU  17  -7.397  -8.831  -2.347
  124    HB2  LEU  17           HB2      LEU  17  -8.579  -8.992  -0.174
  125    HB3  LEU  17           HB1      LEU  17  -7.085  -9.505   0.602
  126    HG   LEU  17           HG       LEU  17  -6.050  -7.333   0.073
  127   HD11  LEU  17          HD11      LEU  17  -7.379  -5.439  -0.788
  128   HD12  LEU  17          HD12      LEU  17  -8.755  -6.519  -1.041
  129   HD13  LEU  17          HD13      LEU  17  -7.269  -6.743  -1.968
  130   HD21  LEU  17          HD21      LEU  17  -8.659  -6.978   1.550
  131   HD22  LEU  17          HD22      LEU  17  -7.240  -5.930   1.655
  132   HD23  LEU  17          HD23      LEU  17  -7.147  -7.593   2.229
  133    H    ALA  18           HN       ALA  18  -5.276 -10.826  -0.349
  134    HA   ALA  18           HA       ALA  18  -2.943  -9.266  -0.490
  135    HB1  ALA  18           HB1      ALA  18  -3.360 -11.002   1.215
  136    HB2  ALA  18           HB2      ALA  18  -1.798 -11.212   0.424
  137    HB3  ALA  18           HB3      ALA  18  -3.159 -12.252  -0.015
  138    H    ALA  19           HN       ALA  19  -4.125 -11.928  -2.534
  139    HA   ALA  19           HA       ALA  19  -1.898 -12.246  -4.234
  140    HB1  ALA  19           HB1      ALA  19  -3.504 -13.189  -5.851
  141    HB2  ALA  19           HB2      ALA  19  -4.847 -12.526  -4.915
  142    HB3  ALA  19           HB3      ALA  19  -3.825 -13.778  -4.214
  143    H    ALA  20           HN       ALA  20  -4.516  -9.865  -4.238
  144    HA   ALA  20           HA       ALA  20  -3.780  -8.611  -6.748
  145    HB1  ALA  20           HB1      ALA  20  -5.729  -7.724  -4.597
  146    HB2  ALA  20           HB2      ALA  20  -6.122  -8.688  -6.023
  147    HB3  ALA  20           HB3      ALA  20  -5.584  -7.016  -6.206
  148    H    LEU  21           HN       LEU  21  -3.130  -8.114  -3.338
  149    HA   LEU  21           HA       LEU  21  -1.994  -5.440  -3.691
  150    HB2  LEU  21           HB2      LEU  21  -2.471  -7.156  -1.235
  151    HB3  LEU  21           HB1      LEU  21  -1.698  -5.577  -1.171
  152    HG   LEU  21           HG       LEU  21  -4.560  -6.130  -2.063
  153   HD11  LEU  21          HD11      LEU  21  -3.488  -4.788   0.428
  154   HD12  LEU  21          HD12      LEU  21  -4.336  -6.335   0.320
  155   HD13  LEU  21          HD13      LEU  21  -5.190  -4.839  -0.052
  156   HD21  LEU  21          HD21      LEU  21  -3.642  -4.276  -3.351
  157   HD22  LEU  21          HD22      LEU  21  -3.097  -3.481  -1.870
  158   HD23  LEU  21          HD23      LEU  21  -4.824  -3.686  -2.188
  159    H    GLY  22           HN       GLY  22  -0.866  -8.584  -3.916
  160    HA2  GLY  22           HA2      GLY  22   1.236  -9.369  -4.436
  161    HA3  GLY  22           HA1      GLY  22   1.836  -7.722  -4.349
  162    H    VAL  23           HN       VAL  23   0.180  -9.263  -1.677
  163    HA   VAL  23           HA       VAL  23   2.719  -9.617  -0.165
  164    HB   VAL  23           HB       VAL  23   1.554  -8.758   1.876
  165   HG11  VAL  23          HG11      VAL  23   2.980  -7.200   0.626
  166   HG12  VAL  23          HG12      VAL  23   1.605  -6.348   1.330
  167   HG13  VAL  23          HG13      VAL  23   1.613  -6.729  -0.393
  168   HG21  VAL  23          HG21      VAL  23  -0.792  -9.212   1.231
  169   HG22  VAL  23          HG22      VAL  23  -0.706  -7.963  -0.016
  170   HG23  VAL  23          HG23      VAL  23  -0.589  -7.521   1.689
  171    H    ASN  24           HN       ASN  24   1.994 -10.794   2.052
  172    HA   ASN  24           HA       ASN  24   0.676 -13.296   1.263
  173    HB2  ASN  24           HB2      ASN  24   2.854 -13.277   2.474
  174    HB3  ASN  24           HB1      ASN  24   2.077 -12.538   3.858
  175   HD21  ASN  24          HD21      ASN  24   2.708 -14.259   5.193
  176   HD22  ASN  24          HD22      ASN  24   1.993 -15.829   5.086
  177    H    GLN  25           HN       GLN  25  -0.796 -14.321   2.812
  178    HA   GLN  25           HA       GLN  25  -3.116 -12.813   3.353
  179    HB2  GLN  25           HB2      GLN  25  -2.282 -15.612   4.192
  180    HB3  GLN  25           HB1      GLN  25  -3.822 -14.934   4.682
  181    HG2  GLN  25           HG2      GLN  25  -4.159 -16.377   2.794
  182    HG3  GLN  25           HG1      GLN  25  -4.493 -14.720   2.318
  183   HE21  GLN  25          HE21      GLN  25  -3.186 -13.755   0.737
  184   HE22  GLN  25          HE22      GLN  25  -2.033 -14.641  -0.192
  185    H    SER  26           HN       SER  26  -0.513 -13.941   5.468
  186    HA   SER  26           HA       SER  26  -1.510 -13.045   7.958
  187    HB2  SER  26           HB2      SER  26   0.327 -14.680   7.716
  188    HB3  SER  26           HB1      SER  26   1.378 -13.431   7.058
  189    HG   SER  26           HG       SER  26   1.084 -14.087   9.570
  190    H    ALA  27           HN       ALA  27   0.276 -11.340   5.425
  191    HA   ALA  27           HA       ALA  27   0.955  -8.985   6.848
  192    HB1  ALA  27           HB1      ALA  27   0.350  -9.268   3.883
  193    HB2  ALA  27           HB2      ALA  27   1.922  -9.510   4.649
  194    HB3  ALA  27           HB3      ALA  27   1.176  -7.911   4.641
  195    H    ILE  28           HN       ILE  28  -1.914  -9.818   4.903
  196    HA   ILE  28           HA       ILE  28  -3.311  -7.351   5.176
  197    HB   ILE  28           HB       ILE  28  -4.511 -10.114   4.725
  198   HG12  ILE  28          HG12      ILE  28  -2.704  -9.589   3.077
  199   HG13  ILE  28          HG11      ILE  28  -4.291  -9.774   2.343
  200   HG21  ILE  28          HG21      ILE  28  -5.599  -7.369   4.006
  201   HG22  ILE  28          HG22      ILE  28  -6.214  -8.438   5.269
  202   HG23  ILE  28          HG23      ILE  28  -6.342  -8.919   3.580
  203   HD11  ILE  28          HD11      ILE  28  -4.491  -7.345   2.177
  204   HD12  ILE  28          HD12      ILE  28  -3.063  -7.954   1.343
  205   HD13  ILE  28          HD13      ILE  28  -2.897  -7.171   2.912
  206    H    SER  29           HN       SER  29  -3.370 -10.374   7.034
  207    HA   SER  29           HA       SER  29  -5.457  -9.800   8.833
  208    HB2  SER  29           HB2      SER  29  -4.456 -12.046   8.582
  209    HB3  SER  29           HB1      SER  29  -2.943 -11.471   9.277
  210    HG   SER  29           HG       SER  29  -4.924 -10.872  10.972
  211    H    GLN  30           HN       GLN  30  -1.990  -9.081   8.969
  212    HA   GLN  30           HA       GLN  30  -1.941  -7.767  11.485
  213    HB2  GLN  30           HB2      GLN  30   0.053  -8.699  10.323
  214    HB3  GLN  30           HB1      GLN  30  -0.091  -7.485   9.065
  215    HG2  GLN  30           HG2      GLN  30   0.323  -6.624  11.934
  216    HG3  GLN  30           HG1      GLN  30   1.685  -7.233  11.004
  217   HE21  GLN  30          HE21      GLN  30   2.376  -6.055   9.154
  218   HE22  GLN  30          HE22      GLN  30   2.001  -4.380   8.957
  219    H    TRP  31           HN       TRP  31  -2.324  -6.579   8.156
  220    HA   TRP  31           HA       TRP  31  -2.316  -3.811   8.683
  221    HB2  TRP  31           HB2      TRP  31  -3.477  -5.392   6.376
  222    HB3  TRP  31           HB1      TRP  31  -3.428  -3.633   6.405
  223    HD1  TRP  31           HD1      TRP  31  -0.207  -4.427   7.829
  224    HE1  TRP  31           HE1      TRP  31   1.618  -4.523   6.022
  225    HE3  TRP  31           HE3      TRP  31  -3.154  -4.772   3.658
  226    HZ2  TRP  31           HZ2      TRP  31   1.799  -4.718   3.211
  227    HZ3  TRP  31           HZ3      TRP  31  -2.088  -4.889   1.466
  228    HH2  TRP  31           HH2      TRP  31   0.331  -4.865   1.234
  229    H    ARG  32           HN       ARG  32  -4.919  -6.192   8.753
  230    HA   ARG  32           HA       ARG  32  -7.100  -4.328   8.730
  231    HB2  ARG  32           HB2      ARG  32  -7.369  -6.779   8.119
  232    HB3  ARG  32           HB1      ARG  32  -7.108  -7.200   9.809
  233    HG2  ARG  32           HG2      ARG  32  -9.141  -5.513  10.200
  234    HG3  ARG  32           HG1      ARG  32  -9.486  -5.874   8.513
  235    HD2  ARG  32           HD2      ARG  32  -9.299  -7.900  10.776
  236    HD3  ARG  32           HD1      ARG  32 -10.793  -7.292  10.061
  237    HE   ARG  32           HE       ARG  32  -8.803  -8.905   8.567
  238   HH11  ARG  32          HH11      ARG  32 -12.771  -9.425   8.246
  239   HH12  ARG  32          HH12      ARG  32 -12.163  -8.205   9.315
  240   HH21  ARG  32          HH21      ARG  32  -9.628 -10.503   7.199
  241   HH22  ARG  32          HH22      ARG  32 -11.341 -10.725   7.045
  242    H    ALA  33           HN       ALA  33  -5.461  -6.264  11.228
  243    HA   ALA  33           HA       ALA  33  -6.862  -5.178  13.452
  244    HB1  ALA  33           HB1      ALA  33  -5.815  -7.393  13.541
  245    HB2  ALA  33           HB2      ALA  33  -5.180  -6.367  14.825
  246    HB3  ALA  33           HB3      ALA  33  -4.213  -6.665  13.379
  247    H    ARG  34           HN       ARG  34  -4.124  -4.086  11.646
  248    HA   ARG  34           HA       ARG  34  -3.069  -2.182  13.546
  249    HB2  ARG  34           HB2      ARG  34  -1.828  -3.344  11.629
  250    HB3  ARG  34           HB1      ARG  34  -2.769  -2.373  10.512
  251    HG2  ARG  34           HG2      ARG  34  -0.767  -1.245  10.605
  252    HG3  ARG  34           HG1      ARG  34  -1.741  -0.336  11.752
  253    HD2  ARG  34           HD2      ARG  34  -0.638  -1.305  13.621
  254    HD3  ARG  34           HD1      ARG  34   0.099  -2.578  12.644
  255    HE   ARG  34           HE       ARG  34   1.018   0.155  12.965
  256   HH11  ARG  34          HH11      ARG  34   1.278  -2.763  11.022
  257   HH12  ARG  34          HH12      ARG  34   2.826  -2.337  10.369
  258   HH21  ARG  34          HH21      ARG  34   3.070   0.696  12.110
  259   HH22  ARG  34          HH22      ARG  34   3.847  -0.375  10.990
  260    H    GLY  35           HN       GLY  35  -5.355  -2.269  10.889
  261    HA2  GLY  35           HA2      GLY  35  -6.969  -0.830  10.116
  262    HA3  GLY  35           HA1      GLY  35  -6.619   0.251  11.459
  263    H    ARG  36           HN       ARG  36  -3.994  -0.777   9.424
  264    HA   ARG  36           HA       ARG  36  -3.828   1.651   7.827
  265    HB2  ARG  36           HB2      ARG  36  -3.098   2.276  10.241
  266    HB3  ARG  36           HB1      ARG  36  -1.741   1.190  10.019
  267    HG2  ARG  36           HG2      ARG  36  -0.842   3.314   9.555
  268    HG3  ARG  36           HG1      ARG  36  -1.144   2.631   7.954
  269    HD2  ARG  36           HD2      ARG  36  -3.267   3.901   7.825
  270    HD3  ARG  36           HD1      ARG  36  -2.940   4.613   9.411
  271    HE   ARG  36           HE       ARG  36  -1.005   5.001   7.215
  272   HH11  ARG  36          HH11      ARG  36  -3.402   6.436   9.328
  273   HH12  ARG  36          HH12      ARG  36  -2.952   8.064   8.933
  274   HH21  ARG  36          HH21      ARG  36  -0.426   7.147   6.690
  275   HH22  ARG  36          HH22      ARG  36  -1.265   8.473   7.430
  276    H    VAL  37           HN       VAL  37  -2.410   1.304   6.100
  277    HA   VAL  37           HA       VAL  37  -0.773  -1.182   6.106
  278    HB   VAL  37           HB       VAL  37  -1.028  -1.347   3.704
  279   HG11  VAL  37          HG11      VAL  37  -2.848  -2.294   5.041
  280   HG12  VAL  37          HG12      VAL  37  -3.433  -1.731   3.477
  281   HG13  VAL  37          HG13      VAL  37  -3.737  -0.771   4.925
  282   HG21  VAL  37          HG21      VAL  37  -0.980   1.024   3.073
  283   HG22  VAL  37          HG22      VAL  37  -2.582   1.264   3.766
  284   HG23  VAL  37          HG23      VAL  37  -2.377   0.228   2.350
  285    HA   PRO  38           HA       PRO  38   3.032   1.212   5.039
  286    HB2  PRO  38           HB2      PRO  38   3.295  -0.992   2.960
  287    HB3  PRO  38           HB1      PRO  38   4.510  -0.361   4.096
  288    HG2  PRO  38           HG2      PRO  38   3.374  -2.663   4.615
  289    HG3  PRO  38           HG1      PRO  38   3.572  -1.476   5.928
  290    HD2  PRO  38           HD2      PRO  38   1.091  -2.134   4.349
  291    HD3  PRO  38           HD1      PRO  38   1.279  -1.875   6.097
  292    H    ALA  39           HN       ALA  39   4.105   2.116   3.027
  293    HA   ALA  39           HA       ALA  39   2.322   3.859   1.762
  294    HB1  ALA  39           HB1      ALA  39   4.659   4.403   2.224
  295    HB2  ALA  39           HB2      ALA  39   4.288   4.653   0.516
  296    HB3  ALA  39           HB3      ALA  39   5.195   3.223   1.023
  297    H    GLY  40           HN       GLY  40   1.726   4.141  -0.425
  298    HA2  GLY  40           HA2      GLY  40   1.134   3.744  -2.579
  299    HA3  GLY  40           HA1      GLY  40   2.597   2.775  -2.694
  300    H    ARG  41           HN       ARG  41  -0.242   2.147  -0.619
  301    HA   ARG  41           HA       ARG  41  -0.794  -0.317  -2.162
  302    HB2  ARG  41           HB2      ARG  41   0.750  -0.754  -0.174
  303    HB3  ARG  41           HB1      ARG  41  -0.576  -0.288   0.884
  304    HG2  ARG  41           HG2      ARG  41  -0.672  -2.632   0.845
  305    HG3  ARG  41           HG1      ARG  41  -1.940  -2.143  -0.277
  306    HD2  ARG  41           HD2      ARG  41   0.848  -3.100  -1.039
  307    HD3  ARG  41           HD1      ARG  41  -0.634  -4.047  -1.146
  308    HE   ARG  41           HE       ARG  41  -1.256  -1.983  -2.763
  309   HH11  ARG  41          HH11      ARG  41   2.033  -3.782  -4.294
  310   HH12  ARG  41          HH12      ARG  41   1.663  -3.969  -2.615
  311   HH21  ARG  41          HH21      ARG  41   0.672  -2.512  -5.635
  312   HH22  ARG  41          HH22      ARG  41  -0.731  -1.734  -4.975
  313    H    CYS  42           HN       CYS  42  -2.001   2.070   0.143
  314    HA   CYS  42           HA       CYS  42  -4.676   1.104   0.239
  315    HB2  CYS  42           HB2      CYS  42  -3.372   3.703   0.952
  316    HB3  CYS  42           HB1      CYS  42  -5.131   3.684   0.779
  317    H    ILE  43           HN       ILE  43  -2.929   2.810  -2.189
  318    HA   ILE  43           HA       ILE  43  -4.881   4.019  -3.761
  319    HB   ILE  43           HB       ILE  43  -2.503   2.343  -4.697
  320   HG12  ILE  43          HG12      ILE  43  -1.816   4.131  -3.125
  321   HG13  ILE  43          HG11      ILE  43  -1.202   4.426  -4.743
  322   HG21  ILE  43          HG21      ILE  43  -4.032   4.480  -6.219
  323   HG22  ILE  43          HG22      ILE  43  -4.019   2.750  -6.562
  324   HG23  ILE  43          HG23      ILE  43  -2.545   3.695  -6.770
  325   HD11  ILE  43          HD11      ILE  43  -2.944   6.131  -5.086
  326   HD12  ILE  43          HD12      ILE  43  -1.927   6.488  -3.694
  327   HD13  ILE  43          HD13      ILE  43  -3.546   5.838  -3.452
  328    H    ASP  44           HN       ASP  44  -3.905   0.577  -3.630
  329    HA   ASP  44           HA       ASP  44  -5.793  -0.296  -5.656
  330    HB2  ASP  44           HB2      ASP  44  -4.432  -2.175  -3.697
  331    HB3  ASP  44           HB1      ASP  44  -4.880  -2.465  -5.375
  332    H    ILE  45           HN       ILE  45  -5.582  -0.441  -2.107
  333    HA   ILE  45           HA       ILE  45  -7.938  -1.917  -1.617
  334    HB   ILE  45           HB       ILE  45  -6.532   0.114   0.172
  335   HG12  ILE  45          HG12      ILE  45  -6.373  -2.937   0.010
  336   HG13  ILE  45          HG11      ILE  45  -5.084  -1.797  -0.368
  337   HG21  ILE  45          HG21      ILE  45  -8.635  -1.940   0.963
  338   HG22  ILE  45          HG22      ILE  45  -8.881  -0.195   0.904
  339   HG23  ILE  45          HG23      ILE  45  -7.753  -0.879   2.071
  340   HD11  ILE  45          HD11      ILE  45  -5.020  -1.155   2.029
  341   HD12  ILE  45          HD12      ILE  45  -4.667  -2.857   1.748
  342   HD13  ILE  45          HD13      ILE  45  -6.251  -2.383   2.369
  343    H    GLU  46           HN       GLU  46  -7.442   1.471  -2.363
  344    HA   GLU  46           HA       GLU  46 -10.099   2.377  -1.727
  345    HB2  GLU  46           HB2      GLU  46  -7.784   3.647  -3.223
  346    HB3  GLU  46           HB1      GLU  46  -9.359   4.431  -3.138
  347    HG2  GLU  46           HG2      GLU  46  -9.225   4.704  -0.780
  348    HG3  GLU  46           HG1      GLU  46  -7.862   3.589  -0.653
  349    H    LEU  47           HN       LEU  47  -8.494   1.113  -4.621
  350    HA   LEU  47           HA       LEU  47 -10.519   1.499  -6.515
  351    HB2  LEU  47           HB2      LEU  47  -8.096  -0.003  -6.340
  352    HB3  LEU  47           HB1      LEU  47  -9.313  -1.199  -6.739
  353    HG   LEU  47           HG       LEU  47  -8.689   1.308  -8.352
  354   HD11  LEU  47          HD11      LEU  47  -7.746  -0.219 -10.021
  355   HD12  LEU  47          HD12      LEU  47  -8.049  -1.598  -8.961
  356   HD13  LEU  47          HD13      LEU  47  -6.892  -0.351  -8.486
  357   HD21  LEU  47          HD21      LEU  47 -10.612  -0.958  -9.006
  358   HD22  LEU  47          HD22      LEU  47 -10.174   0.370 -10.086
  359   HD23  LEU  47          HD23      LEU  47 -11.055   0.703  -8.598
  360    H    TYR  48           HN       TYR  48 -10.233  -0.785  -3.856
  361    HA   TYR  48           HA       TYR  48 -12.686  -2.222  -4.577
  362    HB2  TYR  48           HB2      TYR  48 -11.014  -2.741  -2.087
  363    HB3  TYR  48           HB1      TYR  48 -12.093  -3.860  -2.938
  364    HD1  TYR  48           HD1      TYR  48  -8.868  -3.800  -2.165
  365    HD2  TYR  48           HD2      TYR  48 -11.153  -3.539  -5.770
  366    HE1  TYR  48           HE1      TYR  48  -6.934  -4.598  -3.462
  367    HE2  TYR  48           HE2      TYR  48  -9.226  -4.338  -7.045
  368    HH   TYR  48           HH       TYR  48  -6.770  -4.391  -6.836
  369    H    THR  49           HN       THR  49 -11.595   0.237  -2.336
  370    HA   THR  49           HA       THR  49 -14.199   0.240  -0.948
  371    HB   THR  49           HB       THR  49 -13.108   1.429   0.924
  372    HG1  THR  49           HG1      THR  49 -10.525   0.970   0.018
  373   HG21  THR  49          HG21      THR  49 -11.527  -1.049   0.165
  374   HG22  THR  49          HG22      THR  49 -13.110  -1.045   0.943
  375   HG23  THR  49          HG23      THR  49 -11.718  -0.375   1.789
  376    H    ASP  50           HN       ASP  50 -14.666   1.154  -3.141
  377    HA   ASP  50           HA       ASP  50 -13.798   3.871  -3.718
  378    HB2  ASP  50           HB2      ASP  50 -13.946   2.012  -5.418
  379    HB3  ASP  50           HB1      ASP  50 -15.701   2.061  -5.267
  380    H    GLY  51           HN       GLY  51 -15.285   3.869  -1.340
  381    HA2  GLY  51           HA2      GLY  51 -17.036   5.959  -1.601
  382    HA3  GLY  51           HA1      GLY  51 -18.051   4.538  -1.781
  383    H    ARG  52           HN       ARG  52 -17.316   2.792   0.044
  384    HA   ARG  52           HA       ARG  52 -18.683   3.663   2.299
  385    HB2  ARG  52           HB2      ARG  52 -16.951   1.198   1.880
  386    HB3  ARG  52           HB1      ARG  52 -17.864   1.468   3.361
  387    HG2  ARG  52           HG2      ARG  52 -19.966   1.565   2.003
  388    HG3  ARG  52           HG1      ARG  52 -19.019   1.158   0.571
  389    HD2  ARG  52           HD2      ARG  52 -19.094  -0.628   3.028
  390    HD3  ARG  52           HD1      ARG  52 -20.285  -0.756   1.733
  391    HE   ARG  52           HE       ARG  52 -17.446  -0.982   1.015
  392   HH11  ARG  52          HH11      ARG  52 -20.021  -4.059   0.659
  393   HH12  ARG  52          HH12      ARG  52 -20.515  -2.623   1.493
  394   HH21  ARG  52          HH21      ARG  52 -17.911  -4.204  -0.246
  395   HH22  ARG  52          HH22      ARG  52 -16.811  -2.871  -0.090
  396    H    VAL  53           HN       VAL  53 -15.181   3.172   1.926
  397    HA   VAL  53           HA       VAL  53 -14.604   5.139   3.983
  398    HB   VAL  53           HB       VAL  53 -14.839   3.137   5.392
  399   HG11  VAL  53          HG11      VAL  53 -13.533   1.089   5.061
  400   HG12  VAL  53          HG12      VAL  53 -12.813   1.767   3.597
  401   HG13  VAL  53          HG13      VAL  53 -14.546   1.419   3.651
  402   HG21  VAL  53          HG21      VAL  53 -11.884   3.775   5.022
  403   HG22  VAL  53          HG22      VAL  53 -12.602   3.013   6.443
  404   HG23  VAL  53          HG23      VAL  53 -13.019   4.676   6.032
  405    H    GLU  54           HN       GLU  54 -12.548   6.088   3.642
  406    HA   GLU  54           HA       GLU  54 -11.103   5.248   1.209
  407    HB2  GLU  54           HB2      GLU  54 -11.778   7.609   1.356
  408    HB3  GLU  54           HB1      GLU  54 -10.913   7.799   2.876
  409    HG2  GLU  54           HG2      GLU  54  -8.777   7.536   1.784
  410    HG3  GLU  54           HG1      GLU  54  -9.550   7.068   0.264
  411    H    CYS  55           HN       CYS  55  -9.102   4.385   1.283
  412    HA   CYS  55           HA       CYS  55  -8.270   3.222   3.759
  413    HB2  CYS  55           HB2      CYS  55  -8.207   2.047   1.558
  414    HB3  CYS  55           HB1      CYS  55  -6.881   3.089   1.058
  415    H    ARG  56           HN       ARG  56  -6.336   3.492   4.879
  416    HA   ARG  56           HA       ARG  56  -4.859   6.020   4.380
  417    HB2  ARG  56           HB2      ARG  56  -5.283   4.655   7.083
  418    HB3  ARG  56           HB1      ARG  56  -4.589   6.249   6.792
  419    HG2  ARG  56           HG2      ARG  56  -7.488   5.410   6.428
  420    HG3  ARG  56           HG1      ARG  56  -6.840   6.539   7.622
  421    HD2  ARG  56           HD2      ARG  56  -6.247   8.111   5.823
  422    HD3  ARG  56           HD1      ARG  56  -6.833   6.967   4.611
  423    HE   ARG  56           HE       ARG  56  -8.906   7.566   6.437
  424   HH11  ARG  56          HH11      ARG  56  -8.401  10.059   3.315
  425   HH12  ARG  56          HH12      ARG  56  -7.108   9.011   3.802
  426   HH21  ARG  56          HH21      ARG  56 -10.618   8.944   5.791
  427   HH22  ARG  56          HH22      ARG  56 -10.397  10.020   4.449
  428    H    GLU  57           HN       GLU  57  -2.922   5.557   3.547
  429    HA   GLU  57           HA       GLU  57  -1.402   3.198   4.482
  430    HB2  GLU  57           HB2      GLU  57   0.036   3.601   2.453
  431    HB3  GLU  57           HB1      GLU  57  -1.637   3.199   2.083
  432    HG2  GLU  57           HG2      GLU  57  -2.138   5.562   1.642
  433    HG3  GLU  57           HG1      GLU  57  -0.470   5.998   2.045
  434    H    LEU  58           HN       LEU  58   0.899   3.480   4.871
  435    HA   LEU  58           HA       LEU  58   1.466   5.902   6.359
  436    HB2  LEU  58           HB2      LEU  58   2.982   3.305   5.956
  437    HB3  LEU  58           HB1      LEU  58   3.630   4.654   6.884
  438    HG   LEU  58           HG       LEU  58   1.046   3.193   7.567
  439   HD11  LEU  58          HD11      LEU  58   2.290   2.124   9.397
  440   HD12  LEU  58          HD12      LEU  58   3.785   2.875   8.829
  441   HD13  LEU  58          HD13      LEU  58   2.957   1.684   7.825
  442   HD21  LEU  58          HD21      LEU  58   2.629   5.256   9.149
  443   HD22  LEU  58          HD22      LEU  58   1.209   4.383   9.732
  444   HD23  LEU  58          HD23      LEU  58   1.056   5.506   8.384
  445    H    ARG  59           HN       ARG  59   2.131   7.598   5.247
  446    HA   ARG  59           HA       ARG  59   2.722   7.463   2.499
  447    HB2  ARG  59           HB2      ARG  59   3.245   9.869   4.292
  448    HB3  ARG  59           HB1      ARG  59   2.966   9.858   2.540
  449    HG2  ARG  59           HG2      ARG  59   0.614   9.014   3.031
  450    HG3  ARG  59           HG1      ARG  59   0.954   9.275   4.749
  451    HD2  ARG  59           HD2      ARG  59   0.793  11.349   2.541
  452    HD3  ARG  59           HD1      ARG  59  -0.192  11.232   4.005
  453    HE   ARG  59           HE       ARG  59   2.310  11.537   4.987
  454   HH11  ARG  59          HH11      ARG  59   1.303  14.938   3.098
  455   HH12  ARG  59          HH12      ARG  59   0.481  13.469   2.677
  456   HH21  ARG  59          HH21      ARG  59   2.966  14.909   4.697
  457   HH22  ARG  59          HH22      ARG  59   3.393  13.421   5.482
  458    HA   PRO  60           HA       PRO  60   7.061   6.743   2.354
  459    HB2  PRO  60           HB2      PRO  60   7.896   8.244   0.211
  460    HB3  PRO  60           HB1      PRO  60   6.896   6.782   0.028
  461    HG2  PRO  60           HG2      PRO  60   6.042   9.668   0.075
  462    HG3  PRO  60           HG1      PRO  60   5.596   8.361  -1.029
  463    HD2  PRO  60           HD2      PRO  60   3.948   9.084   1.003
  464    HD3  PRO  60           HD1      PRO  60   4.100   7.380   0.469
  465    H    ASP  61           HN       ASP  61   7.666   7.572   4.239
  466    HA   ASP  61           HA       ASP  61   8.090  10.283   4.942
  467    HB2  ASP  61           HB2      ASP  61   7.611   8.570   6.627
  468    HB3  ASP  61           HB1      ASP  61   9.102   7.717   6.230
  469    H    VAL  62           HN       VAL  62   9.854  11.544   4.899
  470    HA   VAL  62           HA       VAL  62  11.744  12.486   4.142
  471    HB   VAL  62           HB       VAL  62  13.033   9.747   4.659
  472   HG11  VAL  62          HG11      VAL  62  14.328  12.505   4.655
  473   HG12  VAL  62          HG12      VAL  62  14.563  11.250   3.440
  474   HG13  VAL  62          HG13      VAL  62  15.135  10.997   5.089
  475   HG21  VAL  62          HG21      VAL  62  12.652  12.061   6.602
  476   HG22  VAL  62          HG22      VAL  62  13.522  10.563   6.941
  477   HG23  VAL  62          HG23      VAL  62  11.788  10.521   6.638
  478    H    PHE  63           HN       PHE  63   9.888  11.329   2.295
