*HEADER    ISOMERASE                               20-JAN-15   2RUQ              
*TITLE     SOLUTION STRUCTURE OF HUMAN PIN1 PPIASE MUTANT C113A                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE NIMA-INTERACTING 1;    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 51-163;                                       
*COMPND   5 SYNONYM: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE PIN1, PPIASE PIN1,      
*COMPND   6 ROTAMASE PIN1;                                                       
*COMPND   7 EC: 5.2.1.8;                                                         
*COMPND   8 ENGINEERED: YES;                                                     
*COMPND   9 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: PIN1;                                                          
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET28A                                     
*KEYWDS    CYS-113 MUTATION, HUMAN PIN1 PPIASE, ISOMERASE                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    W.JING, N.TOCHIO, S.TATE                                              
*REVDAT   1   06-JAN-16 2RUQ    0                                                


assign (resid    8 and name C    ) (resid    9 and name N    )
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assign (resid    9 and name N    ) (resid    9 and name CA   )
       (resid    9 and name C    ) (resid   10 and name N    )    1.0  160.1   30.0 2
assign (resid    9 and name C    ) (resid   10 and name N    )
       (resid   10 and name CA   ) (resid   10 and name C    )    1.0 -128.5   30.0 2
assign (resid   10 and name N    ) (resid   10 and name CA   )
       (resid   10 and name C    ) (resid   11 and name N    )    1.0  137.2   30.0 2
assign (resid   10 and name C    ) (resid   11 and name N    )
       (resid   11 and name CA   ) (resid   11 and name C    )    1.0 -139.9   30.0 2
assign (resid   11 and name N    ) (resid   11 and name CA   )
       (resid   11 and name C    ) (resid   12 and name N    )    1.0  159.6   30.0 2
assign (resid   11 and name C    ) (resid   12 and name N    )
       (resid   12 and name CA   ) (resid   12 and name C    )    1.0 -127.1   30.0 2
assign (resid   12 and name N    ) (resid   12 and name CA   )
       (resid   12 and name C    ) (resid   13 and name N    )    1.0  146.0   30.0 2
assign (resid   12 and name C    ) (resid   13 and name N    )
       (resid   13 and name CA   ) (resid   13 and name C    )    1.0 -144.1   30.0 2
assign (resid   13 and name N    ) (resid   13 and name CA   )
       (resid   13 and name C    ) (resid   14 and name N    )    1.0  153.4   30.0 2
assign (resid   13 and name C    ) (resid   14 and name N    )
       (resid   14 and name CA   ) (resid   14 and name C    )    1.0 -137.3   30.0 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
       (resid   14 and name C    ) (resid   15 and name N    )    1.0  131.5   30.0 2
assign (resid   14 and name C    ) (resid   15 and name N    )
       (resid   15 and name CA   ) (resid   15 and name C    )    1.0 -111.7   30.0 2
assign (resid   15 and name N    ) (resid   15 and name CA   )
       (resid   15 and name C    ) (resid   16 and name N    )    1.0  128.9   30.0 2
assign (resid   35 and name C    ) (resid   36 and name N    )
       (resid   36 and name CA   ) (resid   36 and name C    )    1.0  -60.9   30.0 2
assign (resid   36 and name N    ) (resid   36 and name CA   )
       (resid   36 and name C    ) (resid   37 and name N    )    1.0  -40.9   30.0 2
assign (resid   36 and name C    ) (resid   37 and name N    )
       (resid   37 and name CA   ) (resid   37 and name C    )    1.0  -62.6   30.0 2
assign (resid   37 and name N    ) (resid   37 and name CA   )
       (resid   37 and name C    ) (resid   38 and name N    )    1.0  -40.0   30.0 2
assign (resid   37 and name C    ) (resid   38 and name N    )
       (resid   38 and name CA   ) (resid   38 and name C    )    1.0  -66.7   30.0 2
assign (resid   38 and name N    ) (resid   38 and name CA   )
       (resid   38 and name C    ) (resid   39 and name N    )    1.0  -41.7   30.0 2
assign (resid   38 and name C    ) (resid   39 and name N    )