  479    HA   PHE  63           HA       PHE  63  11.487  11.179  -0.144
  480    HB2  PHE  63           HB2      PHE  63  11.216   8.784   0.720
  481    HB3  PHE  63           HB1      PHE  63   9.477   8.970   0.535
  482    HD1  PHE  63           HD1      PHE  63  12.696   8.726  -1.290
  483    HD2  PHE  63           HD2      PHE  63   8.436   8.811  -1.691
  484    HE1  PHE  63           HE1      PHE  63  12.894   7.971  -3.621
  485    HE2  PHE  63           HE2      PHE  63   8.648   8.052  -4.020
  486    HZ   PHE  63           HZ       PHE  63  10.872   7.633  -4.992
  487    H    GLY  64           HN       GLY  64  10.140  11.617  -2.067
  488    HA2  GLY  64           HA2      GLY  64   7.641  12.008  -2.675
  489    HA3  GLY  64           HA1      GLY  64   7.722  13.222  -1.400
  490    H    ALA  65           HN       ALA  65  10.663  13.536  -2.385
  491    HA   ALA  65           HA       ALA  65  10.202  15.706  -4.205
  492    HB1  ALA  65           HB1      ALA  65  12.808  14.411  -3.323
  493    HB2  ALA  65           HB2      ALA  65  12.036  15.822  -2.597
  494    HB3  ALA  65           HB3      ALA  65  12.670  15.915  -4.239
  Start of MODEL   16
    1    H1   MET   1           HT1      MET   1 -15.740  -0.948  11.607
    2    H2   MET   1           HT2      MET   1 -15.387   0.449  10.725
    3    H3   MET   1           HT3      MET   1 -14.321  -0.087  11.913
    4    HA   MET   1           HA       MET   1 -13.802  -2.044  10.667
    5    HB2  MET   1           HB2      MET   1 -15.834  -0.916   8.708
    6    HB3  MET   1           HB1      MET   1 -14.647  -2.118   8.227
    7    HG2  MET   1           HG2      MET   1 -15.579  -3.701   9.849
    8    HG3  MET   1           HG1      MET   1 -16.782  -2.496  10.335
    9    HE1  MET   1           HE1      MET   1 -17.276  -5.579   9.113
   10    HE2  MET   1           HE2      MET   1 -18.719  -5.264   8.153
   11    HE3  MET   1           HE3      MET   1 -18.567  -4.578   9.771
   12    H    ASN   2           HN       ASN   2 -12.096  -2.066   9.136
   13    HA   ASN   2           HA       ASN   2 -11.062   0.598   8.347
   14    HB2  ASN   2           HB2      ASN   2  -8.810  -0.532   8.273
   15    HB3  ASN   2           HB1      ASN   2  -9.523  -0.434   9.869
   16   HD21  ASN   2          HD21      ASN   2 -10.076  -2.335  10.932
   17   HD22  ASN   2          HD22      ASN   2  -9.575  -3.883  10.358
   18    H    ALA   3           HN       ALA   3  -9.975   0.785   6.379
   19    HA   ALA   3           HA       ALA   3 -11.332   0.031   4.129
   20    HB1  ALA   3           HB1      ALA   3  -9.795   1.937   4.250
   21    HB2  ALA   3           HB2      ALA   3  -9.446   0.923   2.851
   22    HB3  ALA   3           HB3      ALA   3  -8.414   0.834   4.281
   23    H    ILE   4           HN       ILE   4  -8.570  -1.599   5.576
   24    HA   ILE   4           HA       ILE   4  -7.862  -3.275   3.403
   25    HB   ILE   4           HB       ILE   4  -7.427  -3.870   6.360
   26   HG12  ILE   4          HG12      ILE   4  -5.031  -2.930   5.820
   27   HG13  ILE   4          HG11      ILE   4  -5.817  -2.115   4.479
   28   HG21  ILE   4          HG21      ILE   4  -7.048  -5.824   4.924
   29   HG22  ILE   4          HG22      ILE   4  -5.535  -5.258   5.625
   30   HG23  ILE   4          HG23      ILE   4  -5.912  -4.896   3.940
   31   HD11  ILE   4          HD11      ILE   4  -6.477  -1.752   7.407
   32   HD12  ILE   4          HD12      ILE   4  -7.231  -0.889   6.064
   33   HD13  ILE   4          HD13      ILE   4  -5.516  -0.661   6.410
   34    H    ASP   5           HN       ASP   5 -10.021  -3.634   6.178
   35    HA   ASP   5           HA       ASP   5 -10.857  -6.315   5.702
   36    HB2  ASP   5           HB2      ASP   5 -11.006  -5.247   7.931
   37    HB3  ASP   5           HB1      ASP   5 -12.227  -4.133   7.326
   38    H    ILE   6           HN       ILE   6 -12.097  -3.179   4.710
   39    HA   ILE   6           HA       ILE   6 -14.606  -4.083   3.682
   40    HB   ILE   6           HB       ILE   6 -13.014  -1.569   2.989
   41   HG12  ILE   6          HG12      ILE   6 -13.451  -1.559   5.348
   42   HG13  ILE   6          HG11      ILE   6 -14.613  -0.461   4.627
   43   HG21  ILE   6          HG21      ILE   6 -14.714  -1.988   1.269
   44   HG22  ILE   6          HG22      ILE   6 -15.157  -0.587   2.242
   45   HG23  ILE   6          HG23      ILE   6 -15.967  -2.133   2.504
   46   HD11  ILE   6          HD11      ILE   6 -16.337  -2.235   4.812
   47   HD12  ILE   6          HD12      ILE   6 -15.658  -1.743   6.360
   48   HD13  ILE   6          HD13      ILE   6 -15.149  -3.259   5.624
   49    H    ALA   7           HN       ALA   7 -11.356  -3.829   2.379
   50    HA   ALA   7           HA       ALA   7 -12.026  -4.471  -0.342
   51    HB1  ALA   7           HB1      ALA   7  -9.620  -4.702  -0.670
   52    HB2  ALA   7           HB2      ALA   7  -9.354  -4.655   1.081
   53    HB3  ALA   7           HB3      ALA   7  -9.986  -3.235   0.244
   54    H    ILE   8           HN       ILE   8 -11.169  -6.361   2.531
   55    HA   ILE   8           HA       ILE   8 -10.903  -8.945   1.385
   56    HB   ILE   8           HB       ILE   8 -12.041  -8.141   4.117
   57   HG12  ILE   8          HG12      ILE   8  -9.237  -9.113   3.416
   58   HG13  ILE   8          HG11      ILE   8  -9.673  -7.428   3.651
   59   HG21  ILE   8          HG21      ILE   8 -11.566 -10.455   4.865
   60   HG22  ILE   8          HG22      ILE   8 -11.111 -10.897   3.218
   61   HG23  ILE   8          HG23      ILE   8 -12.772 -10.424   3.578
   62   HD11  ILE   8          HD11      ILE   8  -8.584  -8.296   5.596
   63   HD12  ILE   8          HD12      ILE   8  -9.764  -9.598   5.729
   64   HD13  ILE   8          HD13      ILE   8 -10.265  -7.924   5.979
   65    H    ASN   9           HN       ASN   9 -13.697  -7.128   2.566
   66    HA   ASN   9           HA       ASN   9 -15.638  -9.196   2.139
   67    HB2  ASN   9           HB2      ASN   9 -15.911  -6.221   2.738
   68    HB3  ASN   9           HB1      ASN   9 -17.291  -7.305   2.593
   69   HD21  ASN   9          HD21      ASN   9 -14.206  -8.153   4.178
   70   HD22  ASN   9          HD22      ASN   9 -14.864  -8.264   5.759
   71    H    LYS  10           HN       LYS  10 -14.382  -6.527   0.239
   72    HA   LYS  10           HA       LYS  10 -16.443  -6.505  -1.765
   73    HB2  LYS  10           HB2      LYS  10 -14.917  -4.545  -1.135
   74    HB3  LYS  10           HB1      LYS  10 -13.615  -5.327  -2.019
   75    HG2  LYS  10           HG2      LYS  10 -16.242  -4.692  -3.405
   76    HG3  LYS  10           HG1      LYS  10 -15.032  -3.433  -3.161
   77    HD2  LYS  10           HD2      LYS  10 -13.365  -4.826  -4.375
   78    HD3  LYS  10           HD1      LYS  10 -14.619  -6.038  -4.668
   79    HE2  LYS  10           HE2      LYS  10 -15.928  -4.333  -5.929
   80    HE3  LYS  10           HE1      LYS  10 -14.618  -3.175  -5.680
   81    HZ1  LYS  10           HZ1      LYS  10 -14.415  -5.743  -7.173
   82    HZ2  LYS  10           HZ2      LYS  10 -13.135  -4.673  -6.902
   83    HZ3  LYS  10           HZ3      LYS  10 -14.450  -4.193  -7.851
   84    H    LEU  11           HN       LEU  11 -13.104  -7.825  -1.620
   85    HA   LEU  11           HA       LEU  11 -13.331  -9.063  -4.242
   86    HB2  LEU  11           HB2      LEU  11 -11.118  -9.398  -2.174
   87    HB3  LEU  11           HB1      LEU  11 -11.067  -9.944  -3.838
   88    HG   LEU  11           HG       LEU  11 -10.837  -7.120  -2.776
   89   HD11  LEU  11          HD11      LEU  11  -8.834  -7.054  -4.220
   90   HD12  LEU  11          HD12      LEU  11  -9.152  -8.710  -4.741
   91   HD13  LEU  11          HD13      LEU  11  -8.762  -8.374  -3.056
   92   HD21  LEU  11          HD21      LEU  11 -11.476  -7.800  -5.662
   93   HD22  LEU  11          HD22      LEU  11 -11.012  -6.211  -5.037
   94   HD23  LEU  11          HD23      LEU  11 -12.524  -6.946  -4.525
   95    H    GLY  12           HN       GLY  12 -14.196  -9.961  -1.056
   96    HA2  GLY  12           HA2      GLY  12 -15.672 -11.818  -0.764
   97    HA3  GLY  12           HA1      GLY  12 -14.772 -12.720  -1.974
   98    H    SER  13           HN       SER  13 -12.104 -12.035  -0.883
   99    HA   SER  13           HA       SER  13 -12.041 -13.258   1.764
  100    HB2  SER  13           HB2      SER  13 -10.688 -15.207   1.056
  101    HB3  SER  13           HB1      SER  13 -12.255 -15.215   0.248
  102    HG   SER  13           HG       SER  13 -11.281 -15.052  -1.593
  103    H    VAL  14           HN       VAL  14  -9.757 -13.670   2.472
  104    HA   VAL  14           HA       VAL  14  -8.049 -11.380   2.011
  105    HB   VAL  14           HB       VAL  14  -7.981 -13.730   3.958
  106   HG11  VAL  14          HG11      VAL  14  -5.619 -13.297   3.403
  107   HG12  VAL  14          HG12      VAL  14  -5.979 -12.762   5.041
  108   HG13  VAL  14          HG13      VAL  14  -5.839 -11.579   3.739
  109   HG21  VAL  14          HG21      VAL  14  -9.532 -11.929   4.474
  110   HG22  VAL  14          HG22      VAL  14  -8.240 -10.728   4.307
  111   HG23  VAL  14          HG23      VAL  14  -8.199 -11.909   5.634
  112    H    SER  15           HN       SER  15  -8.131 -14.802   1.169
  113    HA   SER  15           HA       SER  15  -5.457 -14.986   0.203
  114    HB2  SER  15           HB2      SER  15  -6.384 -17.033  -1.030
  115    HB3  SER  15           HB1      SER  15  -6.595 -17.031   0.723
  116    HG   SER  15           HG       SER  15  -8.527 -16.480  -1.282
  117    H    ALA  16           HN       ALA  16  -8.534 -14.010  -1.249
  118    HA   ALA  16           HA       ALA  16  -7.506 -13.593  -3.916
  119    HB1  ALA  16           HB1      ALA  16 -10.045 -12.524  -2.626
  120    HB2  ALA  16           HB2      ALA  16  -9.901 -14.040  -3.519
  121    HB3  ALA  16           HB3      ALA  16  -9.670 -12.501  -4.351
  122    H    LEU  17           HN       LEU  17  -8.045 -11.552  -1.039
  123    HA   LEU  17           HA       LEU  17  -7.504  -9.056  -2.269
  124    HB2  LEU  17           HB2      LEU  17  -8.692  -9.206  -0.104
  125    HB3  LEU  17           HB1      LEU  17  -7.236  -9.830   0.663
  126    HG   LEU  17           HG       LEU  17  -6.077  -7.714   0.290
  127   HD11  LEU  17          HD11      LEU  17  -7.239  -5.711  -0.573
  128   HD12  LEU  17          HD12      LEU  17  -8.645  -6.698  -0.980
  129   HD13  LEU  17          HD13      LEU  17  -7.103  -6.969  -1.797
  130   HD21  LEU  17          HD21      LEU  17  -8.743  -7.255   1.621
  131   HD22  LEU  17          HD22      LEU  17  -7.284  -6.277   1.825
  132   HD23  LEU  17          HD23      LEU  17  -7.298  -7.957   2.357
  133    H    ALA  18           HN       ALA  18  -5.468 -11.274  -0.439
  134    HA   ALA  18           HA       ALA  18  -3.096  -9.713  -0.429
  135    HB1  ALA  18           HB1      ALA  18  -3.599 -11.485   1.211
  136    HB2  ALA  18           HB2      ALA  18  -2.036 -11.737   0.434
  137    HB3  ALA  18           HB3      ALA  18  -3.428 -12.710  -0.052
  138    H    ALA  19           HN       ALA  19  -4.358 -12.245  -2.570
  139    HA   ALA  19           HA       ALA  19  -2.102 -12.554  -4.257
  140    HB1  ALA  19           HB1      ALA  19  -3.695 -13.511  -5.877
  141    HB2  ALA  19           HB2      ALA  19  -5.050 -12.880  -4.932
  142    HB3  ALA  19           HB3      ALA  19  -3.996 -14.117  -4.248
  143    H    ALA  20           HN       ALA  20  -4.825 -10.295  -4.294
  144    HA   ALA  20           HA       ALA  20  -4.216  -8.998  -6.773
  145    HB1  ALA  20           HB1      ALA  20  -5.951  -8.049  -4.467
  146    HB2  ALA  20           HB2      ALA  20  -6.486  -9.029  -5.834
  147    HB3  ALA  20           HB3      ALA  20  -5.937  -7.373  -6.099
  148    H    LEU  21           HN       LEU  21  -3.388  -8.393  -3.399
  149    HA   LEU  21           HA       LEU  21  -2.158  -5.799  -3.908
  150    HB2  LEU  21           HB2      LEU  21  -2.423  -7.483  -1.387
  151    HB3  LEU  21           HB1      LEU  21  -1.644  -5.908  -1.423
  152    HG   LEU  21           HG       LEU  21  -4.570  -6.415  -2.103
  153   HD11  LEU  21          HD11      LEU  21  -3.324  -5.259   0.404
  154   HD12  LEU  21          HD12      LEU  21  -4.282  -6.737   0.247
  155   HD13  LEU  21          HD13      LEU  21  -5.048  -5.170   0.004
  156   HD21  LEU  21          HD21      LEU  21  -3.049  -3.815  -1.850
  157   HD22  LEU  21          HD22      LEU  21  -4.795  -3.977  -2.090
  158   HD23  LEU  21          HD23      LEU  21  -3.680  -4.529  -3.335
  159    H    GLY  22           HN       GLY  22  -1.187  -9.044  -4.043
  160    HA2  GLY  22           HA2      GLY  22   0.830 -10.049  -4.506
  161    HA3  GLY  22           HA1      GLY  22   1.515  -8.446  -4.739
  162    H    VAL  23           HN       VAL  23   0.030  -9.913  -1.889
  163    HA   VAL  23           HA       VAL  23   2.540  -9.920  -0.354
  164    HB   VAL  23           HB       VAL  23   1.439  -8.839   1.597
  165   HG11  VAL  23          HG11      VAL  23   2.686  -7.394   0.017
  166   HG12  VAL  23          HG12      VAL  23   1.374  -6.527   0.804
  167   HG13  VAL  23          HG13      VAL  23   1.191  -7.068  -0.865
  168   HG21  VAL  23          HG21      VAL  23  -0.967  -8.397  -0.227
  169   HG22  VAL  23          HG22      VAL  23  -0.786  -7.738   1.401
  170   HG23  VAL  23          HG23      VAL  23  -0.909  -9.480   1.168
  171    H    ASN  24           HN       ASN  24   2.008 -10.966   1.905
  172    HA   ASN  24           HA       ASN  24   0.681 -13.506   1.481
  173    HB2  ASN  24           HB2      ASN  24   2.137 -12.290   3.849
  174    HB3  ASN  24           HB1      ASN  24   1.251 -13.801   4.003
  175   HD21  ASN  24          HD21      ASN  24   2.839 -15.194   4.307
  176   HD22  ASN  24          HD22      ASN  24   4.142 -15.491   3.205
  177    H    GLN  25           HN       GLN  25  -0.820 -14.339   3.102
  178    HA   GLN  25           HA       GLN  25  -3.140 -12.674   3.449
  179    HB2  GLN  25           HB2      GLN  25  -2.554 -15.516   4.418
  180    HB3  GLN  25           HB1      GLN  25  -4.104 -14.715   4.616
  181    HG2  GLN  25           HG2      GLN  25  -4.377 -16.126   2.753
  182    HG3  GLN  25           HG1      GLN  25  -4.179 -14.512   2.069
  183   HE21  GLN  25          HE21      GLN  25  -2.272 -14.067   0.869
  184   HE22  GLN  25          HE22      GLN  25  -1.234 -15.323   0.308
  185    H    SER  26           HN       SER  26  -0.431 -13.644   5.434
  186    HA   SER  26           HA       SER  26  -1.471 -12.808   7.978
  187    HB2  SER  26           HB2      SER  26   0.401 -14.430   7.750
  188    HB3  SER  26           HB1      SER  26   1.423 -13.165   7.073
  189    HG   SER  26           HG       SER  26   1.318 -13.766   9.550
  190    H    ALA  27           HN       ALA  27   0.210 -11.200   5.336
  191    HA   ALA  27           HA       ALA  27   0.895  -8.760   6.613
  192    HB1  ALA  27           HB1      ALA  27   0.291  -9.268   3.675
  193    HB2  ALA  27           HB2      ALA  27   1.866  -9.437   4.453
  194    HB3  ALA  27           HB3      ALA  27   1.109  -7.847   4.330
  195    H    ILE  28           HN       ILE  28  -1.965  -9.873   4.866
  196    HA   ILE  28           HA       ILE  28  -3.460  -7.459   4.894
  197    HB   ILE  28           HB       ILE  28  -4.504 -10.337   4.864
  198   HG12  ILE  28          HG12      ILE  28  -2.907  -9.972   3.028
  199   HG13  ILE  28          HG11      ILE  28  -4.543 -10.118   2.397
  200   HG21  ILE  28          HG21      ILE  28  -6.278  -8.712   5.366
  201   HG22  ILE  28          HG22      ILE  28  -6.494  -9.401   3.760
  202   HG23  ILE  28          HG23      ILE  28  -5.841  -7.771   3.934
  203   HD11  ILE  28          HD11      ILE  28  -4.651  -7.674   2.167
  204   HD12  ILE  28          HD12      ILE  28  -3.336  -8.394   1.242
  205   HD13  ILE  28          HD13      ILE  28  -2.989  -7.560   2.756
  206    H    SER  29           HN       SER  29  -3.435 -10.284   7.039
  207    HA   SER  29           HA       SER  29  -5.366  -9.510   8.913
  208    HB2  SER  29           HB2      SER  29  -4.445 -11.790   8.756
  209    HB3  SER  29           HB1      SER  29  -2.867 -11.217   9.288
  210    HG   SER  29           HG       SER  29  -3.564 -11.609  11.216
  211    H    GLN  30           HN       GLN  30  -1.928  -8.780   8.693
  212    HA   GLN  30           HA       GLN  30  -1.533  -7.516  11.203
  213    HB2  GLN  30           HB2      GLN  30   0.204  -8.516   9.606
  214    HB3  GLN  30           HB1      GLN  30   0.028  -7.088   8.602
  215    HG2  GLN  30           HG2      GLN  30   0.778  -6.723  11.491
  216    HG3  GLN  30           HG1      GLN  30   1.992  -7.354  10.387
  217   HE21  GLN  30          HE21      GLN  30   3.298  -5.533  10.679
  218   HE22  GLN  30          HE22      GLN  30   2.929  -3.999   9.972
  219    H    TRP  31           HN       TRP  31  -2.043  -6.203   7.921
  220    HA   TRP  31           HA       TRP  31  -2.019  -3.463   8.590
  221    HB2  TRP  31           HB2      TRP  31  -3.322  -4.860   6.223
  222    HB3  TRP  31           HB1      TRP  31  -3.073  -3.120   6.353
  223    HD1  TRP  31           HD1      TRP  31   0.080  -3.806   7.587
  224    HE1  TRP  31           HE1      TRP  31   1.854  -4.204   5.762
  225    HE3  TRP  31           HE3      TRP  31  -3.015  -4.863   3.659
  226    HZ2  TRP  31           HZ2      TRP  31   1.920  -4.871   3.018
  227    HZ3  TRP  31           HZ3      TRP  31  -2.029  -5.351   1.479
  228    HH2  TRP  31           HH2      TRP  31   0.378  -5.350   1.164
  229    H    ARG  32           HN       ARG  32  -4.606  -5.829   8.394
  230    HA   ARG  32           HA       ARG  32  -6.801  -4.030   8.571
  231    HB2  ARG  32           HB2      ARG  32  -7.162  -6.263   7.653
  232    HB3  ARG  32           HB1      ARG  32  -6.598  -7.030   9.138
  233    HG2  ARG  32           HG2      ARG  32  -8.537  -6.216  10.358
  234    HG3  ARG  32           HG1      ARG  32  -9.082  -5.278   8.967
  235    HD2  ARG  32           HD2      ARG  32 -10.394  -7.318   9.208
  236    HD3  ARG  32           HD1      ARG  32  -9.456  -7.364   7.716
  237    HE   ARG  32           HE       ARG  32  -7.967  -8.667   9.699
  238   HH11  ARG  32          HH11      ARG  32 -10.944 -10.854   8.061
  239   HH12  ARG  32          HH12      ARG  32 -10.988  -9.120   7.954
  240   HH21  ARG  32          HH21      ARG  32  -7.897 -10.955   9.864
  241   HH22  ARG  32          HH22      ARG  32  -9.166 -11.904   9.160
  242    H    ALA  33           HN       ALA  33  -4.924  -5.913  10.899
  243    HA   ALA  33           HA       ALA  33  -6.499  -5.295  13.168
  244    HB1  ALA  33           HB1      ALA  33  -5.015  -7.245  13.098
  245    HB2  ALA  33           HB2      ALA  33  -4.625  -6.217  14.478
  246    HB3  ALA  33           HB3      ALA  33  -3.601  -6.191  13.039
  247    H    ARG  34           HN       ARG  34  -3.879  -3.643  11.528
  248    HA   ARG  34           HA       ARG  34  -3.412  -1.666  13.592
  249    HB2  ARG  34           HB2      ARG  34  -1.648  -2.414  11.952
  250    HB3  ARG  34           HB1      ARG  34  -2.598  -1.729  10.641
  251    HG2  ARG  34           HG2      ARG  34  -1.053  -0.063  11.012
  252    HG3  ARG  34           HG1      ARG  34  -2.395   0.509  11.986
  253    HD2  ARG  34           HD2      ARG  34   0.131  -0.864  12.960
  254    HD3  ARG  34           HD1      ARG  34  -0.354   0.811  13.232
  255    HE   ARG  34           HE       ARG  34  -2.124   0.007  14.693
  256   HH11  ARG  34          HH11      ARG  34   0.052  -3.330  15.334
  257   HH12  ARG  34          HH12      ARG  34   0.381  -2.352  13.942
  258   HH21  ARG  34          HH21      ARG  34  -1.629  -2.742  16.790
  259   HH22  ARG  34          HH22      ARG  34  -2.576  -1.314  16.497
  260    H    GLY  35           HN       GLY  35  -5.339  -2.048  10.719
  261    HA2  GLY  35           HA2      GLY  35  -7.052  -0.828   9.787
  262    HA3  GLY  35           HA1      GLY  35  -6.931   0.328  11.111
  263    H    ARG  36           HN       ARG  36  -4.214  -0.655   9.096
  264    HA   ARG  36           HA       ARG  36  -4.075   1.768   7.521
  265    HB2  ARG  36           HB2      ARG  36  -3.460   2.387   9.972
  266    HB3  ARG  36           HB1      ARG  36  -2.007   1.436   9.743
  267    HG2  ARG  36           HG2      ARG  36  -1.266   2.958   7.969
  268    HG3  ARG  36           HG1      ARG  36  -2.773   3.876   8.101
  269    HD2  ARG  36           HD2      ARG  36  -0.600   3.599  10.209
  270    HD3  ARG  36           HD1      ARG  36  -1.065   5.061   9.337
  271    HE   ARG  36           HE       ARG  36  -3.256   4.906  10.522
  272   HH11  ARG  36          HH11      ARG  36  -0.437   3.396  11.994
  273   HH12  ARG  36          HH12      ARG  36  -1.074   3.486  13.601
  274   HH21  ARG  36          HH21      ARG  36  -4.109   4.980  12.654
  275   HH22  ARG  36          HH22      ARG  36  -3.153   4.382  13.977
  276    H    VAL  37           HN       VAL  37  -2.446   1.603   5.946
  277    HA   VAL  37           HA       VAL  37  -0.879  -0.928   5.835
  278    HB   VAL  37           HB       VAL  37  -1.003  -0.758   3.343
  279   HG11  VAL  37          HG11      VAL  37  -3.349  -1.450   3.081
  280   HG12  VAL  37          HG12      VAL  37  -3.721  -0.825   4.689
  281   HG13  VAL  37          HG13      VAL  37  -2.610  -2.182   4.502
  282   HG21  VAL  37          HG21      VAL  37  -2.942   1.535   3.828
  283   HG22  VAL  37          HG22      VAL  37  -2.609   0.780   2.266
  284   HG23  VAL  37          HG23      VAL  37  -1.335   1.661   3.106
  285    HA   PRO  38           HA       PRO  38   2.956   1.474   5.118
  286    HB2  PRO  38           HB2      PRO  38   3.474  -0.454   2.837
  287    HB3  PRO  38           HB1      PRO  38   4.503  -0.040   4.226
  288    HG2  PRO  38           HG2      PRO  38   3.250  -2.366   4.154
  289    HG3  PRO  38           HG1      PRO  38   3.354  -1.452   5.680
  290    HD2  PRO  38           HD2      PRO  38   1.031  -1.677   3.766
  291    HD3  PRO  38           HD1      PRO  38   1.045  -1.754   5.543
  292    H    ALA  39           HN       ALA  39   4.143   2.578   3.309
  293    HA   ALA  39           HA       ALA  39   2.392   4.371   2.060
  294    HB1  ALA  39           HB1      ALA  39   4.649   4.980   2.783
  295    HB2  ALA  39           HB2      ALA  39   4.419   5.357   1.076
  296    HB3  ALA  39           HB3      ALA  39   5.351   3.934   1.546
  297    H    GLY  40           HN       GLY  40   1.165   3.946   0.284
  298    HA2  GLY  40           HA2      GLY  40   1.172   4.040  -2.125
  299    HA3  GLY  40           HA1      GLY  40   2.454   2.841  -2.147
  300    H    ARG  41           HN       ARG  41   0.664   1.467   0.087
  301    HA   ARG  41           HA       ARG  41  -0.479  -0.362  -1.855
  302    HB2  ARG  41           HB2      ARG  41   0.805  -1.125   0.188
  303    HB3  ARG  41           HB1      ARG  41  -0.540  -0.590   1.185
  304    HG2  ARG  41           HG2      ARG  41  -0.884  -2.899   0.974
  305    HG3  ARG  41           HG1      ARG  41  -2.000  -2.226  -0.208
  306    HD2  ARG  41           HD2      ARG  41   0.721  -3.458  -0.774
  307    HD3  ARG  41           HD1      ARG  41  -0.847  -4.195  -1.098
  308    HE   ARG  41           HE       ARG  41  -1.061  -2.017  -2.621
  309   HH11  ARG  41          HH11      ARG  41   2.261  -3.942  -3.884
  310   HH12  ARG  41          HH12      ARG  41   1.683  -4.226  -2.275
  311   HH21  ARG  41          HH21      ARG  41   1.186  -2.511  -5.265
  312   HH22  ARG  41          HH22      ARG  41  -0.238  -1.668  -4.741
  313    H    CYS  42           HN       CYS  42  -1.715   2.137   0.215
  314    HA   CYS  42           HA       CYS  42  -4.402   1.296   0.514
  315    HB2  CYS  42           HB2      CYS  42  -3.695   3.090   1.897
  316    HB3  CYS  42           HB1      CYS  42  -3.120   4.034   0.531
  317    H    ILE  43           HN       ILE  43  -2.702   2.746  -2.170
  318    HA   ILE  43           HA       ILE  43  -4.722   3.840  -3.742
  319    HB   ILE  43           HB       ILE  43  -2.190   2.325  -4.539
  320   HG12  ILE  43          HG12      ILE  43  -1.763   4.336  -3.184
  321   HG13  ILE  43          HG11      ILE  43  -1.187   4.571  -4.828
  322   HG21  ILE  43          HG21      ILE  43  -3.905   4.058  -6.352
  323   HG22  ILE  43          HG22      ILE  43  -3.663   2.314  -6.477
  324   HG23  ILE  43          HG23      ILE  43  -2.311   3.409  -6.753
  325   HD11  ILE  43          HD11      ILE  43  -3.183   5.937  -5.311
  326   HD12  ILE  43          HD12      ILE  43  -2.221   6.585  -3.985
  327   HD13  ILE  43          HD13      ILE  43  -3.720   5.722  -3.642
  328    H    ASP  44           HN       ASP  44  -3.630   0.462  -3.532
  329    HA   ASP  44           HA       ASP  44  -5.345  -0.559  -5.613
  330    HB2  ASP  44           HB2      ASP  44  -3.974  -2.184  -3.426
  331    HB3  ASP  44           HB1      ASP  44  -4.431  -2.719  -5.040
  332    H    ILE  45           HN       ILE  45  -5.321  -0.711  -2.072
  333    HA   ILE  45           HA       ILE  45  -7.739  -2.105  -1.693
  334    HB   ILE  45           HB       ILE  45  -6.201  -0.223   0.161
  335   HG12  ILE  45          HG12      ILE  45  -6.370  -3.278  -0.032
  336   HG13  ILE  45          HG11      ILE  45  -4.970  -2.274  -0.391
  337   HG21  ILE  45          HG21      ILE  45  -8.516  -2.033   0.930
  338   HG22  ILE  45          HG22      ILE  45  -8.566  -0.270   0.874
  339   HG23  ILE  45          HG23      ILE  45  -7.524  -1.081   2.039
  340   HD11  ILE  45          HD11      ILE  45  -4.650  -3.386   1.704
  341   HD12  ILE  45          HD12      ILE  45  -6.184  -2.784   2.333
  342   HD13  ILE  45          HD13      ILE  45  -4.853  -1.662   2.013
  343    H    GLU  46           HN       GLU  46  -7.094   1.232  -2.458
  344    HA   GLU  46           HA       GLU  46  -9.590   2.387  -1.673
  345    HB2  GLU  46           HB2      GLU  46  -7.389   3.604  -1.967
  346    HB3  GLU  46           HB1      GLU  46  -7.568   3.448  -3.704
  347    HG2  GLU  46           HG2      GLU  46  -9.635   4.847  -2.003
  348    HG3  GLU  46           HG1      GLU  46  -8.197   5.684  -2.566
  349    H    LEU  47           HN       LEU  47  -8.335   0.928  -4.663
  350    HA   LEU  47           HA       LEU  47 -10.486   1.267  -6.419
  351    HB2  LEU  47           HB2      LEU  47  -8.781  -1.208  -5.952
  352    HB3  LEU  47           HB1      LEU  47  -9.889  -1.056  -7.300
  353    HG   LEU  47           HG       LEU  47  -7.590   0.896  -6.923
  354   HD11  LEU  47          HD11      LEU  47  -6.625  -1.368  -6.983
  355   HD12  LEU  47          HD12      LEU  47  -6.247  -0.474  -8.450
  356   HD13  LEU  47          HD13      LEU  47  -7.500  -1.721  -8.476
  357   HD21  LEU  47          HD21      LEU  47  -9.191   0.048  -9.364
  358   HD22  LEU  47          HD22      LEU  47  -7.879   1.234  -9.345
  359   HD23  LEU  47          HD23      LEU  47  -9.376   1.567  -8.480
  360    H    TYR  48           HN       TYR  48 -10.028  -1.079  -3.792
  361    HA   TYR  48           HA       TYR  48 -12.592  -2.409  -4.348
  362    HB2  TYR  48           HB2      TYR  48 -10.815  -3.116  -1.991
  363    HB3  TYR  48           HB1      TYR  48 -11.861  -4.170  -2.952
  364    HD1  TYR  48           HD1      TYR  48  -8.676  -4.185  -2.129
  365    HD2  TYR  48           HD2      TYR  48 -10.860  -3.494  -5.737
  366    HE1  TYR  48           HE1      TYR  48  -6.705  -4.830  -3.454
  367    HE2  TYR  48           HE2      TYR  48  -8.889  -4.124  -7.054
  368    HH   TYR  48           HH       TYR  48  -6.439  -4.227  -6.776
  369    H    THR  49           HN       THR  49 -11.550   0.191  -2.405
  370    HA   THR  49           HA       THR  49 -13.965   0.016  -0.675
  371    HB   THR  49           HB       THR  49 -12.808   1.542   0.888
  372    HG1  THR  49           HG1      THR  49 -11.463   2.590  -0.715
  373   HG21  THR  49          HG21      THR  49 -11.049  -0.829   0.159
  374   HG22  THR  49          HG22      THR  49 -12.468  -0.887   1.204
  375   HG23  THR  49          HG23      THR  49 -11.050   0.030   1.703
  376    H    ASP  50           HN       ASP  50 -14.490   0.710  -3.121
  377    HA   ASP  50           HA       ASP  50 -13.987   2.832  -4.557
  378    HB2  ASP  50           HB2      ASP  50 -16.803   1.856  -3.942
  379    HB3  ASP  50           HB1      ASP  50 -16.397   2.879  -5.312
  380    H    GLY  51           HN       GLY  51 -16.469   3.188  -1.988
  381    HA2  GLY  51           HA2      GLY  51 -15.469   5.796  -1.214
  382    HA3  GLY  51           HA1      GLY  51 -17.031   5.852  -2.029
  383    H    ARG  52           HN       ARG  52 -15.907   3.253   0.036
  384    HA   ARG  52           HA       ARG  52 -18.382   3.418   1.612
  385    HB2  ARG  52           HB2      ARG  52 -16.291   1.198   1.430
  386    HB3  ARG  52           HB1      ARG  52 -17.868   1.082   2.217
  387    HG2  ARG  52           HG2      ARG  52 -18.986   1.427   0.059
  388    HG3  ARG  52           HG1      ARG  52 -17.417   1.580  -0.732
  389    HD2  ARG  52           HD2      ARG  52 -16.907  -0.780  -0.066
  390    HD3  ARG  52           HD1      ARG  52 -18.550  -0.901   0.585
  391    HE   ARG  52           HE       ARG  52 -19.427  -0.583  -1.622
  392   HH11  ARG  52          HH11      ARG  52 -15.906  -1.711  -3.199
  393   HH12  ARG  52          HH12      ARG  52 -15.970  -1.237  -1.535
  394   HH21  ARG  52          HH21      ARG  52 -17.780  -1.628  -4.487
  395   HH22  ARG  52          HH22      ARG  52 -19.285  -1.082  -3.821
  396    H    VAL  53           HN       VAL  53 -14.924   3.739   1.962
  397    HA   VAL  53           HA       VAL  53 -15.108   4.480   4.774
  398    HB   VAL  53           HB       VAL  53 -14.933   1.988   4.834
  399   HG11  VAL  53          HG11      VAL  53 -13.769   1.631   2.728
  400   HG12  VAL  53          HG12      VAL  53 -12.919   0.837   4.049
  401   HG13  VAL  53          HG13      VAL  53 -12.294   2.347   3.389
  402   HG21  VAL  53          HG21      VAL  53 -13.945   3.243   6.707
  403   HG22  VAL  53          HG22      VAL  53 -12.399   3.324   5.862
  404   HG23  VAL  53          HG23      VAL  53 -13.037   1.765   6.393
  405    H    GLU  54           HN       GLU  54 -13.140   5.484   5.535
  406    HA   GLU  54           HA       GLU  54 -11.550   6.791   3.515
  407    HB2  GLU  54           HB2      GLU  54 -12.240   7.960   5.583
  408    HB3  GLU  54           HB1      GLU  54 -11.323   6.819   6.557
  409    HG2  GLU  54           HG2      GLU  54 -10.165   8.979   6.316
  410    HG3  GLU  54           HG1      GLU  54  -9.231   7.645   5.652
  411    H    CYS  55           HN       CYS  55  -9.975   5.722   2.504
  412    HA   CYS  55           HA       CYS  55  -8.506   3.532   3.770
  413    HB2  CYS  55           HB2      CYS  55  -9.227   3.203   1.458
  414    HB3  CYS  55           HB1      CYS  55  -8.384   4.663   0.946
  415    H    ARG  56           HN       ARG  56  -6.653   3.885   4.869
  416    HA   ARG  56           HA       ARG  56  -5.042   6.301   4.250
  417    HB2  ARG  56           HB2      ARG  56  -4.370   6.372   6.645
  418    HB3  ARG  56           HB1      ARG  56  -6.067   6.696   6.375
  419    HG2  ARG  56           HG2      ARG  56  -5.325   3.877   7.084
  420    HG3  ARG  56           HG1      ARG  56  -5.199   5.092   8.354
  421    HD2  ARG  56           HD2      ARG  56  -7.698   4.505   6.726
  422    HD3  ARG  56           HD1      ARG  56  -7.390   3.971   8.383
  423    HE   ARG  56           HE       ARG  56  -7.084   6.736   8.348
  424   HH11  ARG  56          HH11      ARG  56 -10.936   5.572   8.398
  425   HH12  ARG  56          HH12      ARG  56  -9.727   4.460   7.855
  426   HH21  ARG  56          HH21      ARG  56  -8.694   8.193   9.003
  427   HH22  ARG  56          HH22      ARG  56 -10.349   7.689   9.050
  428    H    GLU  57           HN       GLU  57  -2.945   6.113   4.041
  429    HA   GLU  57           HA       GLU  57  -1.534   3.599   4.709
  430    HB2  GLU  57           HB2      GLU  57   0.008   4.128   2.771
  431    HB3  GLU  57           HB1      GLU  57  -1.619   3.682   2.282
  432    HG2  GLU  57           HG2      GLU  57  -2.171   6.026   1.873
  433    HG3  GLU  57           HG1      GLU  57  -0.586   6.526   2.455
  434    H    LEU  58           HN       LEU  58   0.782   3.962   5.059
  435    HA   LEU  58           HA       LEU  58   1.336   6.282   6.684
  436    HB2  LEU  58           HB2      LEU  58   2.936   3.809   5.946
  437    HB3  LEU  58           HB1      LEU  58   3.565   5.064   7.007
  438    HG   LEU  58           HG       LEU  58   0.933   3.702   7.652
  439   HD11  LEU  58          HD11      LEU  58   2.067   2.091   9.068
  440   HD12  LEU  58          HD12      LEU  58   3.645   2.667   8.508
  441   HD13  LEU  58          HD13      LEU  58   2.533   1.884   7.381
  442   HD21  LEU  58          HD21      LEU  58   1.443   5.745   8.865
  443   HD22  LEU  58          HD22      LEU  58   2.997   5.088   9.382
  444   HD23  LEU  58          HD23      LEU  58   1.493   4.358   9.949
  445    H    ARG  59           HN       ARG  59   3.118   7.740   6.318
  446    HA   ARG  59           HA       ARG  59   3.424   8.689   3.684
  447    HB2  ARG  59           HB2      ARG  59   5.019  10.291   4.535
  448    HB3  ARG  59           HB1      ARG  59   3.721  10.131   5.711
  449    HG2  ARG  59           HG2      ARG  59   6.409   8.755   5.984
  450    HG3  ARG  59           HG1      ARG  59   6.055  10.335   6.676
  451    HD2  ARG  59           HD2      ARG  59   4.255   9.308   8.047
  452    HD3  ARG  59           HD1      ARG  59   4.650   7.732   7.353
  453    HE   ARG  59           HE       ARG  59   6.994   8.772   8.460
  454   HH11  ARG  59          HH11      ARG  59   4.494   7.098  11.141
  455   HH12  ARG  59          HH12      ARG  59   3.867   7.605   9.606
  456   HH21  ARG  59          HH21      ARG  59   7.783   8.101  10.479
  457   HH22  ARG  59          HH22      ARG  59   6.712   7.382  11.633
  458    HA   PRO  60           HA       PRO  60   6.654   6.324   1.783
  459    HB2  PRO  60           HB2      PRO  60   8.449   8.216   0.801
  460    HB3  PRO  60           HB1      PRO  60   6.893   7.819   0.041
  461    HG2  PRO  60           HG2      PRO  60   7.559  10.075   1.893
  462    HG3  PRO  60           HG1      PRO  60   6.620  10.065   0.395
  463    HD2  PRO  60           HD2      PRO  60   5.374  10.098   2.767
  464    HD3  PRO  60           HD1      PRO  60   4.726   9.143   1.403
  465    H    ASP  61           HN       ASP  61   7.809   5.163   3.036
  466    HA   ASP  61           HA       ASP  61   9.490   5.985   5.204
  467    HB2  ASP  61           HB2      ASP  61   8.364   3.844   5.357
  468    HB3  ASP  61           HB1      ASP  61   9.084   3.287   3.852
  469    H    VAL  62           HN       VAL  62  10.708   3.747   2.726
  470    HA   VAL  62           HA       VAL  62  12.937   5.593   2.084
  471    HB   VAL  62           HB       VAL  62  14.111   3.556   1.176
  472   HG11  VAL  62          HG11      VAL  62  14.654   4.386   3.419
  473   HG12  VAL  62          HG12      VAL  62  14.772   2.628   3.368
  474   HG13  VAL  62          HG13      VAL  62  13.372   3.397   4.120
  475   HG21  VAL  62          HG21      VAL  62  12.163   2.117   0.751
  476   HG22  VAL  62          HG22      VAL  62  11.833   2.010   2.481
  477   HG23  VAL  62          HG23      VAL  62  13.306   1.296   1.817
  478    H    PHE  63           HN       PHE  63  10.095   5.421   1.104
  479    HA   PHE  63           HA       PHE  63  10.430   5.033  -1.790
  480    HB2  PHE  63           HB2      PHE  63   7.938   5.880  -0.226
  481    HB3  PHE  63           HB1      PHE  63   7.998   5.352  -1.901
  482    HD1  PHE  63           HD1      PHE  63   8.203   4.246   1.634
  483    HD2  PHE  63           HD2      PHE  63   8.029   2.982  -2.450
  484    HE1  PHE  63           HE1      PHE  63   7.743   1.942   2.361
  485    HE2  PHE  63           HE2      PHE  63   7.573   0.685  -1.711
  486    HZ   PHE  63           HZ       PHE  63   7.434   0.160   0.690
  487    H    GLY  64           HN       GLY  64   9.112   6.915  -3.006
  488    HA2  GLY  64           HA2      GLY  64   8.683   9.459  -2.323
  489    HA3  GLY  64           HA1      GLY  64  10.443   9.450  -2.390
  490    H    ALA  65           HN       ALA  65  10.044   7.303  -4.569
  491    HA   ALA  65           HA       ALA  65  10.523   8.834  -6.817
  492    HB1  ALA  65           HB1      ALA  65  11.165   6.473  -6.629
  493    HB2  ALA  65           HB2      ALA  65  10.253   6.756  -8.107
  494    HB3  ALA  65           HB3      ALA  65   9.466   5.981  -6.733
  Start of MODEL   17
    1    H1   MET   1           HT1      MET   1 -15.703  -1.574  11.588
    2    H2   MET   1           HT2      MET   1 -15.501  -0.172  10.662
    3    H3   MET   1           HT3      MET   1 -14.340  -0.598  11.806
    4    HA   MET   1           HA       MET   1 -13.745  -2.548  10.579
    5    HB2  MET   1           HB2      MET   1 -15.849  -1.566   8.591
    6    HB3  MET   1           HB1      MET   1 -14.685  -2.841   8.241
    7    HG2  MET   1           HG2      MET   1 -15.644  -4.223  10.036
    8    HG3  MET   1           HG1      MET   1 -16.811  -2.948  10.400
    9    HE1  MET   1           HE1      MET   1 -19.089  -2.978   7.195
   10    HE2  MET   1           HE2      MET   1 -17.739  -1.897   7.532
   11    HE3  MET   1           HE3      MET   1 -18.874  -2.317   8.816
   12    H    ASN   2           HN       ASN   2 -11.930  -2.343   9.270
   13    HA   ASN   2           HA       ASN   2 -11.094   0.376   8.544
   14    HB2  ASN   2           HB2      ASN   2  -9.603  -2.275   8.388
   15    HB3  ASN   2           HB1      ASN   2  -8.892  -0.691   8.096
   16   HD21  ASN   2          HD21      ASN   2  -8.404  -2.832  10.179
   17   HD22  ASN   2          HD22      ASN   2  -8.457  -1.995  11.685
   18    H    ALA   3           HN       ALA   3 -10.244   0.830   6.440
   19    HA   ALA   3           HA       ALA   3 -11.727   0.106   4.221
   20    HB1  ALA   3           HB1      ALA   3 -10.415   2.171   4.366
   21    HB2  ALA   3           HB2      ALA   3 -10.005   1.272   2.902
   22    HB3  ALA   3           HB3      ALA   3  -8.914   1.247   4.295
   23    H    ILE   4           HN       ILE   4  -8.692  -1.170   5.415
   24    HA   ILE   4           HA       ILE   4  -8.059  -2.908   3.284
   25    HB   ILE   4           HB       ILE   4  -7.383  -3.469   6.198
   26   HG12  ILE   4          HG12      ILE   4  -5.084  -2.381   5.496
   27   HG13  ILE   4          HG11      ILE   4  -6.036  -1.573   4.262
   28   HG21  ILE   4          HG21      ILE   4  -5.462  -4.746   5.308
   29   HG22  ILE   4          HG22      ILE   4  -5.977  -4.377   3.660
   30   HG23  ILE   4          HG23      ILE   4  -6.992  -5.382   4.697
   31   HD11  ILE   4          HD11      ILE   4  -5.662  -0.168   6.197
   32   HD12  ILE   4          HD12      ILE   4  -6.445  -1.354   7.244
   33   HD13  ILE   4          HD13      ILE   4  -7.380  -0.510   6.004
   34    H    ASP   5           HN       ASP   5 -10.003  -3.317   6.231
   35    HA   ASP   5           HA       ASP   5 -10.680  -6.061   5.985
   36    HB2  ASP   5           HB2      ASP   5 -10.871  -4.537   8.049
   37    HB3  ASP   5           HB1      ASP   5 -12.360  -3.921   7.355
   38    H    ILE   6           HN       ILE   6 -12.242  -3.114   4.849
   39    HA   ILE   6           HA       ILE   6 -14.632  -4.288   3.842
   40    HB   ILE   6           HB       ILE   6 -13.239  -1.664   3.142
   41   HG12  ILE   6          HG12      ILE   6 -14.033  -1.815   5.487
   42   HG13  ILE   6          HG11      ILE   6 -14.934  -0.608   4.584
   43   HG21  ILE   6          HG21      ILE   6 -15.387  -0.917   2.124
   44   HG22  ILE   6          HG22      ILE   6 -16.037  -2.548   2.319
   45   HG23  ILE   6          HG23      ILE   6 -14.665  -2.268   1.246
   46   HD11  ILE   6          HD11      ILE   6 -16.388  -1.858   6.057
   47   HD12  ILE   6          HD12      ILE   6 -15.901  -3.376   5.305
   48   HD13  ILE   6          HD13      ILE   6 -16.812  -2.182   4.376
   49    H    ALA   7           HN       ALA   7 -11.461  -3.615   2.442
   50    HA   ALA   7           HA       ALA   7 -12.031  -4.402  -0.239
   51    HB1  ALA   7           HB1      ALA   7  -9.347  -4.314   1.166
   52    HB2  ALA   7           HB2      ALA   7 -10.120  -2.953   0.349
   53    HB3  ALA   7           HB3      ALA   7  -9.621  -4.371  -0.588
   54    H    ILE   8           HN       ILE   8 -10.918  -6.156   2.615
   55    HA   ILE   8           HA       ILE   8 -10.313  -8.674   1.533
   56    HB   ILE   8           HB       ILE   8 -11.599  -7.926   4.194
   57   HG12  ILE   8          HG12      ILE   8  -8.731  -8.759   3.593
   58   HG13  ILE   8          HG11      ILE   8  -9.261  -7.092   3.736
   59   HG21  ILE   8          HG21      ILE   8 -11.016 -10.183   5.035
   60   HG22  ILE   8          HG22      ILE   8 -10.507 -10.651   3.411
   61   HG23  ILE   8          HG23      ILE   8 -12.197 -10.252   3.725
   62   HD11  ILE   8          HD11      ILE   8  -9.238  -9.167   5.905
   63   HD12  ILE   8          HD12      ILE   8  -9.888  -7.536   6.082
   64   HD13  ILE   8          HD13      ILE   8  -8.174  -7.772   5.739
   65    H    ASN   9           HN       ASN   9 -13.382  -7.434   2.791
   66    HA   ASN   9           HA       ASN   9 -14.935  -9.716   2.024
   67    HB2  ASN   9           HB2      ASN   9 -15.794  -6.937   2.931
   68    HB3  ASN   9           HB1      ASN   9 -16.860  -8.338   2.805
   69   HD21  ASN   9          HD21      ASN   9 -16.062  -6.680   5.159
   70   HD22  ASN   9          HD22      ASN   9 -15.444  -7.803   6.313
   71    H    LYS  10           HN       LYS  10 -13.972  -6.785   0.401
   72    HA   LYS  10           HA       LYS  10 -16.061  -6.776  -1.588
   73    HB2  LYS  10           HB2      LYS  10 -14.834  -4.702  -0.915
   74    HB3  LYS  10           HB1      LYS  10 -13.363  -5.329  -1.651
   75    HG2  LYS  10           HG2      LYS  10 -15.846  -5.049  -3.349
   76    HG3  LYS  10           HG1      LYS  10 -14.933  -3.603  -2.921
   77    HD2  LYS  10           HD2      LYS  10 -12.898  -4.597  -3.917
   78    HD3  LYS  10           HD1      LYS  10 -13.808  -6.035  -4.368
   79    HE2  LYS  10           HE2      LYS  10 -14.449  -3.249  -5.358
   80    HE3  LYS  10           HE1      LYS  10 -13.421  -4.386  -6.227
   81    HZ1  LYS  10           HZ1      LYS  10 -16.267  -4.738  -5.550
   82    HZ2  LYS  10           HZ2      LYS  10 -15.305  -5.929  -6.250
   83    HZ3  LYS  10           HZ3      LYS  10 -15.608  -4.490  -7.079
   84    H    LEU  11           HN       LEU  11 -12.657  -7.885  -1.497
   85    HA   LEU  11           HA       LEU  11 -12.884  -9.101  -4.133
   86    HB2  LEU  11           HB2      LEU  11 -10.609  -9.333  -2.137
   87    HB3  LEU  11           HB1      LEU  11 -10.586  -9.927  -3.794
   88    HG   LEU  11           HG       LEU  11 -10.415  -7.066  -2.791
   89   HD11  LEU  11          HD11      LEU  11  -8.512  -6.940  -4.353
   90   HD12  LEU  11          HD12      LEU  11  -8.790  -8.622  -4.812
   91   HD13  LEU  11          HD13      LEU  11  -8.324  -8.224  -3.164
   92   HD21  LEU  11          HD21      LEU  11 -11.134  -7.772  -5.655
   93   HD22  LEU  11          HD22      LEU  11 -10.757  -6.166  -5.016
   94   HD23  LEU  11          HD23      LEU  11 -12.204  -7.003  -4.479
   95    H    GLY  12           HN       GLY  12 -13.906  -9.972  -1.074
   96    HA2  GLY  12           HA2      GLY  12 -15.384 -11.844  -0.870
   97    HA3  GLY  12           HA1      GLY  12 -14.388 -12.745  -2.003
   98    H    SER  13           HN       SER  13 -11.862 -11.908  -0.621
   99    HA   SER  13           HA       SER  13 -11.933 -13.034   2.032
  100    HB2  SER  13           HB2      SER  13 -10.541 -15.048   1.475
  101    HB3  SER  13           HB1      SER  13 -12.155 -15.112   0.753
  102    HG   SER  13           HG       SER  13 -10.308 -15.652  -0.652
  103    H    VAL  14           HN       VAL  14  -9.652 -13.432   2.846
  104    HA   VAL  14           HA       VAL  14  -7.915 -11.217   2.255
  105    HB   VAL  14           HB       VAL  14  -7.908 -13.477   4.279
  106   HG11  VAL  14          HG11      VAL  14  -5.553 -13.446   3.555
  107   HG12  VAL  14          HG12      VAL  14  -5.704 -12.783   5.181
  108   HG13  VAL  14          HG13      VAL  14  -5.477 -11.702   3.802
  109   HG21  VAL  14          HG21      VAL  14  -7.722 -10.447   4.443
  110   HG22  VAL  14          HG22      VAL  14  -7.670 -11.528   5.855
  111   HG23  VAL  14          HG23      VAL  14  -9.115 -11.463   4.848
  112    H    SER  15           HN       SER  15  -8.010 -14.656   1.479
  113    HA   SER  15           HA       SER  15  -5.438 -14.931   0.387
  114    HB2  SER  15           HB2      SER  15  -6.473 -16.855  -0.911
  115    HB3  SER  15           HB1      SER  15  -6.763 -16.908   0.828
  116    HG   SER  15           HG       SER  15  -8.702 -17.287  -0.133
  117    H    ALA  16           HN       ALA  16  -8.514 -13.892  -0.988
  118    HA   ALA  16           HA       ALA  16  -7.624 -13.485  -3.669
  119    HB1  ALA  16           HB1      ALA  16 -10.053 -12.354  -2.227
  120    HB2  ALA  16           HB2      ALA  16  -9.991 -13.878  -3.114
  121    HB3  ALA  16           HB3      ALA  16  -9.795 -12.353  -3.978
  122    H    LEU  17           HN       LEU  17  -8.016 -11.343  -0.834
  123    HA   LEU  17           HA       LEU  17  -7.402  -8.924  -2.176
  124    HB2  LEU  17           HB2      LEU  17  -8.603  -8.956  -0.010
  125    HB3  LEU  17           HB1      LEU  17  -7.143  -9.512   0.799
  126    HG   LEU  17           HG       LEU  17  -5.994  -7.430   0.191
  127   HD11  LEU  17          HD11      LEU  17  -8.638  -6.524  -1.000
  128   HD12  LEU  17          HD12      LEU  17  -7.148  -6.850  -1.889
  129   HD13  LEU  17          HD13      LEU  17  -7.220  -5.494  -0.766
  130   HD21  LEU  17          HD21      LEU  17  -8.577  -6.892   1.639
  131   HD22  LEU  17          HD22      LEU  17  -7.133  -5.870   1.672
  132   HD23  LEU  17          HD23      LEU  17  -7.075  -7.504   2.334
  133    H    ALA  18           HN       ALA  18  -5.402 -11.236  -0.501
  134    HA   ALA  18           HA       ALA  18  -3.052  -9.618  -0.347
  135    HB1  ALA  18           HB1      ALA  18  -1.969 -11.637   0.520
  136    HB2  ALA  18           HB2      ALA  18  -3.364 -12.607   0.032
  137    HB3  ALA  18           HB3      ALA  18  -3.541 -11.380   1.288
  138    H    ALA  19           HN       ALA  19  -4.221 -12.154  -2.516
  139    HA   ALA  19           HA       ALA  19  -1.921 -12.446  -4.139
  140    HB1  ALA  19           HB1      ALA  19  -3.454 -13.495  -5.755
  141    HB2  ALA  19           HB2      ALA  19  -4.843 -12.873  -4.856
  142    HB3  ALA  19           HB3      ALA  19  -3.776 -14.069  -4.116
  143    H    ALA  20           HN       ALA  20  -4.609 -10.177  -4.142
  144    HA   ALA  20           HA       ALA  20  -4.024  -8.930  -6.677
  145    HB1  ALA  20           HB1      ALA  20  -5.814  -8.025  -4.401
  146    HB2  ALA  20           HB2      ALA  20  -6.309  -9.010  -5.779
  147    HB3  ALA  20           HB3      ALA  20  -5.790  -7.342  -6.031
  148    H    LEU  21           HN       LEU  21  -3.324  -8.224  -3.284
  149    HA   LEU  21           HA       LEU  21  -2.074  -5.649  -3.865
  150    HB2  LEU  21           HB2      LEU  21  -2.526  -7.161  -1.277
  151    HB3  LEU  21           HB1      LEU  21  -1.701  -5.608  -1.356
  152    HG   LEU  21           HG       LEU  21  -4.601  -6.108  -2.163
  153   HD11  LEU  21          HD11      LEU  21  -3.456  -4.753   0.283
  154   HD12  LEU  21          HD12      LEU  21  -4.422  -6.234   0.213
  155   HD13  LEU  21          HD13      LEU  21  -5.157  -4.685  -0.201
  156   HD21  LEU  21          HD21      LEU  21  -3.028  -3.513  -2.083
  157   HD22  LEU  21          HD22      LEU  21  -4.765  -3.650  -2.374
  158   HD23  LEU  21          HD23      LEU  21  -3.627  -4.332  -3.531
  159    H    GLY  22           HN       GLY  22  -1.102  -8.856  -3.875
  160    HA2  GLY  22           HA2      GLY  22   0.940  -9.788  -4.428
  161    HA3  GLY  22           HA1      GLY  22   1.640  -8.175  -4.439
  162    H    VAL  23           HN       VAL  23  -0.046  -9.312  -1.607
  163    HA   VAL  23           HA       VAL  23   2.518  -9.679  -0.143
  164    HB   VAL  23           HB       VAL  23   1.303  -8.810   1.900
  165   HG11  VAL  23          HG11      VAL  23   2.834  -7.352   0.652
  166   HG12  VAL  23          HG12      VAL  23   1.498  -6.430   1.342
  167   HG13  VAL  23          HG13      VAL  23   1.506  -6.817  -0.381
  168   HG21  VAL  23          HG21      VAL  23  -0.856  -7.982  -0.094
  169   HG22  VAL  23          HG22      VAL  23  -0.785  -7.500   1.604
  170   HG23  VAL  23          HG23      VAL  23  -1.027  -9.195   1.182
  171    H    ASN  24           HN       ASN  24   1.901 -10.704   2.110
  172    HA   ASN  24           HA       ASN  24   0.827 -13.340   1.599
  173    HB2  ASN  24           HB2      ASN  24   2.021 -12.021   4.057
  174    HB3  ASN  24           HB1      ASN  24   1.357 -13.652   4.099
  175   HD21  ASN  24          HD21      ASN  24   3.206 -14.669   4.514
  176   HD22  ASN  24          HD22      ASN  24   4.545 -14.771   3.417
  177    H    GLN  25           HN       GLN  25  -0.646 -14.348   3.094
  178    HA   GLN  25           HA       GLN  25  -3.098 -12.896   3.440
  179    HB2  GLN  25           HB2      GLN  25  -2.300 -15.718   4.304
  180    HB3  GLN  25           HB1      GLN  25  -3.919 -15.055   4.464
  181    HG2  GLN  25           HG2      GLN  25  -3.941 -16.451   2.547
  182    HG3  GLN  25           HG1      GLN  25  -4.005 -14.798   1.960
  183   HE21  GLN  25          HE21      GLN  25  -2.214 -13.981   0.800
  184   HE22  GLN  25          HE22      GLN  25  -0.969 -15.003   0.178
  185    H    SER  26           HN       SER  26  -0.423 -13.957   5.481
  186    HA   SER  26           HA       SER  26  -1.511 -13.160   8.003
  187    HB2  SER  26           HB2      SER  26   1.407 -13.394   7.142
  188    HB3  SER  26           HB1      SER  26   0.811 -13.369   8.808
  189    HG   SER  26           HG       SER  26  -0.440 -15.266   7.334
  190    H    ALA  27           HN       ALA  27   0.130 -11.467   5.390
  191    HA   ALA  27           HA       ALA  27   0.843  -9.075   6.785
  192    HB1  ALA  27           HB1      ALA  27   1.917  -9.761   4.674
  193    HB2  ALA  27           HB2      ALA  27   1.238  -8.136   4.548
  194    HB3  ALA  27           HB3      ALA  27   0.398  -9.507   3.814
  195    H    ILE  28           HN       ILE  28  -1.961  -9.970   4.777
  196    HA   ILE  28           HA       ILE  28  -3.309  -7.465   4.878
  197    HB   ILE  28           HB       ILE  28  -4.455 -10.258   4.485
  198   HG12  ILE  28          HG12      ILE  28  -2.769  -9.563   2.770
  199   HG13  ILE  28          HG11      ILE  28  -4.376  -9.804   2.097
  200   HG21  ILE  28          HG21      ILE  28  -6.236  -8.732   5.161