       (resid   39 and name CA   ) (resid   39 and name C    )    1.0  -66.7   30.0 2
assign (resid   39 and name N    ) (resid   39 and name CA   )
       (resid   39 and name C    ) (resid   40 and name N    )    1.0  -38.0   30.0 2
assign (resid   39 and name C    ) (resid   40 and name N    )
       (resid   40 and name CA   ) (resid   40 and name C    )    1.0  -63.0   30.0 2
assign (resid   40 and name N    ) (resid   40 and name CA   )
       (resid   40 and name C    ) (resid   41 and name N    )    1.0  -43.4   30.0 2
assign (resid   40 and name C    ) (resid   41 and name N    )
       (resid   41 and name CA   ) (resid   41 and name C    )    1.0  -62.8   30.0 2
assign (resid   41 and name N    ) (resid   41 and name CA   )
       (resid   41 and name C    ) (resid   42 and name N    )    1.0  -40.5   30.0 2
assign (resid   41 and name C    ) (resid   42 and name N    )
       (resid   42 and name CA   ) (resid   42 and name C    )    1.0  -68.1   30.0 2
assign (resid   42 and name N    ) (resid   42 and name CA   )
       (resid   42 and name C    ) (resid   43 and name N    )    1.0  -40.1   30.0 2
assign (resid   42 and name C    ) (resid   43 and name N    )
       (resid   43 and name CA   ) (resid   43 and name C    )    1.0  -65.2   30.0 2
assign (resid   43 and name N    ) (resid   43 and name CA   )
       (resid   43 and name C    ) (resid   44 and name N    )    1.0  -43.8   30.0 2
assign (resid   43 and name C    ) (resid   44 and name N    )
       (resid   44 and name CA   ) (resid   44 and name C    )    1.0  -61.6   30.0 2
assign (resid   44 and name N    ) (resid   44 and name CA   )
       (resid   44 and name C    ) (resid   45 and name N    )    1.0  -39.9   30.0 2
assign (resid   44 and name C    ) (resid   45 and name N    )
       (resid   45 and name CA   ) (resid   45 and name C    )    1.0  -65.8   30.0 2
assign (resid   45 and name N    ) (resid   45 and name CA   )
       (resid   45 and name C    ) (resid   46 and name N    )    1.0  -37.2   30.0 2
assign (resid   45 and name C    ) (resid   46 and name N    )
       (resid   46 and name CA   ) (resid   46 and name C    )    1.0  -71.2   30.0 2
assign (resid   46 and name N    ) (resid   46 and name CA   )
       (resid   46 and name C    ) (resid   47 and name N    )    1.0  -38.9   30.0 2
assign (resid   46 and name C    ) (resid   47 and name N    )
       (resid   47 and name CA   ) (resid   47 and name C    )    1.0  -62.6   30.0 2
assign (resid   47 and name N    ) (resid   47 and name CA   )
       (resid   47 and name C    ) (resid   48 and name N    )    1.0  -44.9   30.0 2
assign (resid   47 and name C    ) (resid   48 and name N    )
       (resid   48 and name CA   ) (resid   48 and name C    )    1.0  -61.8   30.0 2
assign (resid   48 and name N    ) (resid   48 and name CA   )
       (resid   48 and name C    ) (resid   49 and name N    )    1.0  -41.3   30.0 2
assign (resid   48 and name C    ) (resid   49 and name N    )
       (resid   49 and name CA   ) (resid   49 and name C    )    1.0  -63.0   30.0 2
assign (resid   49 and name N    ) (resid   49 and name CA   )
       (resid   49 and name C    ) (resid   50 and name N    )    1.0  -43.8   30.0 2
assign (resid   49 and name C    ) (resid   50 and name N    )
       (resid   50 and name CA   ) (resid   50 and name C    )    1.0  -62.9   30.0 2
assign (resid   50 and name N    ) (resid   50 and name CA   )
       (resid   50 and name C    ) (resid   51 and name N    )    1.0  -41.5   30.0 2
assign (resid   50 and name C    ) (resid   51 and name N    )
       (resid   51 and name CA   ) (resid   51 and name C    )    1.0  -65.0   30.0 2
assign (resid   51 and name N    ) (resid   51 and name CA   )
       (resid   51 and name C    ) (resid   52 and name N    )    1.0  -34.3   30.0 2
assign (resid   51 and name C    ) (resid   52 and name N    )
       (resid   52 and name CA   ) (resid   52 and name C    )    1.0  -88.9   30.0 2
assign (resid   52 and name N    ) (resid   52 and name CA   )
       (resid   52 and name C    ) (resid   53 and name N    )    1.0   -2.8   30.0 2
assign (resid   56 and name C    ) (resid   57 and name N    )
       (resid   57 and name CA   ) (resid   57 and name C    )    1.0  -57.8   30.0 2