  201   HG22  ILE  28          HG22      ILE  28  -6.409  -9.127   3.452
  202   HG23  ILE  28          HG23      ILE  28  -5.744  -7.564   3.931
  203   HD11  ILE  28          HD11      ILE  28  -4.717  -7.381   2.063
  204   HD12  ILE  28          HD12      ILE  28  -3.301  -7.870   1.135
  205   HD13  ILE  28          HD13      ILE  28  -3.100  -7.154   2.732
  206    H    SER  29           HN       SER  29  -3.648 -10.436   6.784
  207    HA   SER  29           HA       SER  29  -5.669  -9.616   8.568
  208    HB2  SER  29           HB2      SER  29  -4.914 -11.972   8.220
  209    HB3  SER  29           HB1      SER  29  -3.400 -11.603   9.045
  210    HG   SER  29           HG       SER  29  -4.853 -12.526  10.487
  211    H    GLN  30           HN       GLN  30  -2.184  -9.219   8.623
  212    HA   GLN  30           HA       GLN  30  -1.826  -7.996  11.136
  213    HB2  GLN  30           HB2      GLN  30   0.043  -8.884   9.853
  214    HB3  GLN  30           HB1      GLN  30  -0.276  -7.774   8.531
  215    HG2  GLN  30           HG2      GLN  30   0.392  -5.873   9.947
  216    HG3  GLN  30           HG1      GLN  30   0.703  -6.976  11.293
  217   HE21  GLN  30          HE21      GLN  30   2.462  -8.451  11.115
  218   HE22  GLN  30          HE22      GLN  30   3.768  -8.178  10.019
  219    H    TRP  31           HN       TRP  31  -2.476  -6.637   7.901
  220    HA   TRP  31           HA       TRP  31  -2.418  -3.886   8.651
  221    HB2  TRP  31           HB2      TRP  31  -3.613  -5.279   6.238
  222    HB3  TRP  31           HB1      TRP  31  -3.533  -3.526   6.400
  223    HD1  TRP  31           HD1      TRP  31  -0.346  -4.180   7.753
  224    HE1  TRP  31           HE1      TRP  31   1.497  -4.256   5.978
  225    HE3  TRP  31           HE3      TRP  31  -3.229  -4.872   3.580
  226    HZ2  TRP  31           HZ2      TRP  31   1.718  -4.559   3.181
  227    HZ3  TRP  31           HZ3      TRP  31  -2.126  -5.029   1.403
  228    HH2  TRP  31           HH2      TRP  31   0.289  -4.877   1.198
  229    H    ARG  32           HN       ARG  32  -4.920  -6.319   8.726
  230    HA   ARG  32           HA       ARG  32  -7.168  -4.583   9.057
  231    HB2  ARG  32           HB2      ARG  32  -7.732  -6.776   8.339
  232    HB3  ARG  32           HB1      ARG  32  -6.667  -7.534   9.516
  233    HG2  ARG  32           HG2      ARG  32  -8.212  -6.879  11.337
  234    HG3  ARG  32           HG1      ARG  32  -9.301  -6.154  10.150
  235    HD2  ARG  32           HD2      ARG  32  -8.505  -9.076   9.962
  236    HD3  ARG  32           HD1      ARG  32  -9.807  -8.556  11.033
  237    HE   ARG  32           HE       ARG  32 -10.512  -7.438   8.680
  238   HH11  ARG  32          HH11      ARG  32 -10.724 -11.426   8.314
  239   HH12  ARG  32          HH12      ARG  32  -9.681 -10.733   9.507
  240   HH21  ARG  32          HH21      ARG  32 -12.019 -10.049   6.971
  241   HH22  ARG  32          HH22      ARG  32 -11.936  -8.332   7.169
  242    H    ALA  33           HN       ALA  33  -4.930  -6.268  11.241
  243    HA   ALA  33           HA       ALA  33  -6.249  -5.240  13.630
  244    HB1  ALA  33           HB1      ALA  33  -5.367  -7.542  13.621
  245    HB2  ALA  33           HB2      ALA  33  -4.582  -6.567  14.867
  246    HB3  ALA  33           HB3      ALA  33  -3.736  -6.921  13.357
  247    H    ARG  34           HN       ARG  34  -3.869  -4.139  11.486
  248    HA   ARG  34           HA       ARG  34  -2.509  -2.369  13.357
  249    HB2  ARG  34           HB2      ARG  34  -1.331  -3.491  11.429
  250    HB3  ARG  34           HB1      ARG  34  -2.350  -2.588  10.325
  251    HG2  ARG  34           HG2      ARG  34  -0.279  -1.475  10.374
  252    HG3  ARG  34           HG1      ARG  34  -1.391  -0.474  11.298
  253    HD2  ARG  34           HD2      ARG  34  -0.483  -1.305  13.398
  254    HD3  ARG  34           HD1      ARG  34   0.561  -2.441  12.537
  255    HE   ARG  34           HE       ARG  34   0.885   0.442  12.062
  256   HH11  ARG  34          HH11      ARG  34   2.177  -2.500  13.464
  257   HH12  ARG  34          HH12      ARG  34   3.762  -1.840  13.684
  258   HH21  ARG  34          HH21      ARG  34   2.977   1.285  12.365
  259   HH22  ARG  34          HH22      ARG  34   4.220   0.301  13.063
  260    H    GLY  35           HN       GLY  35  -4.942  -2.350  10.867
  261    HA2  GLY  35           HA2      GLY  35  -6.755  -0.931  10.604
  262    HA3  GLY  35           HA1      GLY  35  -6.035   0.223  11.712
  263    H    ARG  36           HN       ARG  36  -3.588  -0.517   9.675
  264    HA   ARG  36           HA       ARG  36  -4.220   1.343   7.519
  265    HB2  ARG  36           HB2      ARG  36  -2.271   2.820   8.055
  266    HB3  ARG  36           HB1      ARG  36  -3.488   2.868   9.321
  267    HG2  ARG  36           HG2      ARG  36  -2.075   1.162  10.582
  268    HG3  ARG  36           HG1      ARG  36  -0.813   1.450   9.385
  269    HD2  ARG  36           HD2      ARG  36  -0.383   2.783  11.382
  270    HD3  ARG  36           HD1      ARG  36  -0.776   3.838  10.026
  271    HE   ARG  36           HE       ARG  36  -2.857   4.345  11.005
  272   HH11  ARG  36          HH11      ARG  36  -1.020   2.222  13.062
  273   HH12  ARG  36          HH12      ARG  36  -1.950   2.571  14.475
  274   HH21  ARG  36          HH21      ARG  36  -4.030   4.860  12.888
  275   HH22  ARG  36          HH22      ARG  36  -3.654   4.063  14.378
  276    H    VAL  37           HN       VAL  37  -2.446   1.407   5.927
  277    HA   VAL  37           HA       VAL  37  -0.812  -1.076   5.919
  278    HB   VAL  37           HB       VAL  37  -0.861  -1.031   3.458
  279   HG11  VAL  37          HG11      VAL  37  -3.661  -0.834   4.596
  280   HG12  VAL  37          HG12      VAL  37  -2.628  -2.262   4.638
  281   HG13  VAL  37          HG13      VAL  37  -3.202  -1.639   3.091
  282   HG21  VAL  37          HG21      VAL  37  -2.682   1.395   3.687
  283   HG22  VAL  37          HG22      VAL  37  -2.307   0.529   2.193
  284   HG23  VAL  37          HG23      VAL  37  -1.032   1.387   3.060
  285    HA   PRO  38           HA       PRO  38   3.047   1.296   5.242
  286    HB2  PRO  38           HB2      PRO  38   3.430  -0.789   3.073
  287    HB3  PRO  38           HB1      PRO  38   4.565  -0.254   4.332
  288    HG2  PRO  38           HG2      PRO  38   3.358  -2.564   4.602
  289    HG3  PRO  38           HG1      PRO  38   3.503  -1.474   6.004
  290    HD2  PRO  38           HD2      PRO  38   1.109  -1.972   4.250
  291    HD3  PRO  38           HD1      PRO  38   1.197  -1.807   6.018
  292    H    ALA  39           HN       ALA  39   4.217   2.316   3.377
  293    HA   ALA  39           HA       ALA  39   2.541   4.085   2.031
  294    HB1  ALA  39           HB1      ALA  39   4.846   4.595   2.668
  295    HB2  ALA  39           HB2      ALA  39   4.600   4.886   0.947
  296    HB3  ALA  39           HB3      ALA  39   5.460   3.438   1.483
  297    H    GLY  40           HN       GLY  40   1.606   4.084   0.050
  298    HA2  GLY  40           HA2      GLY  40   1.095   3.675  -2.138
  299    HA3  GLY  40           HA1      GLY  40   2.645   2.856  -2.294
  300    H    ARG  41           HN       ARG  41  -0.546   2.319  -0.724
  301    HA   ARG  41           HA       ARG  41  -0.884  -0.209  -2.129
  302    HB2  ARG  41           HB2      ARG  41   0.520  -0.715  -0.060
  303    HB3  ARG  41           HB1      ARG  41  -0.847  -0.220   0.924
  304    HG2  ARG  41           HG2      ARG  41  -0.986  -2.572   0.873
  305    HG3  ARG  41           HG1      ARG  41  -2.188  -2.047  -0.308
  306    HD2  ARG  41           HD2      ARG  41   0.632  -2.948  -0.996
  307    HD3  ARG  41           HD1      ARG  41  -0.784  -3.990  -1.053
  308    HE   ARG  41           HE       ARG  41  -1.532  -2.010  -2.741
  309   HH11  ARG  41          HH11      ARG  41   1.508  -3.754  -2.536
  310   HH12  ARG  41          HH12      ARG  41   1.846  -3.630  -4.228
  311   HH21  ARG  41          HH21      ARG  41   0.378  -2.584  -5.601
  312   HH22  ARG  41          HH22      ARG  41  -1.079  -1.909  -4.969
  313    H    CYS  42           HN       CYS  42  -2.103   2.187   0.139
  314    HA   CYS  42           HA       CYS  42  -4.809   1.333   0.189
  315    HB2  CYS  42           HB2      CYS  42  -3.414   3.861   0.932
  316    HB3  CYS  42           HB1      CYS  42  -5.162   3.943   0.715
  317    H    ILE  43           HN       ILE  43  -3.004   2.881  -2.273
  318    HA   ILE  43           HA       ILE  43  -4.857   4.125  -3.909
  319    HB   ILE  43           HB       ILE  43  -2.657   2.189  -4.786
  320   HG12  ILE  43          HG12      ILE  43  -2.507   5.217  -4.409
  321   HG13  ILE  43          HG11      ILE  43  -1.824   4.032  -3.301
  322   HG21  ILE  43          HG21      ILE  43  -4.026   4.403  -6.380
  323   HG22  ILE  43          HG22      ILE  43  -4.215   2.666  -6.632
  324   HG23  ILE  43          HG23      ILE  43  -2.658   3.433  -6.938
  325   HD11  ILE  43          HD11      ILE  43  -0.988   4.490  -6.159
  326   HD12  ILE  43          HD12      ILE  43  -0.298   3.286  -5.065
  327   HD13  ILE  43          HD13      ILE  43  -0.127   5.004  -4.710
  328    H    ASP  44           HN       ASP  44  -3.997   0.659  -3.895
  329    HA   ASP  44           HA       ASP  44  -5.956  -0.197  -5.786
  330    HB2  ASP  44           HB2      ASP  44  -4.789  -2.022  -3.648
  331    HB3  ASP  44           HB1      ASP  44  -5.246  -2.412  -5.307
  332    H    ILE  45           HN       ILE  45  -5.768  -0.185  -2.269
  333    HA   ILE  45           HA       ILE  45  -8.099  -1.659  -1.723
  334    HB   ILE  45           HB       ILE  45  -6.583   0.310   0.043
  335   HG12  ILE  45          HG12      ILE  45  -6.496  -2.754  -0.123
  336   HG13  ILE  45          HG11      ILE  45  -5.216  -1.653  -0.631
  337   HG21  ILE  45          HG21      ILE  45  -8.685  -1.722   0.891
  338   HG22  ILE  45          HG22      ILE  45  -8.897   0.030   0.885
  339   HG23  ILE  45          HG23      ILE  45  -7.730  -0.712   1.977
  340   HD11  ILE  45          HD11      ILE  45  -4.955  -0.950   1.740
  341   HD12  ILE  45          HD12      ILE  45  -4.647  -2.664   1.470
  342   HD13  ILE  45          HD13      ILE  45  -6.172  -2.154   2.199
  343    H    GLU  46           HN       GLU  46  -7.675   1.815  -2.362
  344    HA   GLU  46           HA       GLU  46 -10.347   2.532  -1.569
  345    HB2  GLU  46           HB2      GLU  46  -8.302   4.058  -3.185
  346    HB3  GLU  46           HB1      GLU  46  -9.911   4.694  -2.841
  347    HG2  GLU  46           HG2      GLU  46  -9.440   4.485  -0.420
  348    HG3  GLU  46           HG1      GLU  46  -7.801   3.956  -0.794
  349    H    LEU  47           HN       LEU  47  -8.930   1.441  -4.648
  350    HA   LEU  47           HA       LEU  47 -11.295   1.741  -6.186
  351    HB2  LEU  47           HB2      LEU  47  -8.953  -0.157  -6.379
  352    HB3  LEU  47           HB1      LEU  47 -10.341  -0.371  -7.431
  353    HG   LEU  47           HG       LEU  47  -9.984   1.987  -8.258
  354   HD11  LEU  47          HD11      LEU  47  -7.330   1.830  -6.820
  355   HD12  LEU  47          HD12      LEU  47  -8.667   2.913  -6.425
  356   HD13  LEU  47          HD13      LEU  47  -7.826   3.081  -7.964
  357   HD21  LEU  47          HD21      LEU  47  -7.719   0.027  -8.750
  358   HD22  LEU  47          HD22      LEU  47  -8.150   1.389  -9.791
  359   HD23  LEU  47          HD23      LEU  47  -9.279   0.054  -9.581
  360    H    TYR  48           HN       TYR  48 -10.432  -0.521  -3.691
  361    HA   TYR  48           HA       TYR  48 -12.731  -2.271  -4.200
  362    HB2  TYR  48           HB2      TYR  48 -10.804  -2.403  -1.859
  363    HB3  TYR  48           HB1      TYR  48 -11.863  -3.691  -2.452
  364    HD1  TYR  48           HD1      TYR  48  -8.720  -3.662  -1.990
  365    HD2  TYR  48           HD2      TYR  48 -11.128  -3.255  -5.503
  366    HE1  TYR  48           HE1      TYR  48  -6.860  -4.459  -3.366
  367    HE2  TYR  48           HE2      TYR  48  -9.264  -4.055  -6.868
  368    HH   TYR  48           HH       TYR  48  -6.700  -4.080  -6.625
  369    H    THR  49           HN       THR  49 -11.894   0.453  -2.236
  370    HA   THR  49           HA       THR  49 -14.418   0.241  -0.678
  371    HB   THR  49           HB       THR  49 -13.340   1.652   1.036
  372    HG1  THR  49           HG1      THR  49 -11.871   2.908   0.068
  373   HG21  THR  49          HG21      THR  49 -11.533  -0.664   0.252
  374   HG22  THR  49          HG22      THR  49 -13.006  -0.781   1.218
  375   HG23  THR  49          HG23      THR  49 -11.621   0.108   1.838
  376    H    ASP  50           HN       ASP  50 -14.553   1.056  -3.238
  377    HA   ASP  50           HA       ASP  50 -13.820   3.330  -4.369
  378    HB2  ASP  50           HB2      ASP  50 -15.181   1.608  -5.459
  379    HB3  ASP  50           HB1      ASP  50 -16.599   2.115  -4.550
  380    H    GLY  51           HN       GLY  51 -16.893   3.268  -2.558
  381    HA2  GLY  51           HA2      GLY  51 -16.489   6.107  -1.765
  382    HA3  GLY  51           HA1      GLY  51 -18.032   5.585  -2.453
  383    H    ARG  52           HN       ARG  52 -16.251   3.384  -0.487
  384    HA   ARG  52           HA       ARG  52 -18.391   3.334   1.521
  385    HB2  ARG  52           HB2      ARG  52 -16.027   1.488   0.981
  386    HB3  ARG  52           HB1      ARG  52 -17.243   1.206   2.228
  387    HG2  ARG  52           HG2      ARG  52 -18.968   0.861   0.611
  388    HG3  ARG  52           HG1      ARG  52 -17.975   1.488  -0.703
  389    HD2  ARG  52           HD2      ARG  52 -16.498  -0.466  -0.551
  390    HD3  ARG  52           HD1      ARG  52 -17.422  -1.073   0.826
  391    HE   ARG  52           HE       ARG  52 -19.347  -1.290  -0.677
  392   HH11  ARG  52          HH11      ARG  52 -16.700  -2.020  -3.595
  393   HH12  ARG  52          HH12      ARG  52 -16.171  -1.200  -2.168
  394   HH21  ARG  52          HH21      ARG  52 -20.005  -2.330  -2.553
  395   HH22  ARG  52          HH22      ARG  52 -18.871  -2.663  -3.818
  396    H    VAL  53           HN       VAL  53 -14.821   3.420   1.456
  397    HA   VAL  53           HA       VAL  53 -14.685   5.162   3.770
  398    HB   VAL  53           HB       VAL  53 -14.907   3.098   5.014
  399   HG11  VAL  53          HG11      VAL  53 -13.541   1.087   4.645
  400   HG12  VAL  53          HG12      VAL  53 -12.770   1.855   3.254
  401   HG13  VAL  53          HG13      VAL  53 -14.498   1.484   3.211
  402   HG21  VAL  53          HG21      VAL  53 -13.138   4.587   5.883
  403   HG22  VAL  53          HG22      VAL  53 -11.933   3.749   4.904
  404   HG23  VAL  53          HG23      VAL  53 -12.752   2.895   6.214
  405    H    GLU  54           HN       GLU  54 -12.900   6.381   3.714
  406    HA   GLU  54           HA       GLU  54 -11.009   6.337   1.588
  407    HB2  GLU  54           HB2      GLU  54 -11.643   8.426   2.676
  408    HB3  GLU  54           HB1      GLU  54 -11.134   7.823   4.248
  409    HG2  GLU  54           HG2      GLU  54  -8.765   7.781   3.386
  410    HG3  GLU  54           HG1      GLU  54  -9.348   8.551   1.904
  411    H    CYS  55           HN       CYS  55  -9.180   5.055   1.458
  412    HA   CYS  55           HA       CYS  55  -8.400   3.455   3.758
  413    HB2  CYS  55           HB2      CYS  55  -8.385   2.503   1.439
  414    HB3  CYS  55           HB1      CYS  55  -7.009   3.535   1.061
  415    H    ARG  56           HN       ARG  56  -6.336   3.512   4.761
  416    HA   ARG  56           HA       ARG  56  -4.962   6.134   4.589
  417    HB2  ARG  56           HB2      ARG  56  -4.742   5.940   7.132
  418    HB3  ARG  56           HB1      ARG  56  -6.347   6.293   6.499
  419    HG2  ARG  56           HG2      ARG  56  -6.890   3.819   6.756
  420    HG3  ARG  56           HG1      ARG  56  -5.351   3.643   7.609
  421    HD2  ARG  56           HD2      ARG  56  -6.120   5.307   9.284
  422    HD3  ARG  56           HD1      ARG  56  -7.661   5.439   8.432
  423    HE   ARG  56           HE       ARG  56  -7.259   2.754   9.048
  424   HH11  ARG  56          HH11      ARG  56  -7.917   5.744  10.764
  425   HH12  ARG  56          HH12      ARG  56  -8.705   4.941  12.084
  426   HH21  ARG  56          HH21      ARG  56  -8.288   1.724  10.795
  427   HH22  ARG  56          HH22      ARG  56  -8.917   2.672  12.103
  428    H    GLU  57           HN       GLU  57  -2.972   5.829   3.923
  429    HA   GLU  57           HA       GLU  57  -1.403   3.471   4.817
  430    HB2  GLU  57           HB2      GLU  57  -0.027   3.782   2.755
  431    HB3  GLU  57           HB1      GLU  57  -1.708   3.381   2.410
  432    HG2  GLU  57           HG2      GLU  57  -2.206   5.691   1.833
  433    HG3  GLU  57           HG1      GLU  57  -0.575   6.185   2.310
  434    H    LEU  58           HN       LEU  58   0.911   3.876   4.987
  435    HA   LEU  58           HA       LEU  58   1.447   6.377   6.383
  436    HB2  LEU  58           HB2      LEU  58   3.100   3.849   6.076
  437    HB3  LEU  58           HB1      LEU  58   3.537   5.226   7.088
  438    HG   LEU  58           HG       LEU  58   1.072   3.467   7.470
  439   HD11  LEU  58          HD11      LEU  58   2.116   2.657   9.515
  440   HD12  LEU  58          HD12      LEU  58   3.565   3.617   9.186
  441   HD13  LEU  58          HD13      LEU  58   3.123   2.288   8.111
  442   HD21  LEU  58          HD21      LEU  58   0.576   5.765   8.154
  443   HD22  LEU  58          HD22      LEU  58   2.041   5.826   9.136
  444   HD23  LEU  58          HD23      LEU  58   0.724   4.739   9.579
  445    H    ARG  59           HN       ARG  59   3.390   7.636   5.962
  446    HA   ARG  59           HA       ARG  59   3.570   8.322   3.197
  447    HB2  ARG  59           HB2      ARG  59   5.136  10.057   3.855
  448    HB3  ARG  59           HB1      ARG  59   3.774  10.020   4.988
  449    HG2  ARG  59           HG2      ARG  59   5.138   8.928   6.685
  450    HG3  ARG  59           HG1      ARG  59   6.465   8.717   5.540
  451    HD2  ARG  59           HD2      ARG  59   5.428  11.352   6.629
  452    HD3  ARG  59           HD1      ARG  59   6.961  10.580   7.045
  453    HE   ARG  59           HE       ARG  59   6.332  12.122   4.679
  454   HH11  ARG  59          HH11      ARG  59   8.578   9.751   5.992
  455   HH12  ARG  59          HH12      ARG  59   9.817  10.136   4.847
  456   HH21  ARG  59          HH21      ARG  59   9.464  11.733   3.260
  457   HH22  ARG  59          HH22      ARG  59   7.948  12.567   3.192
  458    HA   PRO  60           HA       PRO  60   7.071   5.916   1.865
  459    HB2  PRO  60           HB2      PRO  60   8.381   7.555   0.118
  460    HB3  PRO  60           HB1      PRO  60   6.785   6.856  -0.245
  461    HG2  PRO  60           HG2      PRO  60   7.463   9.607   0.757
  462    HG3  PRO  60           HG1      PRO  60   6.332   9.101  -0.507
  463    HD2  PRO  60           HD2      PRO  60   5.508   9.719   2.042
  464    HD3  PRO  60           HD1      PRO  60   4.654   8.542   1.001
  465    H    ASP  61           HN       ASP  61   8.826   5.404   2.864
  466    HA   ASP  61           HA       ASP  61  10.131   6.932   4.875
  467    HB2  ASP  61           HB2      ASP  61  11.048   4.346   3.517
  468    HB3  ASP  61           HB1      ASP  61  11.722   5.013   5.004
  469    H    VAL  62           HN       VAL  62  11.527   5.555   1.864
  470    HA   VAL  62           HA       VAL  62  13.339   7.892   1.633
  471    HB   VAL  62           HB       VAL  62  15.156   6.377   0.836
  472   HG11  VAL  62          HG11      VAL  62  14.149   5.619   3.613
  473   HG12  VAL  62          HG12      VAL  62  15.136   7.029   3.221
  474   HG13  VAL  62          HG13      VAL  62  15.801   5.406   3.021
  475   HG21  VAL  62          HG21      VAL  62  13.786   4.502  -0.024
  476   HG22  VAL  62          HG22      VAL  62  13.287   4.089   1.620
  477   HG23  VAL  62          HG23      VAL  62  14.977   3.918   1.142
  478    H    PHE  63           HN       PHE  63  10.814   6.363   0.211
  479    HA   PHE  63           HA       PHE  63  11.652   6.359  -2.551
  480    HB2  PHE  63           HB2      PHE  63   9.851   4.877  -1.804
  481    HB3  PHE  63           HB1      PHE  63   8.885   6.253  -1.298
  482    HD1  PHE  63           HD1      PHE  63  10.329   4.567  -4.304
  483    HD2  PHE  63           HD2      PHE  63   7.419   7.351  -2.861
  484    HE1  PHE  63           HE1      PHE  63   9.280   4.628  -6.525
  485    HE2  PHE  63           HE2      PHE  63   6.376   7.406  -5.080
  486    HZ   PHE  63           HZ       PHE  63   7.301   6.047  -6.922
  487    H    GLY  64           HN       GLY  64  11.795   8.072  -3.887
  488    HA2  GLY  64           HA2      GLY  64  10.078  10.374  -3.787
  489    HA3  GLY  64           HA1      GLY  64  11.688  10.720  -3.159
  490    H    ALA  65           HN       ALA  65  13.446   9.595  -4.672
  491    HA   ALA  65           HA       ALA  65  12.822   9.754  -7.530
  492    HB1  ALA  65           HB1      ALA  65  14.674  11.304  -8.015
  493    HB2  ALA  65           HB2      ALA  65  14.977  11.507  -6.289
  494    HB3  ALA  65           HB3      ALA  65  13.459  12.074  -6.990
  Start of MODEL   18
    1    H1   MET   1           HT1      MET   1 -15.932  -1.739  11.097
    2    H2   MET   1           HT2      MET   1 -15.635  -0.201  10.466
    3    H3   MET   1           HT3      MET   1 -14.437  -0.992  11.350
    4    HA   MET   1           HA       MET   1 -14.280  -2.710   9.657
    5    HB2  MET   1           HB2      MET   1 -16.212  -0.912   8.121
    6    HB3  MET   1           HB1      MET   1 -15.442  -2.359   7.492
    7    HG2  MET   1           HG2      MET   1 -16.740  -3.757   8.983
    8    HG3  MET   1           HG1      MET   1 -17.417  -2.339   9.785
    9    HE1  MET   1           HE1      MET   1 -19.676  -0.824   6.924
   10    HE2  MET   1           HE2      MET   1 -18.002  -0.395   7.270
   11    HE3  MET   1           HE3      MET   1 -19.143  -0.641   8.595
   12    H    ASN   2           HN       ASN   2 -12.127  -1.963   9.648
   13    HA   ASN   2           HA       ASN   2 -11.340   0.537   8.455
   14    HB2  ASN   2           HB2      ASN   2  -9.016  -0.409   8.458
   15    HB3  ASN   2           HB1      ASN   2  -9.793  -0.439  10.029
   16   HD21  ASN   2          HD21      ASN   2 -10.039  -2.363  11.044
   17   HD22  ASN   2          HD22      ASN   2  -9.473  -3.863  10.413
   18    H    ALA   3           HN       ALA   3  -9.991   0.668   6.553
   19    HA   ALA   3           HA       ALA   3 -11.283   0.070   4.220
   20    HB1  ALA   3           HB1      ALA   3  -9.597   1.829   4.498
   21    HB2  ALA   3           HB2      ALA   3  -9.249   0.828   3.089
   22    HB3  ALA   3           HB3      ALA   3  -8.322   0.610   4.578
   23    H    ILE   4           HN       ILE   4  -8.666  -1.730   5.730
   24    HA   ILE   4           HA       ILE   4  -8.026  -3.424   3.540
   25    HB   ILE   4           HB       ILE   4  -7.512  -4.010   6.490
   26   HG12  ILE   4          HG12      ILE   4  -5.134  -3.020   5.920
   27   HG13  ILE   4          HG11      ILE   4  -5.963  -2.189   4.616
   28   HG21  ILE   4          HG21      ILE   4  -5.605  -5.346   5.696
   29   HG22  ILE   4          HG22      ILE   4  -6.033  -4.972   4.025
   30   HG23  ILE   4          HG23      ILE   4  -7.127  -5.933   5.023
   31   HD11  ILE   4          HD11      ILE   4  -6.518  -1.894   7.573
   32   HD12  ILE   4          HD12      ILE   4  -7.387  -1.049   6.288
   33   HD13  ILE   4          HD13      ILE   4  -5.665  -0.748   6.540
   34    H    ASP   5           HN       ASP   5 -10.137  -3.633   6.343
   35    HA   ASP   5           HA       ASP   5 -10.995  -6.328   6.122
   36    HB2  ASP   5           HB2      ASP   5 -11.124  -5.006   8.214
   37    HB3  ASP   5           HB1      ASP   5 -12.332  -3.949   7.491
   38    H    ILE   6           HN       ILE   6 -12.297  -3.292   4.889
   39    HA   ILE   6           HA       ILE   6 -14.758  -4.356   3.855
   40    HB   ILE   6           HB       ILE   6 -13.286  -1.723   3.350
   41   HG12  ILE   6          HG12      ILE   6 -15.750  -2.395   5.039
   42   HG13  ILE   6          HG11      ILE   6 -14.146  -2.010   5.652
   43   HG21  ILE   6          HG21      ILE   6 -15.330  -0.871   2.266
   44   HG22  ILE   6          HG22      ILE   6 -16.099  -2.449   2.417
   45   HG23  ILE   6          HG23      ILE   6 -14.691  -2.248   1.373
   46   HD11  ILE   6          HD11      ILE   6 -15.991  -0.137   4.180
   47   HD12  ILE   6          HD12      ILE   6 -14.366   0.258   4.745
   48   HD13  ILE   6          HD13      ILE   6 -15.630  -0.137   5.906
   49    H    ALA   7           HN       ALA   7 -11.506  -3.848   2.569
   50    HA   ALA   7           HA       ALA   7 -12.111  -4.393  -0.166
   51    HB1  ALA   7           HB1      ALA   7  -9.708  -4.590  -0.490
   52    HB2  ALA   7           HB2      ALA   7  -9.452  -4.664   1.264
   53    HB3  ALA   7           HB3      ALA   7 -10.083  -3.191   0.524
   54    H    ILE   8           HN       ILE   8 -11.351  -6.439   2.601
   55    HA   ILE   8           HA       ILE   8 -11.034  -8.955   1.338
   56    HB   ILE   8           HB       ILE   8 -12.378  -8.352   4.029
   57   HG12  ILE   8          HG12      ILE   8  -9.463  -9.093   3.491
   58   HG13  ILE   8          HG11      ILE   8 -10.034  -7.470   3.841
   59   HG21  ILE   8          HG21      ILE   8 -11.826 -10.678   4.658
   60   HG22  ILE   8          HG22      ILE   8 -11.179 -10.973   3.043
   61   HG23  ILE   8          HG23      ILE   8 -12.897 -10.634   3.258
   62   HD11  ILE   8          HD11      ILE   8 -10.156  -9.834   5.699
   63   HD12  ILE   8          HD12      ILE   8 -10.774  -8.218   6.056
   64   HD13  ILE   8          HD13      ILE   8  -9.049  -8.465   5.791
   65    H    ASN   9           HN       ASN   9 -13.900  -7.206   2.472
   66    HA   ASN   9           HA       ASN   9 -15.891  -9.121   1.835
   67    HB2  ASN   9           HB2      ASN   9 -16.086  -6.087   2.109
   68    HB3  ASN   9           HB1      ASN   9 -17.468  -7.181   2.064
   69   HD21  ASN   9          HD21      ASN   9 -16.418  -5.314   4.162
   70   HD22  ASN   9          HD22      ASN   9 -16.303  -6.285   5.587
   71    H    LYS  10           HN       LYS  10 -14.496  -6.425   0.043
   72    HA   LYS  10           HA       LYS  10 -16.391  -6.342  -2.081
   73    HB2  LYS  10           HB2      LYS  10 -14.920  -4.444  -1.264
   74    HB3  LYS  10           HB1      LYS  10 -13.545  -5.208  -2.040
   75    HG2  LYS  10           HG2      LYS  10 -16.007  -4.412  -3.634
   76    HG3  LYS  10           HG1      LYS  10 -14.756  -3.238  -3.238
   77    HD2  LYS  10           HD2      LYS  10 -13.089  -4.858  -4.330
   78    HD3  LYS  10           HD1      LYS  10 -14.497  -5.725  -4.956
   79    HE2  LYS  10           HE2      LYS  10 -13.735  -2.841  -5.519
   80    HE3  LYS  10           HE1      LYS  10 -13.637  -4.191  -6.648
   81    HZ1  LYS  10           HZ1      LYS  10 -16.072  -4.385  -6.473
   82    HZ2  LYS  10           HZ2      LYS  10 -15.564  -2.907  -7.115
   83    HZ3  LYS  10           HZ3      LYS  10 -16.099  -2.991  -5.514
   84    H    LEU  11           HN       LEU  11 -13.075  -7.677  -1.827
   85    HA   LEU  11           HA       LEU  11 -13.174  -8.852  -4.474
   86    HB2  LEU  11           HB2      LEU  11 -11.106  -9.319  -2.295
   87    HB3  LEU  11           HB1      LEU  11 -10.951  -9.751  -3.989
   88    HG   LEU  11           HG       LEU  11 -10.849  -6.984  -2.746
   89   HD11  LEU  11          HD11      LEU  11  -8.687  -6.835  -3.941
   90   HD12  LEU  11          HD12      LEU  11  -8.899  -8.490  -4.519
   91   HD13  LEU  11          HD13      LEU  11  -8.736  -8.167  -2.793
   92   HD21  LEU  11          HD21      LEU  11 -11.086  -7.534  -5.720
   93   HD22  LEU  11          HD22      LEU  11 -10.774  -5.969  -4.954
   94   HD23  LEU  11          HD23      LEU  11 -12.312  -6.780  -4.696
   95    H    GLY  12           HN       GLY  12 -13.996  -9.860  -1.266
   96    HA2  GLY  12           HA2      GLY  12 -15.528 -11.687  -1.003
   97    HA3  GLY  12           HA1      GLY  12 -14.671 -12.571  -2.257
   98    H    SER  13           HN       SER  13 -12.015 -11.595  -0.904
   99    HA   SER  13           HA       SER  13 -11.905 -13.114   1.546
  100    HB2  SER  13           HB2      SER  13 -10.457 -14.954   0.651
  101    HB3  SER  13           HB1      SER  13 -12.075 -14.978  -0.052
  102    HG   SER  13           HG       SER  13 -11.274 -14.037  -1.901
  103    H    VAL  14           HN       VAL  14  -9.663 -13.468   2.301
  104    HA   VAL  14           HA       VAL  14  -7.922 -11.183   1.865
  105    HB   VAL  14           HB       VAL  14  -7.756 -13.601   3.739
  106   HG11  VAL  14          HG11      VAL  14  -5.446 -12.920   3.200
  107   HG12  VAL  14          HG12      VAL  14  -5.842 -12.503   4.864
  108   HG13  VAL  14          HG13      VAL  14  -5.822 -11.249   3.621
  109   HG21  VAL  14          HG21      VAL  14  -9.470 -11.956   4.324
  110   HG22  VAL  14          HG22      VAL  14  -8.274 -10.651   4.253
  111   HG23  VAL  14          HG23      VAL  14  -8.154 -11.906   5.501
  112    H    SER  15           HN       SER  15  -8.114 -14.554   0.926
  113    HA   SER  15           HA       SER  15  -5.443 -14.907   0.042
  114    HB2  SER  15           HB2      SER  15  -6.431 -16.833  -1.268
  115    HB3  SER  15           HB1      SER  15  -6.849 -16.836   0.448
  116    HG   SER  15           HG       SER  15  -8.717 -17.214  -0.686
  117    H    ALA  16           HN       ALA  16  -8.407 -13.759  -1.521
  118    HA   ALA  16           HA       ALA  16  -7.254 -13.151  -4.077
  119    HB1  ALA  16           HB1      ALA  16  -9.776 -12.040  -2.788
  120    HB2  ALA  16           HB2      ALA  16  -9.680 -13.490  -3.790
  121    HB3  ALA  16           HB3      ALA  16  -9.339 -11.909  -4.496
  122    H    LEU  17           HN       LEU  17  -7.899 -11.247  -1.118
  123    HA   LEU  17           HA       LEU  17  -7.293  -8.699  -2.147
  124    HB2  LEU  17           HB2      LEU  17  -8.541  -9.033  -0.037
  125    HB3  LEU  17           HB1      LEU  17  -7.088  -9.661   0.730
  126    HG   LEU  17           HG       LEU  17  -6.002  -7.484   0.583
  127   HD11  LEU  17          HD11      LEU  17  -6.938  -6.639  -1.514
  128   HD12  LEU  17          HD12      LEU  17  -7.176  -5.467  -0.223
  129   HD13  LEU  17          HD13      LEU  17  -8.530  -6.462  -0.766
  130   HD21  LEU  17          HD21      LEU  17  -8.770  -7.232   1.781
  131   HD22  LEU  17          HD22      LEU  17  -7.380  -6.202   2.144
  132   HD23  LEU  17          HD23      LEU  17  -7.337  -7.915   2.561
  133    H    ALA  18           HN       ALA  18  -5.282 -10.905  -0.273
  134    HA   ALA  18           HA       ALA  18  -2.939  -9.343  -0.199
  135    HB1  ALA  18           HB1      ALA  18  -3.465 -11.144   1.396
  136    HB2  ALA  18           HB2      ALA  18  -1.872 -11.352   0.666
  137    HB3  ALA  18           HB3      ALA  18  -3.231 -12.344   0.122
  138    H    ALA  19           HN       ALA  19  -4.060 -11.897  -2.416
  139    HA   ALA  19           HA       ALA  19  -1.729 -12.148  -3.991
  140    HB1  ALA  19           HB1      ALA  19  -3.196 -13.134  -5.697
  141    HB2  ALA  19           HB2      ALA  19  -4.620 -12.516  -4.850
  142    HB3  ALA  19           HB3      ALA  19  -3.603 -13.740  -4.090
  143    H    ALA  20           HN       ALA  20  -4.481  -9.914  -4.202
  144    HA   ALA  20           HA       ALA  20  -3.697  -8.590  -6.619
  145    HB1  ALA  20           HB1      ALA  20  -5.567  -7.658  -4.409
  146    HB2  ALA  20           HB2      ALA  20  -6.023  -8.590  -5.835
  147    HB3  ALA  20           HB3      ALA  20  -5.434  -6.938  -6.018
  148    H    LEU  21           HN       LEU  21  -3.103  -8.044  -3.189
  149    HA   LEU  21           HA       LEU  21  -1.719  -5.505  -3.567
  150    HB2  LEU  21           HB2      LEU  21  -2.312  -7.217  -1.125
  151    HB3  LEU  21           HB1      LEU  21  -1.390  -5.720  -1.037
  152    HG   LEU  21           HG       LEU  21  -4.258  -5.892  -2.053
  153   HD11  LEU  21          HD11      LEU  21  -3.248  -5.031   0.672
  154   HD12  LEU  21          HD12      LEU  21  -4.251  -6.446   0.294
  155   HD13  LEU  21          HD13      LEU  21  -4.907  -4.822   0.077
  156   HD21  LEU  21          HD21      LEU  21  -3.030  -4.009  -2.997
  157   HD22  LEU  21          HD22      LEU  21  -2.543  -3.481  -1.385
  158   HD23  LEU  21          HD23      LEU  21  -4.246  -3.443  -1.855
  159    H    GLY  22           HN       GLY  22  -0.854  -8.737  -3.835
  160    HA2  GLY  22           HA2      GLY  22   1.153  -9.719  -4.381
  161    HA3  GLY  22           HA1      GLY  22   1.871  -8.115  -4.381
  162    H    VAL  23           HN       VAL  23   0.245  -9.299  -1.548
  163    HA   VAL  23           HA       VAL  23   2.783  -9.975  -0.182
  164    HB   VAL  23           HB       VAL  23   1.801  -9.086   1.938
  165   HG11  VAL  23          HG11      VAL  23   3.301  -7.636   0.655
  166   HG12  VAL  23          HG12      VAL  23   2.054  -6.674   1.452
  167   HG13  VAL  23          HG13      VAL  23   1.940  -7.007  -0.279
  168   HG21  VAL  23          HG21      VAL  23  -0.480  -8.047   0.188
  169   HG22  VAL  23          HG22      VAL  23  -0.232  -7.638   1.887
  170   HG23  VAL  23          HG23      VAL  23  -0.607  -9.298   1.431
  171    H    ASN  24           HN       ASN  24   2.186 -11.245   1.956
  172    HA   ASN  24           HA       ASN  24   0.517 -13.500   1.169
  173    HB2  ASN  24           HB2      ASN  24   1.412 -14.652   3.127
  174    HB3  ASN  24           HB1      ASN  24   2.719 -13.952   2.191
  175   HD21  ASN  24          HD21      ASN  24   2.833 -14.787   4.903
  176   HD22  ASN  24          HD22      ASN  24   3.213 -13.403   5.862
  177    H    GLN  25           HN       GLN  25  -0.907 -14.460   2.843
  178    HA   GLN  25           HA       GLN  25  -3.040 -12.640   3.392
  179    HB2  GLN  25           HB2      GLN  25  -2.678 -15.569   4.168
  180    HB3  GLN  25           HB1      GLN  25  -4.142 -14.660   4.496
  181    HG2  GLN  25           HG2      GLN  25  -4.551 -15.962   2.558
  182    HG3  GLN  25           HG1      GLN  25  -4.391 -14.286   2.029
  183   HE21  GLN  25          HE21      GLN  25  -2.664 -13.755   0.674
  184   HE22  GLN  25          HE22      GLN  25  -1.666 -14.931  -0.081
  185    H    SER  26           HN       SER  26  -0.414 -13.887   5.302
  186    HA   SER  26           HA       SER  26  -1.343 -13.317   7.919
  187    HB2  SER  26           HB2      SER  26   1.562 -13.325   6.978
  188    HB3  SER  26           HB1      SER  26   0.959 -13.674   8.601
  189    HG   SER  26           HG       SER  26   1.240 -15.647   7.755
  190    H    ALA  27           HN       ALA  27   0.452 -11.385   5.527
  191    HA   ALA  27           HA       ALA  27   1.086  -9.144   7.138
  192    HB1  ALA  27           HB1      ALA  27   1.481  -7.929   5.034
  193    HB2  ALA  27           HB2      ALA  27   0.673  -9.213   4.123
  194    HB3  ALA  27           HB3      ALA  27   2.181  -9.546   4.972
  195    H    ILE  28           HN       ILE  28  -1.697  -9.880   5.084
  196    HA   ILE  28           HA       ILE  28  -3.051  -7.405   5.208
  197    HB   ILE  28           HB       ILE  28  -4.158 -10.233   4.848
  198   HG12  ILE  28          HG12      ILE  28  -2.468  -9.587   3.160
  199   HG13  ILE  28          HG11      ILE  28  -4.064  -9.753   2.442
  200   HG21  ILE  28          HG21      ILE  28  -6.115  -9.200   3.770
  201   HG22  ILE  28          HG22      ILE  28  -5.509  -7.594   4.174
  202   HG23  ILE  28          HG23      ILE  28  -5.989  -8.706   5.460
  203   HD11  ILE  28          HD11      ILE  28  -4.301  -7.304   2.448
  204   HD12  ILE  28          HD12      ILE  28  -2.908  -7.854   1.520
  205   HD13  ILE  28          HD13      ILE  28  -2.676  -7.165   3.125
  206    H    SER  29           HN       SER  29  -3.231 -10.288   7.270
  207    HA   SER  29           HA       SER  29  -5.282  -9.454   8.998
  208    HB2  SER  29           HB2      SER  29  -2.931 -11.290   9.600
  209    HB3  SER  29           HB1      SER  29  -4.464 -11.229  10.484
  210    HG   SER  29           HG       SER  29  -4.798 -12.815   9.053
  211    H    GLN  30           HN       GLN  30  -1.802  -8.842   9.039
  212    HA   GLN  30           HA       GLN  30  -1.671  -7.477  11.560
  213    HB2  GLN  30           HB2      GLN  30   0.197  -7.272   9.151
  214    HB3  GLN  30           HB1      GLN  30   0.563  -6.704  10.781
  215    HG2  GLN  30           HG2      GLN  30   0.508  -9.001  11.624
  216    HG3  GLN  30           HG1      GLN  30   0.043  -9.599  10.033
  217   HE21  GLN  30          HE21      GLN  30   1.903  -7.837   8.575
  218   HE22  GLN  30          HE22      GLN  30   3.476  -8.493   8.844
  219    H    TRP  31           HN       TRP  31  -2.054  -6.448   8.195
  220    HA   TRP  31           HA       TRP  31  -1.878  -3.648   8.577
  221    HB2  TRP  31           HB2      TRP  31  -3.099  -5.318   6.339
  222    HB3  TRP  31           HB1      TRP  31  -2.985  -3.563   6.274
  223    HD1  TRP  31           HD1      TRP  31   0.187  -4.553   7.798
  224    HE1  TRP  31           HE1      TRP  31   2.043  -4.733   6.028
  225    HE3  TRP  31           HE3      TRP  31  -2.675  -4.649   3.530
  226    HZ2  TRP  31           HZ2      TRP  31   2.284  -4.886   3.241
  227    HZ3  TRP  31           HZ3      TRP  31  -1.545  -4.802   1.360
  228    HH2  TRP  31           HH2      TRP  31   0.887  -4.921   1.219
  229    H    ARG  32           HN       ARG  32  -4.498  -5.930   8.743
  230    HA   ARG  32           HA       ARG  32  -6.658  -4.020   8.683
  231    HB2  ARG  32           HB2      ARG  32  -6.957  -6.282   7.769
  232    HB3  ARG  32           HB1      ARG  32  -6.585  -7.005   9.334
  233    HG2  ARG  32           HG2      ARG  32  -8.622  -6.079  10.298
  234    HG3  ARG  32           HG1      ARG  32  -8.971  -5.198   8.806
  235    HD2  ARG  32           HD2      ARG  32 -10.350  -7.198   8.964
  236    HD3  ARG  32           HD1      ARG  32  -9.229  -7.338   7.609
  237    HE   ARG  32           HE       ARG  32  -7.916  -8.594   9.619
  238   HH11  ARG  32          HH11      ARG  32 -11.211 -10.688   8.626
  239   HH12  ARG  32          HH12      ARG  32 -11.128  -8.991   8.254
  240   HH21  ARG  32          HH21      ARG  32  -8.047 -10.800  10.136
  241   HH22  ARG  32          HH22      ARG  32  -9.455 -11.712   9.700
  242    H    ALA  33           HN       ALA  33  -5.050  -6.044  11.130
  243    HA   ALA  33           HA       ALA  33  -6.540  -5.150  13.366
  244    HB1  ALA  33           HB1      ALA  33  -5.193  -7.207  13.423
  245    HB2  ALA  33           HB2      ALA  33  -4.716  -6.123  14.731
  246    HB3  ALA  33           HB3      ALA  33  -3.707  -6.264  13.285
  247    H    ARG  34           HN       ARG  34  -3.720  -3.908  11.702
  248    HA   ARG  34           HA       ARG  34  -2.997  -1.794  13.495
  249    HB2  ARG  34           HB2      ARG  34  -1.515  -2.877  11.769
  250    HB3  ARG  34           HB1      ARG  34  -2.510  -2.180  10.501
  251    HG2  ARG  34           HG2      ARG  34  -0.599  -0.836  10.634
  252    HG3  ARG  34           HG1      ARG  34  -1.867   0.098  11.412
  253    HD2  ARG  34           HD2      ARG  34  -1.009  -0.381  13.592
  254    HD3  ARG  34           HD1      ARG  34   0.107  -1.602  12.976
  255    HE   ARG  34           HE       ARG  34   0.409   1.301  12.890
  256   HH11  ARG  34          HH11      ARG  34   1.678  -1.802  11.836
  257   HH12  ARG  34          HH12      ARG  34   3.248  -1.171  11.456
  258   HH21  ARG  34          HH21      ARG  34   2.484   2.108  12.428
  259   HH22  ARG  34          HH22      ARG  34   3.707   1.057  11.794
  260    H    GLY  35           HN       GLY  35  -5.118  -2.196  10.736
  261    HA2  GLY  35           HA2      GLY  35  -6.930  -1.009   9.953
  262    HA3  GLY  35           HA1      GLY  35  -6.723   0.140  11.268
  263    H    ARG  36           HN       ARG  36  -3.957  -0.517   9.330
  264    HA   ARG  36           HA       ARG  36  -4.268   1.513   7.332
  265    HB2  ARG  36           HB2      ARG  36  -3.958   2.913   9.406
  266    HB3  ARG  36           HB1      ARG  36  -2.396   2.157   9.671
  267    HG2  ARG  36           HG2      ARG  36  -1.422   3.247   7.814
  268    HG3  ARG  36           HG1      ARG  36  -2.989   3.650   7.103
  269    HD2  ARG  36           HD2      ARG  36  -1.831   5.610   8.136
  270    HD3  ARG  36           HD1      ARG  36  -3.426   5.301   8.818
  271    HE   ARG  36           HE       ARG  36  -0.867   4.591  10.144
  272   HH11  ARG  36          HH11      ARG  36  -4.156   5.782  12.140
  273   HH12  ARG  36          HH12      ARG  36  -4.227   5.631  10.412
  274   HH21  ARG  36          HH21      ARG  36  -0.806   4.779  12.403
  275   HH22  ARG  36          HH22      ARG  36  -2.216   5.298  13.268
  276    H    VAL  37           HN       VAL  37  -2.736   1.243   5.761
  277    HA   VAL  37           HA       VAL  37  -0.944  -1.091   6.046
  278    HB   VAL  37           HB       VAL  37  -1.002  -1.209   3.571
  279   HG11  VAL  37          HG11      VAL  37  -3.361  -1.850   3.291
  280   HG12  VAL  37          HG12      VAL  37  -3.778  -1.001   4.784
  281   HG13  VAL  37          HG13      VAL  37  -2.719  -2.412   4.834
  282   HG21  VAL  37          HG21      VAL  37  -2.504   0.254   2.251
  283   HG22  VAL  37          HG22      VAL  37  -1.232   1.183   3.040
  284   HG23  VAL  37          HG23      VAL  37  -2.867   1.198   3.701
  285    HA   PRO  38           HA       PRO  38   2.855   1.386   5.085
  286    HB2  PRO  38           HB2      PRO  38   3.432  -1.014   3.311
  287    HB3  PRO  38           HB1      PRO  38   4.479  -0.203   4.500
  288    HG2  PRO  38           HG2      PRO  38   3.385  -2.515   5.117
  289    HG3  PRO  38           HG1      PRO  38   3.424  -1.210   6.330
  290    HD2  PRO  38           HD2      PRO  38   1.118  -2.112   4.603
  291    HD3  PRO  38           HD1      PRO  38   1.135  -1.684   6.329
  292    H    ALA  39           HN       ALA  39   3.991   2.146   3.086
  293    HA   ALA  39           HA       ALA  39   2.252   3.616   1.511
  294    HB1  ALA  39           HB1      ALA  39   4.552   4.295   1.966
  295    HB2  ALA  39           HB2      ALA  39   4.256   4.294   0.228
  296    HB3  ALA  39           HB3      ALA  39   5.180   2.981   0.966
  297    H    GLY  40           HN       GLY  40   1.471   3.442  -0.603
  298    HA2  GLY  40           HA2      GLY  40   1.444   2.836  -2.849
  299    HA3  GLY  40           HA1      GLY  40   2.518   1.494  -2.508
  300    H    ARG  41           HN       ARG  41   0.205   1.050  -0.217
  301    HA   ARG  41           HA       ARG  41  -1.130  -0.899  -2.002
  302    HB2  ARG  41           HB2      ARG  41  -0.312  -1.180   0.907
  303    HB3  ARG  41           HB1      ARG  41  -1.370  -2.326   0.093
  304    HG2  ARG  41           HG2      ARG  41   1.461  -1.689  -0.794
  305    HG3  ARG  41           HG1      ARG  41   0.998  -3.064   0.216
  306    HD2  ARG  41           HD2      ARG  41   1.268  -3.846  -2.035
  307    HD3  ARG  41           HD1      ARG  41  -0.440  -3.897  -1.635
  308    HE   ARG  41           HE       ARG  41  -0.779  -1.944  -3.082
  309   HH11  ARG  41          HH11      ARG  41   2.524  -3.054  -5.114
  310   HH12  ARG  41          HH12      ARG  41   2.301  -3.645  -3.502
  311   HH21  ARG  41          HH21      ARG  41   0.983  -1.683  -6.077
  312   HH22  ARG  41          HH22      ARG  41  -0.446  -1.208  -5.207
  313    H    CYS  42           HN       CYS  42  -1.860   1.680   0.197
  314    HA   CYS  42           HA       CYS  42  -4.610   0.950   0.646
  315    HB2  CYS  42           HB2      CYS  42  -3.695   2.635   2.079
  316    HB3  CYS  42           HB1      CYS  42  -3.222   3.639   0.714
  317    H    ILE  43           HN       ILE  43  -2.802   2.511  -1.909
  318    HA   ILE  43           HA       ILE  43  -4.706   3.795  -3.442
  319    HB   ILE  43           HB       ILE  43  -2.393   2.074  -4.467
  320   HG12  ILE  43          HG12      ILE  43  -1.601   3.765  -2.868
  321   HG13  ILE  43          HG11      ILE  43  -1.072   4.181  -4.490
  322   HG21  ILE  43          HG21      ILE  43  -3.886   4.319  -5.870
  323   HG22  ILE  43          HG22      ILE  43  -3.935   2.605  -6.289
  324   HG23  ILE  43          HG23      ILE  43  -2.438   3.516  -6.483
  325   HD11  ILE  43          HD11      ILE  43  -2.852   5.883  -4.618
  326   HD12  ILE  43          HD12      ILE  43  -1.755   6.157  -3.268
  327   HD13  ILE  43          HD13      ILE  43  -3.353   5.474  -2.973
  328    H    ASP  44           HN       ASP  44  -3.814   0.325  -3.539
  329    HA   ASP  44           HA       ASP  44  -5.836  -0.396  -5.447
  330    HB2  ASP  44           HB2      ASP  44  -4.406  -2.237  -3.498
  331    HB3  ASP  44           HB1      ASP  44  -5.167  -2.694  -5.023
  332    H    ILE  45           HN       ILE  45  -5.632  -0.574  -1.907
  333    HA   ILE  45           HA       ILE  45  -8.062  -1.942  -1.467
  334    HB   ILE  45           HB       ILE  45  -6.437  -0.128   0.381
  335   HG12  ILE  45          HG12      ILE  45  -6.675  -3.183   0.168
  336   HG13  ILE  45          HG11      ILE  45  -5.272  -2.214  -0.276
  337   HG21  ILE  45          HG21      ILE  45  -8.752  -1.937   1.142
  338   HG22  ILE  45          HG22      ILE  45  -8.776  -0.171   1.158
  339   HG23  ILE  45          HG23      ILE  45  -7.718  -1.044   2.261
  340   HD11  ILE  45          HD11      ILE  45  -5.036  -1.572   2.117
  341   HD12  ILE  45          HD12      ILE  45  -4.853  -3.297   1.810
  342   HD13  ILE  45          HD13      ILE  45  -6.355  -2.684   2.509
  343    H    GLU  46           HN       GLU  46  -7.410   1.436  -2.182
  344    HA   GLU  46           HA       GLU  46  -9.952   2.533  -1.392
  345    HB2  GLU  46           HB2      GLU  46  -7.789   3.580  -3.267
  346    HB3  GLU  46           HB1      GLU  46  -9.257   4.482  -2.892
  347    HG2  GLU  46           HG2      GLU  46  -8.655   4.667  -0.581
  348    HG3  GLU  46           HG1      GLU  46  -7.294   3.568  -0.782
  349    H    LEU  47           HN       LEU  47  -8.591   1.196  -4.378
  350    HA   LEU  47           HA       LEU  47 -10.755   1.541  -6.137
  351    HB2  LEU  47           HB2      LEU  47  -8.948  -0.901  -5.873
  352    HB3  LEU  47           HB1      LEU  47  -9.949  -0.541  -7.267
  353    HG   LEU  47           HG       LEU  47  -7.649   1.243  -6.362
  354   HD11  LEU  47          HD11      LEU  47  -7.616  -0.872  -8.550
  355   HD12  LEU  47          HD12      LEU  47  -6.775  -0.983  -7.003
  356   HD13  LEU  47          HD13      LEU  47  -6.311   0.256  -8.166
  357   HD21  LEU  47          HD21      LEU  47  -9.220   1.113  -8.944
  358   HD22  LEU  47          HD22      LEU  47  -7.865   2.201  -8.611
  359   HD23  LEU  47          HD23      LEU  47  -9.367   2.363  -7.704
  360    H    TYR  48           HN       TYR  48 -10.265  -0.694  -3.469
  361    HA   TYR  48           HA       TYR  48 -12.712  -2.214  -4.065
  362    HB2  TYR  48           HB2      TYR  48 -10.823  -2.928  -1.800
  363    HB3  TYR  48           HB1      TYR  48 -11.871  -3.987  -2.745
  364    HD1  TYR  48           HD1      TYR  48  -8.777  -4.185  -2.022
  365    HD2  TYR  48           HD2      TYR  48 -10.886  -2.981  -5.543
  366    HE1  TYR  48           HE1      TYR  48  -6.822  -4.760  -3.390
  367    HE2  TYR  48           HE2      TYR  48  -8.923  -3.527  -6.914
  368    HH   TYR  48           HH       TYR  48  -6.463  -3.766  -6.595
  369    H    THR  49           HN       THR  49 -11.957   0.495  -2.258
  370    HA   THR  49           HA       THR  49 -14.301   0.094  -0.465
  371    HB   THR  49           HB       THR  49 -13.191   1.411   1.313
  372    HG1  THR  49           HG1      THR  49 -10.698   1.264   0.029
  373   HG21  THR  49          HG21      THR  49 -11.387  -0.879   0.433
  374   HG22  THR  49          HG22      THR  49 -12.873  -1.050   1.367
  375   HG23  THR  49          HG23      THR  49 -11.495  -0.197   2.056
  376    H    ASP  50           HN       ASP  50 -14.323   1.177  -3.012
  377    HA   ASP  50           HA       ASP  50 -13.586   3.717  -3.597
  378    HB2  ASP  50           HB2      ASP  50 -14.456   2.145  -5.257
  379    HB3  ASP  50           HB1      ASP  50 -16.069   2.241  -4.557
  380    H    GLY  51           HN       GLY  51 -16.903   2.918  -2.459
  381    HA2  GLY  51           HA2      GLY  51 -17.240   5.747  -1.547
  382    HA3  GLY  51           HA1      GLY  51 -18.544   4.735  -2.151
  383    H    ARG  52           HN       ARG  52 -16.326   3.054  -0.184
  384    HA   ARG  52           HA       ARG  52 -18.358   2.802   1.918
  385    HB2  ARG  52           HB2      ARG  52 -15.986   1.122   1.062
  386    HB3  ARG  52           HB1      ARG  52 -16.673   0.901   2.669
  387    HG2  ARG  52           HG2      ARG  52 -18.225   0.629   0.068
  388    HG3  ARG  52           HG1      ARG  52 -17.576  -0.707   1.024
  389    HD2  ARG  52           HD2      ARG  52 -19.003  -0.043   2.932
  390    HD3  ARG  52           HD1      ARG  52 -19.648   1.303   1.988
  391    HE   ARG  52           HE       ARG  52 -19.996  -1.455   1.019
  392   HH11  ARG  52          HH11      ARG  52 -21.471   1.491   2.292
  393   HH12  ARG  52          HH12      ARG  52 -23.084   0.982   1.908
  394   HH21  ARG  52          HH21      ARG  52 -23.447  -1.068   0.948
  395   HH22  ARG  52          HH22      ARG  52 -22.118  -2.125   0.599
  396    H    VAL  53           HN       VAL  53 -14.804   3.412   1.730
  397    HA   VAL  53           HA       VAL  53 -14.937   5.054   4.142
  398    HB   VAL  53           HB       VAL  53 -14.619   2.720   5.025
  399   HG11  VAL  53          HG11      VAL  53 -13.372   1.750   3.161
  400   HG12  VAL  53          HG12      VAL  53 -12.515   1.517   4.682
  401   HG13  VAL  53          HG13      VAL  53 -11.970   2.755   3.545
  402   HG21  VAL  53          HG21      VAL  53 -13.768   4.607   6.345
  403   HG22  VAL  53          HG22      VAL  53 -12.224   4.542   5.496
  404   HG23  VAL  53          HG23      VAL  53 -12.719   3.203   6.536
  405    H    GLU  54           HN       GLU  54 -13.273   6.520   4.288
  406    HA   GLU  54           HA       GLU  54 -11.565   6.915   1.974
  407    HB2  GLU  54           HB2      GLU  54 -12.829   8.695   3.509
  408    HB3  GLU  54           HB1      GLU  54 -11.402   8.566   4.523
  409    HG2  GLU  54           HG2      GLU  54 -11.258   9.235   1.576
  410    HG3  GLU  54           HG1      GLU  54 -11.501  10.471   2.796
  411    H    CYS  55           HN       CYS  55 -10.064   5.348   1.893
  412    HA   CYS  55           HA       CYS  55  -8.701   4.207   4.152
  413    HB2  CYS  55           HB2      CYS  55  -9.156   2.763   2.314
  414    HB3  CYS  55           HB1      CYS  55  -8.476   3.888   1.155
  415    H    ARG  56           HN       ARG  56  -6.514   4.402   4.745
  416    HA   ARG  56           HA       ARG  56  -4.841   6.409   3.344
  417    HB2  ARG  56           HB2      ARG  56  -5.042   6.152   6.386
  418    HB3  ARG  56           HB1      ARG  56  -3.853   7.124   5.528
  419    HG2  ARG  56           HG2      ARG  56  -5.405   8.738   6.123
  420    HG3  ARG  56           HG1      ARG  56  -5.930   8.334   4.491
  421    HD2  ARG  56           HD2      ARG  56  -7.649   6.796   5.487
  422    HD3  ARG  56           HD1      ARG  56  -7.162   7.357   7.090
  423    HE   ARG  56           HE       ARG  56  -7.913   9.465   5.264
  424   HH11  ARG  56          HH11      ARG  56  -9.175   7.210   7.647
  425   HH12  ARG  56          HH12      ARG  56 -10.576   8.173   7.976
  426   HH21  ARG  56          HH21      ARG  56 -10.914  10.122   6.843
  427   HH22  ARG  56          HH22      ARG  56  -9.771  10.647   5.644
  428    H    GLU  57           HN       GLU  57  -2.714   5.955   3.156
  429    HA   GLU  57           HA       GLU  57  -1.615   3.469   4.330
  430    HB2  GLU  57           HB2      GLU  57   0.086   3.616   2.413
  431    HB3  GLU  57           HB1      GLU  57  -1.551   3.163   1.971
  432    HG2  GLU  57           HG2      GLU  57  -1.990   5.474   1.229
  433    HG3  GLU  57           HG1      GLU  57  -0.331   5.911   1.648
  434    H    LEU  58           HN       LEU  58   0.760   3.571   4.611
  435    HA   LEU  58           HA       LEU  58   1.431   5.940   6.148
  436    HB2  LEU  58           HB2      LEU  58   2.667   3.173   5.947
  437    HB3  LEU  58           HB1      LEU  58   3.372   4.465   6.911
  438    HG   LEU  58           HG       LEU  58   0.579   3.345   7.364
  439   HD11  LEU  58          HD11      LEU  58   1.482   2.172   9.314
  440   HD12  LEU  58          HD12      LEU  58   3.116   2.713   8.911
  441   HD13  LEU  58          HD13      LEU  58   2.255   1.613   7.832
  442   HD21  LEU  58          HD21      LEU  58   0.819   5.652   8.111
  443   HD22  LEU  58          HD22      LEU  58   2.262   5.236   9.037
  444   HD23  LEU  58          HD23      LEU  58   0.691   4.574   9.498
  445    H    ARG  59           HN       ARG  59   2.669   7.475   5.332
  446    HA   ARG  59           HA       ARG  59   3.596   7.515   2.693
  447    HB2  ARG  59           HB2      ARG  59   4.642   9.679   3.324
  448    HB3  ARG  59           HB1      ARG  59   2.978   9.541   3.899
  449    HG2  ARG  59           HG2      ARG  59   3.886   8.901   6.166
  450    HG3  ARG  59           HG1      ARG  59   5.504   9.265   5.557
  451    HD2  ARG  59           HD2      ARG  59   4.622  11.171   6.809
  452    HD3  ARG  59           HD1      ARG  59   4.797  11.600   5.107
  453    HE   ARG  59           HE       ARG  59   2.361  11.263   4.881
  454   HH11  ARG  59          HH11      ARG  59   3.601  11.901   8.115
  455   HH12  ARG  59          HH12      ARG  59   2.091  12.530   8.686
  456   HH21  ARG  59          HH21      ARG  59   0.280  12.666   7.288
  457   HH22  ARG  59          HH22      ARG  59   0.405  12.126   5.643
  458    HA   PRO  60           HA       PRO  60   7.602   5.665   2.380
  459    HB2  PRO  60           HB2      PRO  60   9.304   7.788   1.588
  460    HB3  PRO  60           HB1      PRO  60   8.304   6.800   0.509
  461    HG2  PRO  60           HG2      PRO  60   7.698   9.490   1.693
  462    HG3  PRO  60           HG1      PRO  60   7.390   8.886   0.048
  463    HD2  PRO  60           HD2      PRO  60   5.394   9.040   1.805
  464    HD3  PRO  60           HD1      PRO  60   5.522   7.618   0.729
  465    H    ASP  61           HN       ASP  61   7.445   8.528   4.367
  466    HA   ASP  61           HA       ASP  61   9.807   8.260   5.896
  467    HB2  ASP  61           HB2      ASP  61   8.339  10.302   5.857
  468    HB3  ASP  61           HB1      ASP  61   7.113   9.427   6.769
  469    H    VAL  62           HN       VAL  62   6.447   7.204   6.622
  470    HA   VAL  62           HA       VAL  62   7.402   5.372   8.724
  471    HB   VAL  62           HB       VAL  62   4.480   5.737   7.906
  472   HG11  VAL  62          HG11      VAL  62   4.000   5.053  10.230
  473   HG12  VAL  62          HG12      VAL  62   5.727   4.890  10.555
  474   HG13  VAL  62          HG13      VAL  62   4.944   3.825   9.384
  475   HG21  VAL  62          HG21      VAL  62   5.344   7.983   8.353
  476   HG22  VAL  62          HG22      VAL  62   5.969   7.456   9.917
  477   HG23  VAL  62          HG23      VAL  62   4.228   7.476   9.623
  478    H    PHE  63           HN       PHE  63   8.527   4.362   6.754
  479    HA   PHE  63           HA       PHE  63   6.963   2.055   5.794
  480    HB2  PHE  63           HB2      PHE  63   6.944   3.929   4.054
  481    HB3  PHE  63           HB1      PHE  63   8.690   3.767   3.947
  482    HD1  PHE  63           HD1      PHE  63   5.705   1.464   3.847
  483    HD2  PHE  63           HD2      PHE  63   9.404   2.596   2.017
  484    HE1  PHE  63           HE1      PHE  63   5.365  -0.233   2.097
  485    HE2  PHE  63           HE2      PHE  63   9.048   0.888   0.271
  486    HZ   PHE  63           HZ       PHE  63   7.030  -0.521   0.312
  487    H    GLY  64           HN       GLY  64   9.478   3.072   7.520
  488    HA2  GLY  64           HA2      GLY  64  10.890   0.842   7.979
  489    HA3  GLY  64           HA1      GLY  64  11.643   1.424   6.492
  490    H    ALA  65           HN       ALA  65  10.509   2.759   9.585
  491    HA   ALA  65           HA       ALA  65  13.066   4.136  10.019
  492    HB1  ALA  65           HB1      ALA  65  11.894   6.257  10.554
  493    HB2  ALA  65           HB2      ALA  65  10.349   5.530  10.100
  494    HB3  ALA  65           HB3      ALA  65  11.602   5.777   8.884
  Start of MODEL   19
    1    H1   MET   1           HT1      MET   1 -14.674  -2.721  12.344
    2    H2   MET   1           HT2      MET   1 -14.703  -1.118  11.813
    3    H3   MET   1           HT3      MET   1 -13.244  -1.826  12.274
    4    HA   MET   1           HA       MET   1 -13.280  -3.317  10.471
    5    HB2  MET   1           HB2      MET   1 -15.693  -3.679  10.340
    6    HB3  MET   1           HB1      MET   1 -15.946  -2.035   9.775
    7    HG2  MET   1           HG2      MET   1 -14.877  -2.516   7.671
    8    HG3  MET   1           HG1      MET   1 -14.331  -4.091   8.242
    9    HE1  MET   1           HE1      MET   1 -15.946  -6.130   8.722
   10    HE2  MET   1           HE2      MET   1 -17.691  -6.076   8.478
   11    HE3  MET   1           HE3      MET   1 -16.960  -5.152   9.787
   12    H    ASN   2           HN       ASN   2 -11.562  -2.416   9.654
   13    HA   ASN   2           HA       ASN   2 -11.362   0.360   8.771
   14    HB2  ASN   2           HB2      ASN   2  -8.933  -0.341   8.317
   15    HB3  ASN   2           HB1      ASN   2  -9.465  -0.429   9.991
   16   HD21  ASN   2          HD21      ASN   2  -9.669  -2.419  10.956
   17   HD22  ASN   2          HD22      ASN   2  -9.044  -3.865  10.261
   18    H    ALA   3           HN       ALA   3 -10.266   0.834   6.710
   19    HA   ALA   3           HA       ALA   3 -11.590   0.118   4.430
   20    HB1  ALA   3           HB1      ALA   3 -10.160   2.111   4.633
   21    HB2  ALA   3           HB2      ALA   3  -9.748   1.183   3.188
   22    HB3  ALA   3           HB3      ALA   3  -8.722   1.090   4.622
   23    H    ILE   4           HN       ILE   4  -8.733  -1.472   5.779
   24    HA   ILE   4           HA       ILE   4  -8.065  -3.079   3.525
   25    HB   ILE   4           HB       ILE   4  -7.475  -3.750   6.448
   26   HG12  ILE   4          HG12      ILE   4  -5.127  -2.740   5.882
   27   HG13  ILE   4          HG11      ILE   4  -5.945  -1.919   4.564
   28   HG21  ILE   4          HG21      ILE   4  -7.132  -5.641   4.920
   29   HG22  ILE   4          HG22      ILE   4  -5.597  -5.073   5.577
   30   HG23  ILE   4          HG23      ILE   4  -6.054  -4.651   3.926
   31   HD11  ILE   4          HD11      ILE   4  -5.667  -0.451   6.461
   32   HD12  ILE   4          HD12      ILE   4  -6.504  -1.592   7.513
   33   HD13  ILE   4          HD13      ILE   4  -7.388  -0.778   6.222
   34    H    ASP   5           HN       ASP   5 -10.053  -3.514   6.413
   35    HA   ASP   5           HA       ASP   5 -10.776  -6.238   5.968
   36    HB2  ASP   5           HB2      ASP   5 -10.716  -5.094   8.227
   37    HB3  ASP   5           HB1      ASP   5 -12.170  -4.213   7.770
   38    H    ILE   6           HN       ILE   6 -12.154  -3.153   5.046
   39    HA   ILE   6           HA       ILE   6 -14.663  -4.059   4.064
   40    HB   ILE   6           HB       ILE   6 -12.952  -1.629   3.348
   41   HG12  ILE   6          HG12      ILE   6 -13.953  -1.655   5.637
   42   HG13  ILE   6          HG11      ILE   6 -14.584  -0.343   4.652
   43   HG21  ILE   6          HG21      ILE   6 -14.927  -0.678   2.159
   44   HG22  ILE   6          HG22      ILE   6 -15.751  -2.230   2.311
   45   HG23  ILE   6          HG23      ILE   6 -14.275  -2.108   1.353
   46   HD11  ILE   6          HD11      ILE   6 -16.314  -1.371   5.991
   47   HD12  ILE   6          HD12      ILE   6 -16.004  -2.939   5.249
   48   HD13  ILE   6          HD13      ILE   6 -16.644  -1.610   4.276
   49    H    ALA   7           HN       ALA   7 -11.412  -3.740   2.626
   50    HA   ALA   7           HA       ALA   7 -12.148  -4.521  -0.025
   51    HB1  ALA   7           HB1      ALA   7  -9.412  -4.515   1.294
   52    HB2  ALA   7           HB2      ALA   7 -10.162  -3.155   0.455
   53    HB3  ALA   7           HB3      ALA   7  -9.748  -4.613  -0.447
   54    H    ILE   8           HN       ILE   8 -11.078  -6.284   2.850
   55    HA   ILE   8           HA       ILE   8 -10.688  -8.865   1.748
   56    HB   ILE   8           HB       ILE   8 -11.699  -8.068   4.532
   57   HG12  ILE   8          HG12      ILE   8  -8.892  -8.894   3.663
   58   HG13  ILE   8          HG11      ILE   8  -9.414  -7.234   3.877
   59   HG21  ILE   8          HG21      ILE   8 -11.032 -10.346   5.286
   60   HG22  ILE   8          HG22      ILE   8 -10.677 -10.789   3.616
   61   HG23  ILE   8          HG23      ILE   8 -12.332 -10.403   4.089
   62   HD11  ILE   8          HD11      ILE   8  -9.162  -9.330   6.010
   63   HD12  ILE   8          HD12      ILE   8  -9.841  -7.721   6.263
   64   HD13  ILE   8          HD13      ILE   8  -8.156  -7.901   5.773
   65    H    ASN   9           HN       ASN   9 -13.541  -7.228   3.052
   66    HA   ASN   9           HA       ASN   9 -15.424  -9.323   2.643
   67    HB2  ASN   9           HB2      ASN   9 -15.814  -7.532   4.297
   68    HB3  ASN   9           HB1      ASN   9 -15.834  -6.313   3.024
   69   HD21  ASN   9          HD21      ASN   9 -17.680  -6.144   1.699
   70   HD22  ASN   9          HD22      ASN   9 -19.184  -6.889   2.109
   71    H    LYS  10           HN       LYS  10 -14.231  -6.673   0.669
   72    HA   LYS  10           HA       LYS  10 -16.404  -6.612  -1.189
   73    HB2  LYS  10           HB2      LYS  10 -14.735  -4.703  -0.537
   74    HB3  LYS  10           HB1      LYS  10 -13.641  -5.409  -1.721
   75    HG2  LYS  10           HG2      LYS  10 -16.474  -4.626  -2.457
   76    HG3  LYS  10           HG1      LYS  10 -15.177  -3.437  -2.441
   77    HD2  LYS  10           HD2      LYS  10 -13.946  -4.688  -4.149
   78    HD3  LYS  10           HD1      LYS  10 -15.153  -5.985  -4.108
   79    HE2  LYS  10           HE2      LYS  10 -16.876  -4.385  -4.907
   80    HE3  LYS  10           HE1      LYS  10 -15.644  -3.121  -4.994
   81    HZ1  LYS  10           HZ1      LYS  10 -14.449  -4.494  -6.609
   82    HZ2  LYS  10           HZ2      LYS  10 -15.994  -4.082  -7.145
   83    HZ3  LYS  10           HZ3      LYS  10 -15.691  -5.639  -6.567
   84    H    LEU  11           HN       LEU  11 -13.029  -7.838  -1.359
   85    HA   LEU  11           HA       LEU  11 -13.479  -9.157  -3.905
   86    HB2  LEU  11           HB2      LEU  11 -11.112  -9.539  -2.017
   87    HB3  LEU  11           HB1      LEU  11 -11.213 -10.030  -3.698
   88    HG   LEU  11           HG       LEU  11 -10.758  -7.278  -2.548
   89   HD11  LEU  11          HD11      LEU  11  -8.990  -7.167  -4.242
   90   HD12  LEU  11          HD12      LEU  11  -9.454  -8.756  -4.856
   91   HD13  LEU  11          HD13      LEU  11  -8.820  -8.591  -3.220
   92   HD21  LEU  11          HD21      LEU  11 -11.881  -7.700  -5.334
   93   HD22  LEU  11          HD22      LEU  11 -11.208  -6.194  -4.697
   94   HD23  LEU  11          HD23      LEU  11 -12.667  -6.869  -3.986
   95    H    GLY  12           HN       GLY  12 -14.062  -9.908  -0.630
   96    HA2  GLY  12           HA2      GLY  12 -15.478 -11.613   0.065
   97    HA3  GLY  12           HA1      GLY  12 -15.126 -12.519  -1.397
   98    H    SER  13           HN       SER  13 -12.145 -11.619  -0.315
   99    HA   SER  13           HA       SER  13 -11.682 -13.460   1.820
  100    HB2  SER  13           HB2      SER  13 -10.302 -15.118   0.512
  101    HB3  SER  13           HB1      SER  13 -12.004 -15.156   0.069
  102    HG   SER  13           HG       SER  13 -11.560 -14.092  -1.789
  103    H    VAL  14           HN       VAL  14  -9.482 -13.648   2.415
  104    HA   VAL  14           HA       VAL  14  -7.789 -11.365   1.850
  105    HB   VAL  14           HB       VAL  14  -7.651 -13.690   3.823
  106   HG11  VAL  14          HG11      VAL  14  -5.321 -13.345   3.110
  107   HG12  VAL  14          HG12      VAL  14  -5.553 -12.774   4.763
  108   HG13  VAL  14          HG13      VAL  14  -5.464 -11.618   3.432
  109   HG21  VAL  14          HG21      VAL  14  -7.721 -11.851   5.496
  110   HG22  VAL  14          HG22      VAL  14  -9.113 -11.818   4.411
  111   HG23  VAL  14          HG23      VAL  14  -7.783 -10.673   4.170
  112    H    SER  15           HN       SER  15  -7.996 -14.777   1.007
  113    HA   SER  15           HA       SER  15  -5.414 -15.135  -0.062
  114    HB2  SER  15           HB2      SER  15  -6.496 -16.995  -1.392
  115    HB3  SER  15           HB1      SER  15  -6.828 -17.054   0.340
  116    HG   SER  15           HG       SER  15  -8.740 -17.381  -0.782
  117    H    ALA  16           HN       ALA  16  -8.454 -13.994  -1.551
  118    HA   ALA  16           HA       ALA  16  -7.363 -13.398  -4.122
  119    HB1  ALA  16           HB1      ALA  16  -9.879 -12.308  -2.812
  120    HB2  ALA  16           HB2      ALA  16  -9.771 -13.756  -3.811
  121    HB3  ALA  16           HB3      ALA  16  -9.461 -12.176  -4.529
  122    H    LEU  17           HN       LEU  17  -8.017 -11.431  -1.204
  123    HA   LEU  17           HA       LEU  17  -7.468  -8.923  -2.315
  124    HB2  LEU  17           HB2      LEU  17  -8.629  -9.219  -0.133
  125    HB3  LEU  17           HB1      LEU  17  -7.116  -9.742   0.595
  126    HG   LEU  17           HG       LEU  17  -6.116  -7.533   0.188
  127   HD11  LEU  17          HD11      LEU  17  -7.445  -5.630  -0.620
  128   HD12  LEU  17          HD12      LEU  17  -8.806  -6.706  -0.947
  129   HD13  LEU  17          HD13      LEU  17  -7.297  -6.885  -1.849
  130   HD21  LEU  17          HD21      LEU  17  -8.750  -7.257   1.623
  131   HD22  LEU  17          HD22      LEU  17  -7.342  -6.200   1.785
  132   HD23  LEU  17          HD23      LEU  17  -7.244  -7.883   2.306
  133    H    ALA  18           HN       ALA  18  -5.331 -10.979  -0.353
  134    HA   ALA  18           HA       ALA  18  -3.025  -9.390  -0.434
  135    HB1  ALA  18           HB1      ALA  18  -3.447 -11.156   1.207
  136    HB2  ALA  18           HB2      ALA  18  -1.888 -11.381   0.410
  137    HB3  ALA  18           HB3      ALA  18  -3.271 -12.386  -0.045
  138    H    ALA  19           HN       ALA  19  -4.184 -11.946  -2.589
  139    HA   ALA  19           HA       ALA  19  -1.893 -12.277  -4.202
  140    HB1  ALA  19           HB1      ALA  19  -3.421 -13.297  -5.833
  141    HB2  ALA  19           HB2      ALA  19  -4.811 -12.628  -4.968
  142    HB3  ALA  19           HB3      ALA  19  -3.791 -13.844  -4.198
  143    H    ALA  20           HN       ALA  20  -4.541  -9.944  -4.311
  144    HA   ALA  20           HA       ALA  20  -3.727  -8.709  -6.812
  145    HB1  ALA  20           HB1      ALA  20  -5.786  -7.842  -4.748
  146    HB2  ALA  20           HB2      ALA  20  -6.094  -8.798  -6.195
  147    HB3  ALA  20           HB3      ALA  20  -5.565  -7.126  -6.354
  148    H    LEU  21           HN       LEU  21  -3.229  -8.177  -3.386
  149    HA   LEU  21           HA       LEU  21  -2.062  -5.517  -3.694
  150    HB2  LEU  21           HB2      LEU  21  -2.418  -7.304  -1.247
  151    HB3  LEU  21           HB1      LEU  21  -1.780  -5.666  -1.201
  152    HG   LEU  21           HG       LEU  21  -4.608  -6.470  -1.987
  153   HD11  LEU  21          HD11      LEU  21  -3.555  -5.003   0.440
  154   HD12  LEU  21          HD12      LEU  21  -4.339  -6.586   0.378
  155   HD13  LEU  21          HD13      LEU  21  -5.266  -5.135   0.005
  156   HD21  LEU  21          HD21      LEU  21  -3.381  -3.712  -1.923
  157   HD22  LEU  21          HD22      LEU  21  -5.097  -4.076  -2.148
  158   HD23  LEU  21          HD23      LEU  21  -3.924  -4.600  -3.351
  159    H    GLY  22           HN       GLY  22  -0.971  -8.690  -3.963
  160    HA2  GLY  22           HA2      GLY  22   1.105  -9.537  -4.454
  161    HA3  GLY  22           HA1      GLY  22   1.708  -7.888  -4.504
  162    H    VAL  23           HN       VAL  23   0.148  -9.309  -1.720
  163    HA   VAL  23           HA       VAL  23   2.694  -9.439  -0.210
  164    HB   VAL  23           HB       VAL  23   1.531  -8.523   1.785
  165   HG11  VAL  23          HG11      VAL  23   2.739  -6.923   0.361
  166   HG12  VAL  23          HG12      VAL  23   1.318  -6.165   1.081
  167   HG13  VAL  23          HG13      VAL  23   1.289  -6.660  -0.611
  168   HG21  VAL  23          HG21      VAL  23  -0.868  -8.106  -0.047
  169   HG22  VAL  23          HG22      VAL  23  -0.740  -7.510   1.612
  170   HG23  VAL  23          HG23      VAL  23  -0.771  -9.245   1.295
  171    H    ASN  24           HN       ASN  24   2.078 -10.533   2.054
  172    HA   ASN  24           HA       ASN  24   1.144 -13.201   1.493
  173    HB2  ASN  24           HB2      ASN  24   2.007 -11.863   4.090
  174    HB3  ASN  24           HB1      ASN  24   1.517 -13.547   3.988
  175   HD21  ASN  24          HD21      ASN  24   3.451 -14.244   4.730
  176   HD22  ASN  24          HD22      ASN  24   4.900 -14.217   3.777
  177    H    GLN  25           HN       GLN  25  -0.489 -14.247   2.745
  178    HA   GLN  25           HA       GLN  25  -2.956 -12.810   3.119
  179    HB2  GLN  25           HB2      GLN  25  -2.212 -15.711   3.760
  180    HB3  GLN  25           HB1      GLN  25  -3.830 -15.048   3.963
  181    HG2  GLN  25           HG2      GLN  25  -3.812 -16.275   1.907
  182    HG3  GLN  25           HG1      GLN  25  -3.884 -14.566   1.497
  183   HE21  GLN  25          HE21      GLN  25  -2.076 -13.624   0.480
  184   HE22  GLN  25          HE22      GLN  25  -0.826 -14.552  -0.239
  185    H    SER  26           HN       SER  26  -0.342 -14.029   5.145
  186    HA   SER  26           HA       SER  26  -1.512 -13.481   7.695
  187    HB2  SER  26           HB2      SER  26   0.974 -13.615   8.415
  188    HB3  SER  26           HB1      SER  26   0.294 -15.043   7.636
  189    HG   SER  26           HG       SER  26   2.444 -13.824   6.916
  190    H    ALA  27           HN       ALA  27   0.305 -11.573   5.335
  191    HA   ALA  27           HA       ALA  27   0.951  -9.323   6.908
  192    HB1  ALA  27           HB1      ALA  27   1.990  -9.763   4.722
  193    HB2  ALA  27           HB2      ALA  27   1.290  -8.144   4.778
  194    HB3  ALA  27           HB3      ALA  27   0.459  -9.443   3.910
  195    H    ILE  28           HN       ILE  28  -1.900 -10.089   4.928
  196    HA   ILE  28           HA       ILE  28  -3.239  -7.602   5.166
  197    HB   ILE  28           HB       ILE  28  -4.408 -10.384   4.673
  198   HG12  ILE  28          HG12      ILE  28  -2.700  -9.725   2.993
  199   HG13  ILE  28          HG11      ILE  28  -4.307  -9.805   2.283
  200   HG21  ILE  28          HG21      ILE  28  -6.320  -9.200   3.616
  201   HG22  ILE  28          HG22      ILE  28  -5.646  -7.655   4.139
  202   HG23  ILE  28          HG23      ILE  28  -6.189  -8.831   5.339
  203   HD11  ILE  28          HD11      ILE  28  -4.476  -7.370   2.405
  204   HD12  ILE  28          HD12      ILE  28  -3.092  -7.912   1.463
  205   HD13  ILE  28          HD13      ILE  28  -2.848  -7.303   3.097
  206    H    SER  29           HN       SER  29  -3.415 -10.600   7.063
  207    HA   SER  29           HA       SER  29  -5.441  -9.992   8.862
  208    HB2  SER  29           HB2      SER  29  -2.867 -11.510   9.462
  209    HB3  SER  29           HB1      SER  29  -4.396 -11.667  10.324
  210    HG   SER  29           HG       SER  29  -3.595 -12.777   7.946
  211    H    GLN  30           HN       GLN  30  -2.015  -9.113   8.927
  212    HA   GLN  30           HA       GLN  30  -1.991  -7.833  11.483
  213    HB2  GLN  30           HB2      GLN  30  -0.054  -7.660   9.136
  214    HB3  GLN  30           HB1      GLN  30   0.258  -6.979  10.735
  215    HG2  GLN  30           HG2      GLN  30   0.235  -9.180  11.749
  216    HG3  GLN  30           HG1      GLN  30  -0.266  -9.925  10.229
  217   HE21  GLN  30          HE21      GLN  30   1.270 -10.148   8.562
  218   HE22  GLN  30          HE22      GLN  30   2.965 -10.018   8.851
  219    H    TRP  31           HN       TRP  31  -2.419  -6.670   8.142
  220    HA   TRP  31           HA       TRP  31  -2.489  -3.874   8.767
  221    HB2  TRP  31           HB2      TRP  31  -3.654  -5.364   6.371
  222    HB3  TRP  31           HB1      TRP  31  -3.531  -3.612   6.498
  223    HD1  TRP  31           HD1      TRP  31  -0.321  -4.554   7.835
  224    HE1  TRP  31           HE1      TRP  31   1.481  -4.656   5.992
  225    HE3  TRP  31           HE3      TRP  31  -3.336  -4.680   3.711
  226    HZ2  TRP  31           HZ2      TRP  31   1.601  -4.778   3.199
  227    HZ3  TRP  31           HZ3      TRP  31  -2.303  -4.770   1.502
  228    HH2  TRP  31           HH2      TRP  31   0.111  -4.820   1.249
  229    H    ARG  32           HN       ARG  32  -4.854  -6.450   8.765
  230    HA   ARG  32           HA       ARG  32  -7.226  -4.855   8.883
  231    HB2  ARG  32           HB2      ARG  32  -7.102  -7.350   8.187
  232    HB3  ARG  32           HB1      ARG  32  -6.934  -7.732   9.900
  233    HG2  ARG  32           HG2      ARG  32  -9.159  -6.272  10.108
  234    HG3  ARG  32           HG1      ARG  32  -9.326  -6.674   8.401
  235    HD2  ARG  32           HD2      ARG  32  -9.212  -8.589  10.746
  236    HD3  ARG  32           HD1      ARG  32 -10.599  -8.252   9.717
  237    HE   ARG  32           HE       ARG  32  -8.162  -9.612   8.709
  238   HH11  ARG  32          HH11      ARG  32 -11.920 -10.890   7.975
  239   HH12  ARG  32          HH12      ARG  32 -11.682  -9.490   8.968
  240   HH21  ARG  32          HH21      ARG  32  -8.517 -11.477   7.427
  241   HH22  ARG  32          HH22      ARG  32 -10.139 -12.005   7.108
  242    H    ALA  33           HN       ALA  33  -4.952  -6.190  11.204
  243    HA   ALA  33           HA       ALA  33  -6.552  -5.495  13.520
  244    HB1  ALA  33           HB1      ALA  33  -5.096  -7.477  13.570
  245    HB2  ALA  33           HB2      ALA  33  -4.606  -6.322  14.808
  246    HB3  ALA  33           HB3      ALA  33  -3.671  -6.468  13.315
  247    H    ARG  34           HN       ARG  34  -3.864  -4.147  11.703
  248    HA   ARG  34           HA       ARG  34  -3.144  -2.056  13.530
  249    HB2  ARG  34           HB2      ARG  34  -1.606  -2.990  11.851
  250    HB3  ARG  34           HB1      ARG  34  -2.614  -2.351  10.551
  251    HG2  ARG  34           HG2      ARG  34  -2.053  -0.125  11.024
  252    HG3  ARG  34           HG1      ARG  34  -1.543  -0.500  12.662
  253    HD2  ARG  34           HD2      ARG  34   0.421  -0.040  11.462
  254    HD3  ARG  34           HD1      ARG  34   0.394  -1.788  11.633
  255    HE   ARG  34           HE       ARG  34  -0.659  -0.584   9.167
  256   HH11  ARG  34          HH11      ARG  34   2.534  -3.036   9.170
  257   HH12  ARG  34          HH12      ARG  34   1.893  -2.480  10.683
  258   HH21  ARG  34          HH21      ARG  34   1.564  -2.380   7.213
  259   HH22  ARG  34          HH22      ARG  34   0.184  -1.327   7.212
  260    H    GLY  35           HN       GLY  35  -5.455  -2.419  10.931
  261    HA2  GLY  35           HA2      GLY  35  -7.152  -1.095  10.159
  262    HA3  GLY  35           HA1      GLY  35  -6.855   0.012  11.487
  263    H    ARG  36           HN       ARG  36  -4.132  -0.712   9.475
  264    HA   ARG  36           HA       ARG  36  -4.451   1.594   7.725
  265    HB2  ARG  36           HB2      ARG  36  -3.675   2.427  10.047
  266    HB3  ARG  36           HB1      ARG  36  -2.152   1.609   9.738
  267    HG2  ARG  36           HG2      ARG  36  -1.593   3.089   7.957
  268    HG3  ARG  36           HG1      ARG  36  -3.248   3.700   7.830
  269    HD2  ARG  36           HD2      ARG  36  -1.317   4.185  10.123
  270    HD3  ARG  36           HD1      ARG  36  -1.826   5.358   8.909
  271    HE   ARG  36           HE       ARG  36  -3.607   4.190  10.977
  272   HH11  ARG  36          HH11      ARG  36  -3.966   7.963   9.601
  273   HH12  ARG  36          HH12      ARG  36  -2.731   6.936   8.944
  274   HH21  ARG  36          HH21      ARG  36  -5.367   7.170  11.222
  275   HH22  ARG  36          HH22      ARG  36  -5.210   5.542  11.807
  276    H    VAL  37           HN       VAL  37  -2.992   1.578   5.988
  277    HA   VAL  37           HA       VAL  37  -1.430  -0.920   5.634
  278    HB   VAL  37           HB       VAL  37  -1.474  -0.380   3.167
  279   HG11  VAL  37          HG11      VAL  37  -3.098  -1.931   4.125
  280   HG12  VAL  37          HG12      VAL  37  -3.798  -1.025   2.784
  281   HG13  VAL  37          HG13      VAL  37  -4.209  -0.599   4.448
  282   HG21  VAL  37          HG21      VAL  37  -3.400   1.848   3.946
  283   HG22  VAL  37          HG22      VAL  37  -3.061   1.309   2.298
  284   HG23  VAL  37          HG23      VAL  37  -1.787   2.055   3.262
  285    HA   PRO  38           HA       PRO  38   2.414   1.469   5.212
  286    HB2  PRO  38           HB2      PRO  38   3.863  -0.150   3.541
  287    HB3  PRO  38           HB1      PRO  38   3.541  -0.594   5.229
  288    HG2  PRO  38           HG2      PRO  38   2.164  -1.550   2.749
  289    HG3  PRO  38           HG1      PRO  38   2.667  -2.470   4.181
  290    HD2  PRO  38           HD2      PRO  38   0.092  -1.608   3.779
  291    HD3  PRO  38           HD1      PRO  38   0.788  -1.873   5.391
  292    H    ALA  39           HN       ALA  39   3.783   2.384   3.432
  293    HA   ALA  39           HA       ALA  39   2.370   4.154   1.887
  294    HB1  ALA  39           HB1      ALA  39   4.719   4.471   2.556
  295    HB2  ALA  39           HB2      ALA  39   4.525   4.726   0.821
  296    HB3  ALA  39           HB3      ALA  39   5.230   3.221   1.421
  297    H    GLY  40           HN       GLY  40   1.503   4.144  -0.127
  298    HA2  GLY  40           HA2      GLY  40   1.425   3.869  -2.429
  299    HA3  GLY  40           HA1      GLY  40   2.507   2.492  -2.318
  300    H    ARG  41           HN       ARG  41   0.460   1.552  -0.072
  301    HA   ARG  41           HA       ARG  41  -0.752  -0.293  -1.965
  302    HB2  ARG  41           HB2      ARG  41   0.490  -0.995   0.162
  303    HB3  ARG  41           HB1      ARG  41  -0.903  -0.423   1.072
  304    HG2  ARG  41           HG2      ARG  41  -1.273  -2.738   0.869
  305    HG3  ARG  41           HG1      ARG  41  -2.308  -2.051  -0.378
  306    HD2  ARG  41           HD2      ARG  41   0.444  -3.253  -0.843
  307    HD3  ARG  41           HD1      ARG  41  -1.084  -4.074  -1.128
  308    HE   ARG  41           HE       ARG  41  -1.385  -1.966  -2.732
  309   HH11  ARG  41          HH11      ARG  41   1.963  -3.831  -3.986
  310   HH12  ARG  41          HH12      ARG  41   1.432  -4.056  -2.350
  311   HH21  ARG  41          HH21      ARG  41  -0.647  -1.743  -4.903
  312   HH22  ARG  41          HH22      ARG  41   0.809  -2.541  -5.404
  313    H    CYS  42           HN       CYS  42  -1.827   2.433  -0.104
  314    HA   CYS  42           HA       CYS  42  -4.545   1.750   0.296
  315    HB2  CYS  42           HB2      CYS  42  -3.745   3.600   1.530
  316    HB3  CYS  42           HB1      CYS  42  -3.124   4.407   0.100
  317    H    ILE  43           HN       ILE  43  -2.830   2.918  -2.541
  318    HA   ILE  43           HA       ILE  43  -4.812   3.846  -4.231
  319    HB   ILE  43           HB       ILE  43  -2.393   2.083  -4.836
  320   HG12  ILE  43          HG12      ILE  43  -2.761   5.107  -5.124
  321   HG13  ILE  43          HG11      ILE  43  -1.888   4.304  -3.822
  322   HG21  ILE  43          HG21      ILE  43  -4.084   3.588  -6.865
  323   HG22  ILE  43          HG22      ILE  43  -3.956   1.836  -6.709
  324   HG23  ILE  43          HG23      ILE  43  -2.554   2.781  -7.211
  325   HD11  ILE  43          HD11      ILE  43  -1.113   4.309  -6.740
  326   HD12  ILE  43          HD12      ILE  43  -0.259   3.455  -5.451
  327   HD13  ILE  43          HD13      ILE  43  -0.351   5.214  -5.431
  328    H    ASP  44           HN       ASP  44  -3.914   0.475  -3.613
  329    HA   ASP  44           HA       ASP  44  -5.680  -0.615  -5.623
  330    HB2  ASP  44           HB2      ASP  44  -4.270  -2.177  -3.438
  331    HB3  ASP  44           HB1      ASP  44  -4.754  -2.747  -5.033
  332    H    ILE  45           HN       ILE  45  -5.541  -0.629  -2.073
  333    HA   ILE  45           HA       ILE  45  -7.976  -2.002  -1.643
  334    HB   ILE  45           HB       ILE  45  -6.346  -0.174   0.177
  335   HG12  ILE  45          HG12      ILE  45  -6.675  -3.200  -0.074
  336   HG13  ILE  45          HG11      ILE  45  -5.210  -2.261  -0.319
  337   HG21  ILE  45          HG21      ILE  45  -8.752  -1.833   1.002
  338   HG22  ILE  45          HG22      ILE  45  -8.704  -0.068   0.933
  339   HG23  ILE  45          HG23      ILE  45  -7.691  -0.938   2.087
  340   HD11  ILE  45          HD11      ILE  45  -6.579  -2.855   2.309
  341   HD12  ILE  45          HD12      ILE  45  -5.210  -1.760   2.118
  342   HD13  ILE  45          HD13      ILE  45  -5.029  -3.465   1.723
  343    H    GLU  46           HN       GLU  46  -7.269   1.368  -2.378
  344    HA   GLU  46           HA       GLU  46  -9.776   2.533  -1.709
  345    HB2  GLU  46           HB2      GLU  46  -7.735   3.889  -2.132
  346    HB3  GLU  46           HB1      GLU  46  -7.772   3.433  -3.833
  347    HG2  GLU  46           HG2      GLU  46  -9.989   4.553  -4.052
  348    HG3  GLU  46           HG1      GLU  46  -9.880   5.053  -2.364
  349    H    LEU  47           HN       LEU  47  -8.521   0.940  -4.636
  350    HA   LEU  47           HA       LEU  47 -10.618   1.273  -6.444
  351    HB2  LEU  47           HB2      LEU  47  -8.865  -1.146  -5.901
  352    HB3  LEU  47           HB1      LEU  47  -9.985  -1.104  -7.242
  353    HG   LEU  47           HG       LEU  47  -7.770   0.971  -6.972
  354   HD11  LEU  47          HD11      LEU  47  -7.590  -1.682  -8.453
  355   HD12  LEU  47          HD12      LEU  47  -6.700  -1.254  -6.990
  356   HD13  LEU  47          HD13      LEU  47  -6.396  -0.379  -8.487
  357   HD21  LEU  47          HD21      LEU  47  -9.383  -0.039  -9.333
  358   HD22  LEU  47          HD22      LEU  47  -8.120   1.198  -9.390
  359   HD23  LEU  47          HD23      LEU  47  -9.610   1.506  -8.502
  360    H    TYR  48           HN       TYR  48 -10.307  -0.964  -3.709
  361    HA   TYR  48           HA       TYR  48 -12.904  -2.236  -4.273
  362    HB2  TYR  48           HB2      TYR  48 -11.187  -2.947  -1.866
  363    HB3  TYR  48           HB1      TYR  48 -12.258  -3.986  -2.820
  364    HD1  TYR  48           HD1      TYR  48  -9.090  -4.076  -1.975
  365    HD2  TYR  48           HD2      TYR  48 -11.224  -3.420  -5.621
  366    HE1  TYR  48           HE1      TYR  48  -7.134  -4.820  -3.256
  367    HE2  TYR  48           HE2      TYR  48  -9.260  -4.151  -6.908
  368    HH   TYR  48           HH       TYR  48  -6.559  -5.686  -5.409
  369    H    THR  49           HN       THR  49 -11.648   0.277  -2.279
  370    HA   THR  49           HA       THR  49 -14.158   0.425  -0.696
  371    HB   THR  49           HB       THR  49 -12.954   1.797   0.929
  372    HG1  THR  49           HG1      THR  49 -11.503   2.952  -0.267
  373   HG21  THR  49          HG21      THR  49 -11.213  -0.593   0.237
  374   HG22  THR  49          HG22      THR  49 -12.673  -0.644   1.223
  375   HG23  THR  49          HG23      THR  49 -11.258   0.241   1.789
  376    H    ASP  50           HN       ASP  50 -14.732   1.053  -3.038
  377    HA   ASP  50           HA       ASP  50 -13.881   3.566  -4.150
  378    HB2  ASP  50           HB2      ASP  50 -14.445   1.466  -5.445
  379    HB3  ASP  50           HB1      ASP  50 -16.132   1.695  -5.024
  380    H    GLY  51           HN       GLY  51 -14.979   4.238  -1.678
  381    HA2  GLY  51           HA2      GLY  51 -16.162   6.456  -1.594
  382    HA3  GLY  51           HA1      GLY  51 -17.538   5.621  -2.308
  383    H    ARG  52           HN       ARG  52 -16.605   3.221  -0.561
  384    HA   ARG  52           HA       ARG  52 -18.504   3.596   1.516
  385    HB2  ARG  52           HB2      ARG  52 -17.912   1.406   0.396
  386    HB3  ARG  52           HB1      ARG  52 -16.383   1.408   1.272
  387    HG2  ARG  52           HG2      ARG  52 -17.532   1.181   3.401
  388    HG3  ARG  52           HG1      ARG  52 -19.105   1.419   2.633
  389    HD2  ARG  52           HD2      ARG  52 -18.608  -0.690   1.269
  390    HD3  ARG  52           HD1      ARG  52 -17.240  -0.947   2.348
  391    HE   ARG  52           HE       ARG  52 -18.860  -1.074   4.205
  392   HH11  ARG  52          HH11      ARG  52 -21.413  -2.578   1.461
  393   HH12  ARG  52          HH12      ARG  52 -20.057  -1.631   0.937
  394   HH21  ARG  52          HH21      ARG  52 -21.747  -2.971   3.681
  395   HH22  ARG  52          HH22      ARG  52 -20.659  -2.334   4.877
  396    H    VAL  53           HN       VAL  53 -14.956   3.368   1.514
  397    HA   VAL  53           HA       VAL  53 -14.728   5.187   3.768
  398    HB   VAL  53           HB       VAL  53 -14.878   2.976   4.923
  399   HG11  VAL  53          HG11      VAL  53 -13.175   1.245   4.621
  400   HG12  VAL  53          HG12      VAL  53 -12.451   2.177   3.307
  401   HG13  VAL  53          HG13      VAL  53 -14.086   1.528   3.134
  402   HG21  VAL  53          HG21      VAL  53 -13.471   4.708   5.959
  403   HG22  VAL  53          HG22      VAL  53 -12.068   4.129   5.058
  404   HG23  VAL  53          HG23      VAL  53 -12.820   3.096   6.278
  405    H    GLU  54           HN       GLU  54 -12.684   6.197   3.804
  406    HA   GLU  54           HA       GLU  54 -10.970   5.895   1.445
  407    HB2  GLU  54           HB2      GLU  54 -11.662   8.158   2.149
  408    HB3  GLU  54           HB1      GLU  54 -10.970   7.897   3.745
  409    HG2  GLU  54           HG2      GLU  54  -8.702   7.689   2.649
  410    HG3  GLU  54           HG1      GLU  54  -9.457   8.142   1.120
  411    H    CYS  55           HN       CYS  55  -9.090   4.762   1.539
  412    HA   CYS  55           HA       CYS  55  -8.068   3.670   4.037
  413    HB2  CYS  55           HB2      CYS  55  -6.288   2.667   2.500
  414    HB3  CYS  55           HB1      CYS  55  -7.944   2.184   2.153
  415    H    ARG  56           HN       ARG  56  -6.120   4.230   5.000
  416    HA   ARG  56           HA       ARG  56  -4.687   6.609   3.959
  417    HB2  ARG  56           HB2      ARG  56  -5.211   5.867   6.878
  418    HB3  ARG  56           HB1      ARG  56  -4.036   7.077   6.383
  419    HG2  ARG  56           HG2      ARG  56  -5.931   8.349   6.973
  420    HG3  ARG  56           HG1      ARG  56  -6.001   8.279   5.213
  421    HD2  ARG  56           HD2      ARG  56  -7.629   6.322   5.484
  422    HD3  ARG  56           HD1      ARG  56  -7.672   6.715   7.204
  423    HE   ARG  56           HE       ARG  56  -8.263   8.936   5.454
  424   HH11  ARG  56          HH11      ARG  56 -11.260   6.901   7.209
  425   HH12  ARG  56          HH12      ARG  56  -9.670   6.217   7.180
  426   HH21  ARG  56          HH21      ARG  56 -10.338   9.799   5.463
  427   HH22  ARG  56          HH22      ARG  56 -11.637   8.943   6.229
  428    H    GLU  57           HN       GLU  57  -2.777   6.089   3.253
  429    HA   GLU  57           HA       GLU  57  -1.308   3.748   4.261
  430    HB2  GLU  57           HB2      GLU  57   0.212   4.171   2.302
  431    HB3  GLU  57           HB1      GLU  57  -1.453   3.815   1.852
  432    HG2  GLU  57           HG2      GLU  57  -1.887   6.186   1.450
  433    HG3  GLU  57           HG1      GLU  57  -0.254   6.595   1.974
  434    H    LEU  58           HN       LEU  58   0.825   3.918   4.932
  435    HA   LEU  58           HA       LEU  58   1.496   6.260   6.430
  436    HB2  LEU  58           HB2      LEU  58   3.007   3.667   5.927
  437    HB3  LEU  58           HB1      LEU  58   3.532   4.905   7.065
  438    HG   LEU  58           HG       LEU  58   0.827   3.516   7.293
  439   HD11  LEU  58          HD11      LEU  58   1.734   2.087   9.022
  440   HD12  LEU  58          HD12      LEU  58   3.356   2.744   8.763
  441   HD13  LEU  58          HD13      LEU  58   2.564   1.811   7.489
  442   HD21  LEU  58          HD21      LEU  58   2.410   5.170   9.283
  443   HD22  LEU  58          HD22      LEU  58   0.879   4.351   9.610
  444   HD23  LEU  58          HD23      LEU  58   0.942   5.660   8.433
  445    H    ARG  59           HN       ARG  59   3.648   7.347   6.232
  446    HA   ARG  59           HA       ARG  59   3.955   8.482   3.686
  447    HB2  ARG  59           HB2      ARG  59   6.200   9.386   4.636
  448    HB3  ARG  59           HB1      ARG  59   4.694   9.878   5.387
  449    HG2  ARG  59           HG2      ARG  59   5.959   9.506   7.267
  450    HG3  ARG  59           HG1      ARG  59   5.199   7.932   7.100
  451    HD2  ARG  59           HD2      ARG  59   7.985   8.563   6.075
  452    HD3  ARG  59           HD1      ARG  59   7.661   7.921   7.685
  453    HE   ARG  59           HE       ARG  59   7.460   6.525   5.142
  454   HH11  ARG  59          HH11      ARG  59   6.828   4.620   8.633
  455   HH12  ARG  59          HH12      ARG  59   6.956   6.352   8.624
  456   HH21  ARG  59          HH21      ARG  59   7.189   4.278   5.165
  457   HH22  ARG  59          HH22      ARG  59   6.962   3.455   6.676
  458    HA   PRO  60           HA       PRO  60   6.718   5.841   1.393
  459    HB2  PRO  60           HB2      PRO  60   8.595   7.574   0.298
  460    HB3  PRO  60           HB1      PRO  60   6.939   7.413  -0.318
  461    HG2  PRO  60           HG2      PRO  60   8.070   9.505   1.512
  462    HG3  PRO  60           HG1      PRO  60   6.949   9.688   0.148
  463    HD2  PRO  60           HD2      PRO  60   6.099   9.685   2.744
  464    HD3  PRO  60           HD1      PRO  60   5.091   9.042   1.414
  465    H    ASP  61           HN       ASP  61   8.693   4.820   1.577
  466    HA   ASP  61           HA       ASP  61  10.443   5.523   3.873
  467    HB2  ASP  61           HB2      ASP  61   8.802   3.723   4.480
  468    HB3  ASP  61           HB1      ASP  61   9.368   2.747   3.131
  469    H    VAL  62           HN       VAL  62  10.176   3.148   1.228
  470    HA   VAL  62           HA       VAL  62  12.774   4.030   0.139
  471    HB   VAL  62           HB       VAL  62  13.164   1.564  -0.538
  472   HG11  VAL  62          HG11      VAL  62  14.259   0.987   1.599
  473   HG12  VAL  62          HG12      VAL  62  13.358   2.267   2.418
  474   HG13  VAL  62          HG13      VAL  62  14.537   2.677   1.168
  475   HG21  VAL  62          HG21      VAL  62  10.915   0.680  -0.025
  476   HG22  VAL  62          HG22      VAL  62  11.149   1.029   1.686
  477   HG23  VAL  62          HG23      VAL  62  12.147  -0.193   0.890
  478    H    PHE  63           HN       PHE  63  11.711   5.292  -1.339
  479    HA   PHE  63           HA       PHE  63  10.028   3.933  -3.371
  480    HB2  PHE  63           HB2      PHE  63   8.726   5.429  -1.807
  481    HB3  PHE  63           HB1      PHE  63   9.689   6.794  -2.365
  482    HD1  PHE  63           HD1      PHE  63   7.991   3.954  -4.191
  483    HD2  PHE  63           HD2      PHE  63   8.286   8.198  -3.670
  484    HE1  PHE  63           HE1      PHE  63   6.355   4.292  -5.995
  485    HE2  PHE  63           HE2      PHE  63   6.645   8.520  -5.480
  486    HZ   PHE  63           HZ       PHE  63   5.679   6.572  -6.641
  487    H    GLY  64           HN       GLY  64  11.585   3.648  -4.918
  488    HA2  GLY  64           HA2      GLY  64  12.887   6.063  -6.077
  489    HA3  GLY  64           HA1      GLY  64  13.694   4.501  -5.944
  490    H    ALA  65           HN       ALA  65  10.572   5.737  -7.089
  491    HA   ALA  65           HA       ALA  65  10.220   3.814  -9.158
  492    HB1  ALA  65           HB1      ALA  65   8.819   6.473  -8.707
  493    HB2  ALA  65           HB2      ALA  65   8.330   4.911  -8.044
  494    HB3  ALA  65           HB3      ALA  65   8.271   5.183  -9.786
  Start of MODEL   20
    1    H1   MET   1           HT1      MET   1 -15.609  -3.406   9.258
    2    H2   MET   1           HT2      MET   1 -14.283  -2.989   8.298
    3    H3   MET   1           HT3      MET   1 -15.525  -1.868   8.546
    4    HA   MET   1           HA       MET   1 -15.011  -1.697  10.856
    5    HB2  MET   1           HB2      MET   1 -14.194  -4.033  11.153
    6    HB3  MET   1           HB1      MET   1 -12.749  -3.645  10.231
    7    HG2  MET   1           HG2      MET   1 -12.074  -2.030  11.979
    8    HG3  MET   1           HG1      MET   1 -13.525  -2.431  12.899
    9    HE1  MET   1           HE1      MET   1 -10.072  -3.741  11.544
   10    HE2  MET   1           HE2      MET   1 -11.204  -4.901  10.846
   11    HE3  MET   1           HE3      MET   1 -10.079  -5.414  12.104
   12    H    ASN   2           HN       ASN   2 -12.455  -2.206   8.447
   13    HA   ASN   2           HA       ASN   2 -11.930   0.669   8.251
   14    HB2  ASN   2           HB2      ASN   2  -9.442   0.274   8.415
   15    HB3  ASN   2           HB1      ASN   2 -10.305   0.047   9.930
   16   HD21  ASN   2          HD21      ASN   2  -8.691  -1.204  10.796
   17   HD22  ASN   2          HD22      ASN   2  -8.379  -2.821  10.289
   18    H    ALA   3           HN       ALA   3 -10.298   1.018   6.426
   19    HA   ALA   3           HA       ALA   3 -11.239   0.314   3.991
   20    HB1  ALA   3           HB1      ALA   3  -9.595   2.077   4.400
   21    HB2  ALA   3           HB2      ALA   3  -9.095   1.035   3.069
   22    HB3  ALA   3           HB3      ALA   3  -8.343   0.857   4.657
   23    H    ILE   4           HN       ILE   4  -8.690  -1.423   5.736
   24    HA   ILE   4           HA       ILE   4  -7.958  -3.182   3.627
   25    HB   ILE   4           HB       ILE   4  -7.558  -3.798   6.575
   26   HG12  ILE   4          HG12      ILE   4  -5.205  -2.652   6.145
   27   HG13  ILE   4          HG11      ILE   4  -6.066  -1.764   4.900
   28   HG21  ILE   4          HG21      ILE   4  -5.540  -4.980   5.827
   29   HG22  ILE   4          HG22      ILE   4  -5.897  -4.543   4.155
   30   HG23  ILE   4          HG23      ILE   4  -6.984  -5.615   5.041
   31   HD11  ILE   4          HD11      ILE   4  -6.634  -1.745   7.869
   32   HD12  ILE   4          HD12      ILE   4  -7.605  -0.887   6.666
   33   HD13  ILE   4          HD13      ILE   4  -5.907  -0.455   6.913
   34    H    ASP   5           HN       ASP   5 -10.174  -3.400   6.367
   35    HA   ASP   5           HA       ASP   5 -10.956  -6.127   6.148
   36    HB2  ASP   5           HB2      ASP   5 -11.241  -4.826   8.216
   37    HB3  ASP   5           HB1      ASP   5 -12.373  -3.744   7.411
   38    H    ILE   6           HN       ILE   6 -12.266  -3.148   4.832
   39    HA   ILE   6           HA       ILE   6 -14.719  -4.279   3.858
   40    HB   ILE   6           HB       ILE   6 -13.322  -1.612   3.425
   41   HG12  ILE   6          HG12      ILE   6 -14.191  -1.951   5.694
   42   HG13  ILE   6          HG11      ILE   6 -15.125  -0.710   4.874
   43   HG21  ILE   6          HG21      ILE   6 -14.638  -2.004   1.416
   44   HG22  ILE   6          HG22      ILE   6 -15.373  -0.738   2.392
   45   HG23  ILE   6          HG23      ILE   6 -16.073  -2.358   2.383
   46   HD11  ILE   6          HD11      ILE   6 -16.929  -2.356   4.497
   47   HD12  ILE   6          HD12      ILE   6 -16.563  -2.125   6.207
   48   HD13  ILE   6          HD13      ILE   6 -15.984  -3.566   5.370
   49    H    ALA   7           HN       ALA   7 -11.507  -3.737   2.540
   50    HA   ALA   7           HA       ALA   7 -12.132  -4.393  -0.184
   51    HB1  ALA   7           HB1      ALA   7  -9.721  -4.545  -0.519
   52    HB2  ALA   7           HB2      ALA   7  -9.454  -4.519   1.231
   53    HB3  ALA   7           HB3      ALA   7 -10.123  -3.103   0.422
   54    H    ILE   8           HN       ILE   8 -11.138  -6.281   2.649
   55    HA   ILE   8           HA       ILE   8 -10.802  -8.846   1.526
   56    HB   ILE   8           HB       ILE   8 -12.006  -8.067   4.229
   57   HG12  ILE   8          HG12      ILE   8  -9.169  -8.977   3.562
   58   HG13  ILE   8          HG11      ILE   8  -9.652  -7.311   3.847
   59   HG21  ILE   8          HG21      ILE   8 -11.508 -10.367   5.005
   60   HG22  ILE   8          HG22      ILE   8 -11.023 -10.815   3.367
   61   HG23  ILE   8          HG23      ILE   8 -12.694 -10.359   3.702
   62   HD11  ILE   8          HD11      ILE   8  -8.570  -8.219   5.779
   63   HD12  ILE   8          HD12      ILE   8  -9.716  -9.555   5.849
   64   HD13  ILE   8          HD13      ILE   8 -10.265  -7.904   6.151
   65    H    ASN   9           HN       ASN   9 -13.716  -7.189   2.680
   66    HA   ASN   9           HA       ASN   9 -15.571  -9.287   2.155
   67    HB2  ASN   9           HB2      ASN   9 -15.954  -6.291   2.540
   68    HB3  ASN   9           HB1      ASN   9 -17.304  -7.398   2.314
   69   HD21  ASN   9          HD21      ASN   9 -14.389  -8.103   4.243
   70   HD22  ASN   9          HD22      ASN   9 -15.201  -8.139   5.760
   71    H    LYS  10           HN       LYS  10 -14.471  -6.476   0.303
   72    HA   LYS  10           HA       LYS  10 -16.443  -6.548  -1.729
   73    HB2  LYS  10           HB2      LYS  10 -15.002  -4.560  -1.045
   74    HB3  LYS  10           HB1      LYS  10 -13.663  -5.273  -1.933
   75    HG2  LYS  10           HG2      LYS  10 -16.296  -4.682  -3.315
   76    HG3  LYS  10           HG1      LYS  10 -15.114  -3.404  -3.039
   77    HD2  LYS  10           HD2      LYS  10 -13.434  -4.639  -4.329
   78    HD3  LYS  10           HD1      LYS  10 -14.569  -5.969  -4.568
   79    HE2  LYS  10           HE2      LYS  10 -16.084  -4.397  -5.785
   80    HE3  LYS  10           HE1      LYS  10 -14.858  -3.141  -5.620
   81    HZ1  LYS  10           HZ1      LYS  10 -14.455  -5.730  -7.019
   82    HZ2  LYS  10           HZ2      LYS  10 -13.346  -4.456  -6.939
   83    HZ3  LYS  10           HZ3      LYS  10 -14.801  -4.262  -7.784
   84    H    LEU  11           HN       LEU  11 -13.204  -8.004  -1.498
   85    HA   LEU  11           HA       LEU  11 -13.444  -9.185  -4.170
   86    HB2  LEU  11           HB2      LEU  11 -11.239  -9.628  -2.126
   87    HB3  LEU  11           HB1      LEU  11 -11.207 -10.086  -3.820
   88    HG   LEU  11           HG       LEU  11 -10.865  -7.348  -2.585
   89   HD11  LEU  11          HD11      LEU  11  -8.908  -7.221  -4.069
   90   HD12  LEU  11          HD12      LEU  11  -9.307  -8.804  -4.747
   91   HD13  LEU  11          HD13      LEU  11  -8.850  -8.660  -3.052
   92   HD21  LEU  11          HD21      LEU  11 -11.085  -6.267  -4.766
   93   HD22  LEU  11          HD22      LEU  11 -12.605  -6.979  -4.242
   94   HD23  LEU  11          HD23      LEU  11 -11.639  -7.788  -5.481
   95    H    GLY  12           HN       GLY  12 -14.068 -10.026  -0.869
   96    HA2  GLY  12           HA2      GLY  12 -15.556 -11.848  -0.370
   97    HA3  GLY  12           HA1      GLY  12 -14.830 -12.779  -1.672
   98    H    SER  13           HN       SER  13 -12.044 -12.076  -0.909
   99    HA   SER  13           HA       SER  13 -11.728 -13.382   1.695
  100    HB2  SER  13           HB2      SER  13 -10.271 -15.168   0.761
  101    HB3  SER  13           HB1      SER  13 -11.915 -15.268   0.128
  102    HG   SER  13           HG       SER  13 -11.030 -15.179  -1.763
  103    H    VAL  14           HN       VAL  14  -9.534 -13.533   2.402
  104    HA   VAL  14           HA       VAL  14  -7.898 -11.216   1.855
  105    HB   VAL  14           HB       VAL  14  -7.703 -13.561   3.806
  106   HG11  VAL  14          HG11      VAL  14  -5.816 -12.432   4.916
  107   HG12  VAL  14          HG12      VAL  14  -5.764 -11.234   3.620
  108   HG13  VAL  14          HG13      VAL  14  -5.397 -12.920   3.275
  109   HG21  VAL  14          HG21      VAL  14  -9.411 -11.884   4.301
  110   HG22  VAL  14          HG22      VAL  14  -8.207 -10.592   4.195
  111   HG23  VAL  14          HG23      VAL  14  -8.113 -11.797   5.495
  112    H    SER  15           HN       SER  15  -7.935 -14.613   1.023
  113    HA   SER  15           HA       SER  15  -5.332 -14.829  -0.052
  114    HB2  SER  15           HB2      SER  15  -6.432 -16.768  -1.397
  115    HB3  SER  15           HB1      SER  15  -6.450 -16.880   0.362
  116    HG   SER  15           HG       SER  15  -8.583 -16.073  -1.335
  117    H    ALA  16           HN       ALA  16  -8.447 -13.822  -1.471
  118    HA   ALA  16           HA       ALA  16  -7.425 -13.251  -4.086
  119    HB1  ALA  16           HB1      ALA  16  -9.911 -12.165  -2.720
  120    HB2  ALA  16           HB2      ALA  16  -9.824 -13.630  -3.699
  121    HB3  ALA  16           HB3      ALA  16  -9.548 -12.053  -4.443
  122    H    LEU  17           HN       LEU  17  -7.903 -11.322  -1.126
  123    HA   LEU  17           HA       LEU  17  -7.373  -8.790  -2.276
  124    HB2  LEU  17           HB2      LEU  17  -8.591  -9.086  -0.129
  125    HB3  LEU  17           HB1      LEU  17  -7.104  -9.634   0.636
  126    HG   LEU  17           HG       LEU  17  -6.089  -7.440   0.364
  127   HD11  LEU  17          HD11      LEU  17  -7.337  -5.499  -0.526
  128   HD12  LEU  17          HD12      LEU  17  -8.661  -6.567  -0.999
  129   HD13  LEU  17          HD13      LEU  17  -7.075  -6.731  -1.758
  130   HD21  LEU  17          HD21      LEU  17  -8.851  -7.144   1.559
  131   HD22  LEU  17          HD22      LEU  17  -7.444  -6.125   1.884
  132   HD23  LEU  17          HD23      LEU  17  -7.428  -7.818   2.363
  133    H    ALA  18           HN       ALA  18  -5.277 -11.094  -0.627
  134    HA   ALA  18           HA       ALA  18  -2.967  -9.381  -0.556
  135    HB1  ALA  18           HB1      ALA  18  -3.445 -11.085   1.163
  136    HB2  ALA  18           HB2      ALA  18  -1.848 -11.297   0.439
  137    HB3  ALA  18           HB3      ALA  18  -3.181 -12.359  -0.031
  138    H    ALA  19           HN       ALA  19  -4.166 -11.925  -2.704
  139    HA   ALA  19           HA       ALA  19  -1.863 -12.257  -4.336
  140    HB1  ALA  19           HB1      ALA  19  -3.432 -13.133  -6.029
  141    HB2  ALA  19           HB2      ALA  19  -4.797 -12.489  -5.111
  142    HB3  ALA  19           HB3      ALA  19  -3.804 -13.778  -4.428
  143    H    ALA  20           HN       ALA  20  -4.559  -9.987  -4.399
  144    HA   ALA  20           HA       ALA  20  -3.805  -8.574  -6.784
  145    HB1  ALA  20           HB1      ALA  20  -5.740  -7.811  -4.573
  146    HB2  ALA  20           HB2      ALA  20  -6.137  -8.721  -6.032
  147    HB3  ALA  20           HB3      ALA  20  -5.623  -7.038  -6.155
  148    H    LEU  21           HN       LEU  21  -3.046  -8.272  -3.384
  149    HA   LEU  21           HA       LEU  21  -1.796  -5.629  -3.695
  150    HB2  LEU  21           HB2      LEU  21  -2.447  -7.331  -1.275
  151    HB3  LEU  21           HB1      LEU  21  -1.495  -5.856  -1.151
  152    HG   LEU  21           HG       LEU  21  -4.341  -5.961  -2.244
  153   HD11  LEU  21          HD11      LEU  21  -3.397  -5.142   0.513
  154   HD12  LEU  21          HD12      LEU  21  -4.391  -6.542   0.095
  155   HD13  LEU  21          HD13      LEU  21  -5.033  -4.915  -0.122
  156   HD21  LEU  21          HD21      LEU  21  -3.044  -4.082  -3.120
  157   HD22  LEU  21          HD22      LEU  21  -2.617  -3.589  -1.481
  158   HD23  LEU  21          HD23      LEU  21  -4.297  -3.520  -2.017
  159    H    GLY  22           HN       GLY  22  -0.861  -8.831  -3.965
  160    HA2  GLY  22           HA2      GLY  22   1.196  -9.708  -4.557
  161    HA3  GLY  22           HA1      GLY  22   1.892  -8.106  -4.385
  162    H    VAL  23           HN       VAL  23   0.197  -9.239  -1.640
  163    HA   VAL  23           HA       VAL  23   2.698  -9.968  -0.209
  164    HB   VAL  23           HB       VAL  23   1.593  -9.158   1.876
  165   HG11  VAL  23          HG11      VAL  23   3.051  -7.604   0.690
  166   HG12  VAL  23          HG12      VAL  23   1.703  -6.726   1.423
  167   HG13  VAL  23          HG13      VAL  23   1.703  -7.053  -0.314
  168   HG21  VAL  23          HG21      VAL  23  -0.674  -8.218   0.066
  169   HG22  VAL  23          HG22      VAL  23  -0.500  -7.819   1.776
  170   HG23  VAL  23          HG23      VAL  23  -0.774  -9.491   1.289
  171    H    ASN  24           HN       ASN  24   1.895 -11.244   1.983
  172    HA   ASN  24           HA       ASN  24   0.285 -13.527   1.064
  173    HB2  ASN  24           HB2      ASN  24   1.148 -14.782   2.920
  174    HB3  ASN  24           HB1      ASN  24   2.501 -13.941   2.188
  175   HD21  ASN  24          HD21      ASN  24   2.315 -15.043   4.848
  176   HD22  ASN  24          HD22      ASN  24   2.580 -13.736   5.946
  177    H    GLN  25           HN       GLN  25  -1.036 -14.529   2.923
  178    HA   GLN  25           HA       GLN  25  -3.266 -12.790   3.268
  179    HB2  GLN  25           HB2      GLN  25  -2.697 -15.638   4.167
  180    HB3  GLN  25           HB1      GLN  25  -4.215 -14.831   4.518
  181    HG2  GLN  25           HG2      GLN  25  -4.554 -16.216   2.605
  182    HG3  GLN  25           HG1      GLN  25  -4.585 -14.541   2.060
  183   HE21  GLN  25          HE21      GLN  25  -2.844 -13.790   0.776
  184   HE22  GLN  25          HE22      GLN  25  -1.796 -14.869  -0.063
  185    H    SER  26           HN       SER  26  -0.687 -13.853   5.363
  186    HA   SER  26           HA       SER  26  -1.788 -13.053   7.866
  187    HB2  SER  26           HB2      SER  26   0.040 -14.707   7.661
  188    HB3  SER  26           HB1      SER  26   1.112 -13.469   7.020
  189    HG   SER  26           HG       SER  26   0.094 -12.640   9.353
  190    H    ALA  27           HN       ALA  27   0.054 -11.350   5.366
  191    HA   ALA  27           HA       ALA  27   0.796  -9.047   6.880
  192    HB1  ALA  27           HB1      ALA  27   1.263  -7.974   4.719
  193    HB2  ALA  27           HB2      ALA  27   0.420  -9.282   3.880
  194    HB3  ALA  27           HB3      ALA  27   1.906  -9.616   4.766
  195    H    ILE  28           HN       ILE  28  -2.031  -9.828   4.920
  196    HA   ILE  28           HA       ILE  28  -3.300  -7.283   4.928
  197    HB   ILE  28           HB       ILE  28  -4.543 -10.066   4.719
  198   HG12  ILE  28          HG12      ILE  28  -2.850  -9.699   2.981
  199   HG13  ILE  28          HG11      ILE  28  -4.460  -9.717   2.271
  200   HG21  ILE  28          HG21      ILE  28  -6.429  -8.972   3.591
  201   HG22  ILE  28          HG22      ILE  28  -5.708  -7.389   3.892
  202   HG23  ILE  28          HG23      ILE  28  -6.247  -8.391   5.244
  203   HD11  ILE  28          HD11      ILE  28  -3.109  -8.003   1.263
  204   HD12  ILE  28          HD12      ILE  28  -2.777  -7.282   2.836
  205   HD13  ILE  28          HD13      ILE  28  -4.416  -7.257   2.179
  206    H    SER  29           HN       SER  29  -3.769 -10.174   6.908
  207    HA   SER  29           HA       SER  29  -5.681  -9.221   8.719
  208    HB2  SER  29           HB2      SER  29  -3.475 -11.260   9.228
  209    HB3  SER  29           HB1      SER  29  -5.026 -11.150  10.068
  210    HG   SER  29           HG       SER  29  -4.443 -12.422   7.782
  211    H    GLN  30           HN       GLN  30  -2.199  -8.888   8.637
  212    HA   GLN  30           HA       GLN  30  -1.783  -7.738  11.213
  213    HB2  GLN  30           HB2      GLN  30   0.028  -8.821  10.009
  214    HB3  GLN  30           HB1      GLN  30  -0.150  -7.723   8.647
  215    HG2  GLN  30           HG2      GLN  30   0.600  -5.849  10.113
  216    HG3  GLN  30           HG1      GLN  30   0.866  -7.009  11.417
  217   HE21  GLN  30          HE21      GLN  30   2.776  -5.262  10.003
  218   HE22  GLN  30          HE22      GLN  30   3.987  -6.304   9.353
  219    H    TRP  31           HN       TRP  31  -2.198  -6.341   7.952
  220    HA   TRP  31           HA       TRP  31  -1.806  -3.616   8.685
  221    HB2  TRP  31           HB2      TRP  31  -3.283  -4.784   6.294
  222    HB3  TRP  31           HB1      TRP  31  -2.842  -3.088   6.471
  223    HD1  TRP  31           HD1      TRP  31   0.192  -4.404   7.684
  224    HE1  TRP  31           HE1      TRP  31   1.900  -4.852   5.823
  225    HE3  TRP  31           HE3      TRP  31  -2.939  -4.393   3.629
  226    HZ2  TRP  31           HZ2      TRP  31   1.933  -5.166   3.026
  227    HZ3  TRP  31           HZ3      TRP  31  -1.992  -4.760   1.404
  228    HH2  TRP  31           HH2      TRP  31   0.394  -5.139   1.105
  229    H    ARG  32           HN       ARG  32  -4.536  -5.726   8.624
  230    HA   ARG  32           HA       ARG  32  -6.586  -3.730   8.857
  231    HB2  ARG  32           HB2      ARG  32  -6.952  -5.953   7.788
  232    HB3  ARG  32           HB1      ARG  32  -6.689  -6.745   9.342
  233    HG2  ARG  32           HG2      ARG  32  -8.662  -5.599  10.258
  234    HG3  ARG  32           HG1      ARG  32  -8.925  -4.791   8.710
  235    HD2  ARG  32           HD2      ARG  32 -10.433  -6.672   8.922
  236    HD3  ARG  32           HD1      ARG  32  -9.265  -7.008   7.646
  237    HE   ARG  32           HE       ARG  32  -8.187  -8.159   9.879
  238   HH11  ARG  32          HH11      ARG  32 -11.476 -10.157   8.666
  239   HH12  ARG  32          HH12      ARG  32 -11.257  -8.507   8.183
  240   HH21  ARG  32          HH21      ARG  32  -8.498 -10.290  10.569
  241   HH22  ARG  32          HH22      ARG  32  -9.887 -11.175  10.039
  242    H    ALA  33           HN       ALA  33  -4.868  -5.922  11.042
  243    HA   ALA  33           HA       ALA  33  -6.248  -5.138  13.413
  244    HB1  ALA  33           HB1      ALA  33  -5.042  -7.280  13.255
  245    HB2  ALA  33           HB2      ALA  33  -4.425  -6.322  14.600
  246    HB3  ALA  33           HB3      ALA  33  -3.505  -6.423  13.098
  247    H    ARG  34           HN       ARG  34  -3.513  -3.931  11.653
  248    HA   ARG  34           HA       ARG  34  -2.491  -2.048  13.570
  249    HB2  ARG  34           HB2      ARG  34  -1.114  -3.057  11.775
  250    HB3  ARG  34           HB1      ARG  34  -2.182  -2.386  10.554
  251    HG2  ARG  34           HG2      ARG  34  -0.216  -1.090  10.558
  252    HG3  ARG  34           HG1      ARG  34  -1.475  -0.095  11.271
  253    HD2  ARG  34           HD2      ARG  34  -0.589  -0.593  13.529
  254    HD3  ARG  34           HD1      ARG  34   0.669  -1.603  12.812
  255    HE   ARG  34           HE       ARG  34   1.502   0.432  11.694
  256   HH11  ARG  34          HH11      ARG  34   0.289   2.388  14.991
  257   HH12  ARG  34          HH12      ARG  34  -0.414   0.853  14.607
  258   HH21  ARG  34          HH21      ARG  34   1.923   3.286  13.621
  259   HH22  ARG  34          HH22      ARG  34   2.440   2.412  12.212
  260    H    GLY  35           HN       GLY  35  -4.858  -2.051  10.993
  261    HA2  GLY  35           HA2      GLY  35  -6.573  -0.612  10.444
  262    HA3  GLY  35           HA1      GLY  35  -6.101   0.441  11.776
  263    H    ARG  36           HN       ARG  36  -3.582  -0.436   9.659
  264    HA   ARG  36           HA       ARG  36  -3.688   1.925   7.945
  265    HB2  ARG  36           HB2      ARG  36  -2.665   2.564  10.295
  266    HB3  ARG  36           HB1      ARG  36  -1.296   1.585   9.823
  267    HG2  ARG  36           HG2      ARG  36  -0.679   3.798   9.312
  268    HG3  ARG  36           HG1      ARG  36  -1.109   3.088   7.756
  269    HD2  ARG  36           HD2      ARG  36  -3.293   4.191   7.824
  270    HD3  ARG  36           HD1      ARG  36  -2.955   4.829   9.438
  271    HE   ARG  36           HE       ARG  36  -1.073   5.582   7.352
  272   HH11  ARG  36          HH11      ARG  36  -3.954   6.581   9.132
  273   HH12  ARG  36          HH12      ARG  36  -3.757   8.254   8.728
  274   HH21  ARG  36          HH21      ARG  36  -0.853   7.780   6.827
  275   HH22  ARG  36          HH22      ARG  36  -1.999   8.936   7.421
  276    H    VAL  37           HN       VAL  37  -2.556   1.479   6.054
  277    HA   VAL  37           HA       VAL  37  -0.968  -1.016   5.936
  278    HB   VAL  37           HB       VAL  37  -1.212  -0.930   3.497
  279   HG11  VAL  37          HG11      VAL  37  -3.645  -1.304   3.334
  280   HG12  VAL  37          HG12      VAL  37  -3.861  -0.583   4.931
  281   HG13  VAL  37          HG13      VAL  37  -2.942  -2.079   4.752
  282   HG21  VAL  37          HG21      VAL  37  -2.645   0.743   2.366
  283   HG22  VAL  37          HG22      VAL  37  -1.236   1.494   3.110
  284   HG23  VAL  37          HG23      VAL  37  -2.815   1.630   3.885
  285    HA   PRO  38           HA       PRO  38   2.997   1.161   5.095
  286    HB2  PRO  38           HB2      PRO  38   3.113  -1.039   2.986
  287    HB3  PRO  38           HB1      PRO  38   4.378  -0.480   4.107
  288    HG2  PRO  38           HG2      PRO  38   3.114  -2.712   4.645
  289    HG3  PRO  38           HG1      PRO  38   3.397  -1.536   5.954
  290    HD2  PRO  38           HD2      PRO  38   0.863  -2.076   4.419
  291    HD3  PRO  38           HD1      PRO  38   1.089  -1.767   6.154
  292    H    ALA  39           HN       ALA  39   3.918   2.419   3.381
  293    HA   ALA  39           HA       ALA  39   2.072   3.940   1.954
  294    HB1  ALA  39           HB1      ALA  39   4.232   4.798   2.709
  295    HB2  ALA  39           HB2      ALA  39   4.047   5.049   0.973
  296    HB3  ALA  39           HB3      ALA  39   5.077   3.746   1.571
  297    H    GLY  40           HN       GLY  40   0.953   3.269   0.127
  298    HA2  GLY  40           HA2      GLY  40   1.481   3.115  -2.361
  299    HA3  GLY  40           HA1      GLY  40   2.332   1.638  -1.941
  300    H    ARG  41           HN       ARG  41   0.453   0.603  -0.063
  301    HA   ARG  41           HA       ARG  41  -1.213  -0.723  -2.033
  302    HB2  ARG  41           HB2      ARG  41  -0.791  -1.257   0.925
  303    HB3  ARG  41           HB1      ARG  41  -1.807  -2.256  -0.112
  304    HG2  ARG  41           HG2      ARG  41   1.150  -1.788  -0.557
  305    HG3  ARG  41           HG1      ARG  41   0.480  -3.177   0.291
  306    HD2  ARG  41           HD2      ARG  41   1.055  -3.791  -1.995
  307    HD3  ARG  41           HD1      ARG  41  -0.686  -3.869  -1.774
  308    HE   ARG  41           HE       ARG  41  -0.939  -1.906  -3.124
  309   HH11  ARG  41          HH11      ARG  41   2.804  -2.310  -4.577
  310   HH12  ARG  41          HH12      ARG  41   2.365  -3.159  -3.127
  311   HH21  ARG  41          HH21      ARG  41   1.279  -0.979  -5.643
  312   HH22  ARG  41          HH22      ARG  41  -0.329  -0.807  -5.014
  313    H    CYS  42           HN       CYS  42  -1.764   1.926  -0.021
  314    HA   CYS  42           HA       CYS  42  -4.522   1.507   0.578
  315    HB2  CYS  42           HB2      CYS  42  -3.203   3.223   1.739
  316    HB3  CYS  42           HB1      CYS  42  -3.046   4.133   0.235
  317    H    ILE  43           HN       ILE  43  -2.824   2.547  -2.295
  318    HA   ILE  43           HA       ILE  43  -4.881   3.794  -3.759
  319    HB   ILE  43           HB       ILE  43  -2.571   2.060  -4.757
  320   HG12  ILE  43          HG12      ILE  43  -2.825   5.100  -4.536
  321   HG13  ILE  43          HG11      ILE  43  -1.861   4.071  -3.482
  322   HG21  ILE  43          HG21      ILE  43  -4.329   3.947  -6.378
  323   HG22  ILE  43          HG22      ILE  43  -4.289   2.189  -6.501
  324   HG23  ILE  43          HG23      ILE  43  -2.879   3.128  -6.971
  325   HD11  ILE  43          HD11      ILE  43  -1.398   4.520  -6.429
  326   HD12  ILE  43          HD12      ILE  43  -0.433   3.474  -5.381
  327   HD13  ILE  43          HD13      ILE  43  -0.477   5.213  -5.096
  328    H    ASP  44           HN       ASP  44  -3.908   0.356  -3.635
  329    HA   ASP  44           HA       ASP  44  -5.911  -0.530  -5.493
  330    HB2  ASP  44           HB2      ASP  44  -4.361  -2.280  -3.548
  331    HB3  ASP  44           HB1      ASP  44  -5.054  -2.744  -5.098
  332    H    ILE  45           HN       ILE  45  -5.526  -0.738  -1.964
  333    HA   ILE  45           HA       ILE  45  -7.891  -2.140  -1.383
  334    HB   ILE  45           HB       ILE  45  -6.232  -0.227   0.321
  335   HG12  ILE  45          HG12      ILE  45  -6.451  -3.274   0.177
  336   HG13  ILE  45          HG11      ILE  45  -5.045  -2.286  -0.200
  337   HG21  ILE  45          HG21      ILE  45  -8.525  -1.971   1.283
  338   HG22  ILE  45          HG22      ILE  45  -8.546  -0.210   1.177
  339   HG23  ILE  45          HG23      ILE  45  -7.449  -1.006   2.301
  340   HD11  ILE  45          HD11      ILE  45  -4.905  -1.681   2.218
  341   HD12  ILE  45          HD12      ILE  45  -4.690  -3.396   1.883
  342   HD13  ILE  45          HD13      ILE  45  -6.224  -2.817   2.540
  343    H    GLU  46           HN       GLU  46  -7.301   1.346  -1.842
  344    HA   GLU  46           HA       GLU  46  -9.941   2.174  -1.100
  345    HB2  GLU  46           HB2      GLU  46  -7.876   3.644  -1.039
  346    HB3  GLU  46           HB1      GLU  46  -7.959   3.744  -2.792
  347    HG2  GLU  46           HG2      GLU  46  -9.966   4.984  -2.744
  348    HG3  GLU  46           HG1      GLU  46 -10.296   4.569  -1.063
  349    H    LEU  47           HN       LEU  47  -8.510   0.991  -4.062
  350    HA   LEU  47           HA       LEU  47 -10.493   1.824  -5.901
  351    HB2  LEU  47           HB2      LEU  47  -8.491   1.111  -6.888
  352    HB3  LEU  47           HB1      LEU  47  -8.274  -0.209  -5.762
  353    HG   LEU  47           HG       LEU  47 -10.113  -1.414  -6.951
  354   HD11  LEU  47          HD11      LEU  47 -10.674  -0.788  -9.267
  355   HD12  LEU  47          HD12      LEU  47  -9.769   0.716  -9.079
  356   HD13  LEU  47          HD13      LEU  47 -11.215   0.426  -8.110
  357   HD21  LEU  47          HD21      LEU  47  -7.756  -1.994  -7.280
  358   HD22  LEU  47          HD22      LEU  47  -7.630  -0.813  -8.586
  359   HD23  LEU  47          HD23      LEU  47  -8.669  -2.229  -8.767
  360    H    TYR  48           HN       TYR  48 -10.208  -0.841  -3.596
  361    HA   TYR  48           HA       TYR  48 -12.679  -2.142  -4.449
  362    HB2  TYR  48           HB2      TYR  48 -11.072  -2.783  -1.940
  363    HB3  TYR  48           HB1      TYR  48 -12.176  -3.847  -2.814
  364    HD1  TYR  48           HD1      TYR  48  -8.985  -3.937  -2.001
  365    HD2  TYR  48           HD2      TYR  48 -11.177  -3.495  -5.643
  366    HE1  TYR  48           HE1      TYR  48  -7.064  -4.793  -3.272
  367    HE2  TYR  48           HE2      TYR  48  -9.260  -4.354  -6.898
  368    HH   TYR  48           HH       TYR  48  -6.772  -4.464  -6.592
  369    H    THR  49           HN       THR  49 -11.638   0.192  -2.040
  370    HA   THR  49           HA       THR  49 -14.284   0.124  -0.677
  371    HB   THR  49           HB       THR  49 -13.233   1.225   1.212
  372    HG1  THR  49           HG1      THR  49 -11.774   2.630   0.456
  373   HG21  THR  49          HG21      THR  49 -11.335  -0.932   0.200
  374   HG22  THR  49          HG22      THR  49 -12.834  -1.222   1.086
  375   HG23  THR  49          HG23      THR  49 -11.494  -0.390   1.871
  376    H    ASP  50           HN       ASP  50 -14.117   1.189  -3.193
  377    HA   ASP  50           HA       ASP  50 -13.136   3.670  -3.751
  378    HB2  ASP  50           HB2      ASP  50 -14.724   3.673  -5.696
  379    HB3  ASP  50           HB1      ASP  50 -13.860   2.151  -5.484
  380    H    GLY  51           HN       GLY  51 -16.503   3.029  -2.796
  381    HA2  GLY  51           HA2      GLY  51 -16.667   5.769  -1.645
  382    HA3  GLY  51           HA1      GLY  51 -17.984   5.085  -2.609
  383    H    ARG  52           HN       ARG  52 -16.139   2.983  -0.631
  384    HA   ARG  52           HA       ARG  52 -18.452   2.442   1.081
  385    HB2  ARG  52           HB2      ARG  52 -15.892   0.898   0.539
  386    HB3  ARG  52           HB1      ARG  52 -17.075   0.404   1.744
  387    HG2  ARG  52           HG2      ARG  52 -18.798   0.173  -0.029
  388    HG3  ARG  52           HG1      ARG  52 -17.614   0.675  -1.240
  389    HD2  ARG  52           HD2      ARG  52 -16.268  -1.325  -0.816
  390    HD3  ARG  52           HD1      ARG  52 -17.321  -1.786   0.523
  391    HE   ARG  52           HE       ARG  52 -18.927  -2.516  -0.961
  392   HH11  ARG  52          HH11      ARG  52 -16.902  -1.598  -4.306
  393   HH12  ARG  52          HH12      ARG  52 -16.335  -0.981  -2.794
  394   HH21  ARG  52          HH21      ARG  52 -18.753  -2.922  -4.397
  395   HH22  ARG  52          HH22      ARG  52 -19.621  -3.323  -2.946
  396    H    VAL  53           HN       VAL  53 -14.938   3.046   1.449
  397    HA   VAL  53           HA       VAL  53 -15.364   4.552   3.888
  398    HB   VAL  53           HB       VAL  53 -15.297   2.251   4.797
  399   HG11  VAL  53          HG11      VAL  53 -14.020   1.136   3.058
  400   HG12  VAL  53          HG12      VAL  53 -13.308   0.836   4.641
  401   HG13  VAL  53          HG13      VAL  53 -12.556   1.997   3.544
  402   HG21  VAL  53          HG21      VAL  53 -14.368   4.036   6.201
  403   HG22  VAL  53          HG22      VAL  53 -12.771   3.791   5.496
  404   HG23  VAL  53          HG23      VAL  53 -13.507   2.523   6.478
  405    H    GLU  54           HN       GLU  54 -13.493   5.752   4.550
  406    HA   GLU  54           HA       GLU  54 -11.696   6.565   2.476
  407    HB2  GLU  54           HB2      GLU  54 -11.596   7.178   5.472
  408    HB3  GLU  54           HB1      GLU  54 -10.669   8.004   4.229
  409    HG2  GLU  54           HG2      GLU  54 -12.457   9.434   4.873
  410    HG3  GLU  54           HG1      GLU  54 -12.820   8.848   3.253
  411    H    CYS  55           HN       CYS  55  -9.804   5.593   1.931
  412    HA   CYS  55           HA       CYS  55  -8.509   3.715   3.795
  413    HB2  CYS  55           HB2      CYS  55  -8.842   2.799   1.609
  414    HB3  CYS  55           HB1      CYS  55  -8.156   4.221   0.829
  415    H    ARG  56           HN       ARG  56  -6.301   3.871   4.323
  416    HA   ARG  56           HA       ARG  56  -4.819   6.301   3.676
  417    HB2  ARG  56           HB2      ARG  56  -4.278   6.719   6.110
  418    HB3  ARG  56           HB1      ARG  56  -5.913   7.115   5.627
  419    HG2  ARG  56           HG2      ARG  56  -5.350   4.437   6.898
  420    HG3  ARG  56           HG1      ARG  56  -5.465   5.882   7.901
  421    HD2  ARG  56           HD2      ARG  56  -7.632   4.915   6.002
  422    HD3  ARG  56           HD1      ARG  56  -7.613   4.647   7.747
  423    HE   ARG  56           HE       ARG  56  -7.375   7.422   7.108
  424   HH11  ARG  56          HH11      ARG  56 -11.085   5.955   7.682
  425   HH12  ARG  56          HH12      ARG  56  -9.782   4.861   7.367
  426   HH21  ARG  56          HH21      ARG  56  -9.075   8.851   7.518
  427   HH22  ARG  56          HH22      ARG  56 -10.682   8.251   7.768
  428    H    GLU  57           HN       GLU  57  -2.693   6.046   3.638
  429    HA   GLU  57           HA       GLU  57  -1.445   3.518   4.569
  430    HB2  GLU  57           HB2      GLU  57   0.219   3.810   2.735
  431    HB3  GLU  57           HB1      GLU  57  -1.413   3.613   2.113
  432    HG2  GLU  57           HG2      GLU  57  -1.559   6.087   1.811
  433    HG3  GLU  57           HG1      GLU  57   0.111   6.216   2.360
  434    H    LEU  58           HN       LEU  58   0.870   3.754   5.093
  435    HA   LEU  58           HA       LEU  58   1.541   6.078   6.608
  436    HB2  LEU  58           HB2      LEU  58   3.233   3.720   5.725
  437    HB3  LEU  58           HB1      LEU  58   3.755   4.935   6.884
  438    HG   LEU  58           HG       LEU  58   1.331   3.145   7.313
  439   HD11  LEU  58          HD11      LEU  58   2.684   1.811   8.837
  440   HD12  LEU  58          HD12      LEU  58   4.123   2.751   8.423
  441   HD13  LEU  58          HD13      LEU  58   3.335   1.750   7.200
  442   HD21  LEU  58          HD21      LEU  58   1.203   5.195   8.605
  443   HD22  LEU  58          HD22      LEU  58   2.839   4.963   9.219
  444   HD23  LEU  58          HD23      LEU  58   1.553   3.847   9.683
  445    H    ARG  59           HN       ARG  59   3.510   7.394   6.189
  446    HA   ARG  59           HA       ARG  59   3.450   8.325   3.419
  447    HB2  ARG  59           HB2      ARG  59   4.717   9.552   5.910
  448    HB3  ARG  59           HB1      ARG  59   4.611  10.324   4.310
  449    HG2  ARG  59           HG2      ARG  59   2.166  10.345   4.448
  450    HG3  ARG  59           HG1      ARG  59   2.207   9.453   5.969
  451    HD2  ARG  59           HD2      ARG  59   1.774  11.826   6.350
  452    HD3  ARG  59           HD1      ARG  59   3.305  11.342   7.080
  453    HE   ARG  59           HE       ARG  59   3.204  12.670   4.447
  454   HH11  ARG  59          HH11      ARG  59   4.351  12.635   7.768
  455   HH12  ARG  59          HH12      ARG  59   5.437  13.966   7.536
  456   HH21  ARG  59          HH21      ARG  59   4.648  14.405   4.143
  457   HH22  ARG  59          HH22      ARG  59   5.607  14.972   5.469
  458    HA   PRO  60           HA       PRO  60   7.493   6.755   2.196
  459    HB2  PRO  60           HB2      PRO  60   8.609   8.934   0.882
  460    HB3  PRO  60           HB1      PRO  60   7.343   7.914   0.176
  461    HG2  PRO  60           HG2      PRO  60   7.069  10.556   1.561
  462    HG3  PRO  60           HG1      PRO  60   6.294   9.982   0.066
  463    HD2  PRO  60           HD2      PRO  60   4.974  10.006   2.432
  464    HD3  PRO  60           HD1      PRO  60   4.701   8.718   1.219
  465    H    ASP  61           HN       ASP  61   7.353   9.871   3.779
  466    HA   ASP  61           HA       ASP  61  10.020   9.713   4.882
  467    HB2  ASP  61           HB2      ASP  61   8.970  11.882   4.194
  468    HB3  ASP  61           HB1      ASP  61   7.777  11.699   5.472
  469    H    VAL  62           HN       VAL  62   9.634   7.620   5.828
  470    HA   VAL  62           HA       VAL  62   8.472   7.798   8.547
  471    HB   VAL  62           HB       VAL  62   8.893   5.311   8.684
  472   HG11  VAL  62          HG11      VAL  62   6.655   6.135   8.145
  473   HG12  VAL  62          HG12      VAL  62   6.981   4.620   7.311
  474   HG13  VAL  62          HG13      VAL  62   7.044   6.143   6.423
  475   HG21  VAL  62          HG21      VAL  62   9.327   4.020   6.621
  476   HG22  VAL  62          HG22      VAL  62  10.666   5.105   6.996
  477   HG23  VAL  62          HG23      VAL  62   9.529   5.525   5.715
  478    H    PHE  63           HN       PHE  63  11.376   8.045   6.812
  479    HA   PHE  63           HA       PHE  63  13.175   7.043   8.871
  480    HB2  PHE  63           HB2      PHE  63  13.865   8.491   6.278
  481    HB3  PHE  63           HB1      PHE  63  14.968   7.564   7.285
  482    HD1  PHE  63           HD1      PHE  63  12.378   7.387   4.679
  483    HD2  PHE  63           HD2      PHE  63  14.829   5.076   7.321
  484    HE1  PHE  63           HE1      PHE  63  11.923   5.373   3.352
  485    HE2  PHE  63           HE2      PHE  63  14.364   3.067   5.988
  486    HZ   PHE  63           HZ       PHE  63  12.907   3.210   4.005
  487    H    GLY  64           HN       GLY  64  11.746  10.070   7.946
  488    HA2  GLY  64           HA2      GLY  64  11.753  12.029   9.301
  489    HA3  GLY  64           HA1      GLY  64  13.281  11.529  10.014
  490    H    ALA  65           HN       ALA  65  14.927  11.104   7.990
  491    HA   ALA  65           HA       ALA  65  14.842  13.448   6.180
  492    HB1  ALA  65           HB1      ALA  65  17.308  12.259   7.517
  493    HB2  ALA  65           HB2      ALA  65  16.561  13.809   7.904
  494    HB3  ALA  65           HB3      ALA  65  17.310  13.563   6.327