assign (resid   57 and name N    ) (resid   57 and name CA   )
       (resid   57 and name C    ) (resid   58 and name N    )    1.0  -47.8   30.0 2
assign (resid   57 and name C    ) (resid   58 and name N    )
       (resid   58 and name CA   ) (resid   58 and name C    )    1.0  -60.7   30.0 2
assign (resid   58 and name N    ) (resid   58 and name CA   )
       (resid   58 and name C    ) (resid   59 and name N    )    1.0  -43.1   30.0 2
assign (resid   58 and name C    ) (resid   59 and name N    )
       (resid   59 and name CA   ) (resid   59 and name C    )    1.0  -64.4   30.0 2
assign (resid   59 and name N    ) (resid   59 and name CA   )
       (resid   59 and name C    ) (resid   60 and name N    )    1.0  -41.8   30.0 2
assign (resid   59 and name C    ) (resid   60 and name N    )
       (resid   60 and name CA   ) (resid   60 and name C    )    1.0  -65.1   30.0 2
assign (resid   60 and name N    ) (resid   60 and name CA   )
       (resid   60 and name C    ) (resid   61 and name N    )    1.0  -41.4   30.0 2
assign (resid   60 and name C    ) (resid   61 and name N    )
       (resid   61 and name CA   ) (resid   61 and name C    )    1.0  -62.8   30.0 2
assign (resid   61 and name N    ) (resid   61 and name CA   )
       (resid   61 and name C    ) (resid   62 and name N    )    1.0  -41.4   30.0 2
assign (resid   67 and name C    ) (resid   68 and name N    )
       (resid   68 and name CA   ) (resid   68 and name C    )    1.0  -55.6   30.0 2
assign (resid   68 and name N    ) (resid   68 and name CA   )
       (resid   68 and name C    ) (resid   69 and name N    )    1.0  -37.3   30.0 2
assign (resid   68 and name C    ) (resid   69 and name N    )
       (resid   69 and name CA   ) (resid   69 and name C    )    1.0  -73.3   30.0 2
assign (resid   69 and name N    ) (resid   69 and name CA   )
       (resid   69 and name C    ) (resid   70 and name N    )    1.0  -23.7   30.0 2
assign (resid   69 and name C    ) (resid   70 and name N    )
       (resid   70 and name CA   ) (resid   70 and name C    )    1.0  -62.7   30.0 2
assign (resid   70 and name N    ) (resid   70 and name CA   )
       (resid   70 and name C    ) (resid   71 and name N    )    1.0  -35.7   30.0 2
assign (resid   70 and name C    ) (resid   71 and name N    )
       (resid   71 and name CA   ) (resid   71 and name C    )    1.0  -81.2   30.0 2
assign (resid   71 and name N    ) (resid   71 and name CA   )
       (resid   71 and name C    ) (resid   72 and name N    )    1.0   -6.2   30.0 2
assign (resid   75 and name C    ) (resid   76 and name N    )
       (resid   76 and name CA   ) (resid   76 and name C    )    1.0 -103.1   30.0 2
assign (resid   76 and name N    ) (resid   76 and name CA   )
       (resid   76 and name C    ) (resid   77 and name N    )    1.0  -22.1   30.0 2
assign (resid   77 and name C    ) (resid   78 and name N    )
       (resid   78 and name CA   ) (resid   78 and name C    )    1.0 -106.4   30.0 2
assign (resid   78 and name N    ) (resid   78 and name CA   )
       (resid   78 and name C    ) (resid   79 and name N    )    1.0  138.1   30.0 2
assign (resid   78 and name C    ) (resid   79 and name N    )
       (resid   79 and name CA   ) (resid   79 and name C    )    1.0 -146.6   30.0 2
assign (resid   79 and name N    ) (resid   79 and name CA   )
       (resid   79 and name C    ) (resid   80 and name N    )    1.0  164.9   30.0 2
assign (resid   85 and name C    ) (resid   86 and name N    )
       (resid   86 and name CA   ) (resid   86 and name C    )    1.0  -51.7   30.0 2
assign (resid   86 and name N    ) (resid   86 and name CA   )
       (resid   86 and name C    ) (resid   87 and name N    )    1.0  -47.2   30.0 2
assign (resid   87 and name C    ) (resid   88 and name N    )
       (resid   88 and name CA   ) (resid   88 and name C    )    1.0  -70.9   30.0 2
assign (resid   88 and name N    ) (resid   88 and name CA   )
       (resid   88 and name C    ) (resid   89 and name N    )    1.0  -36.7   30.0 2
assign (resid   88 and name C    ) (resid   89 and name N    )
       (resid   89 and name CA   ) (resid   89 and name C    )    1.0  -63.1   30.0 2
assign (resid   89 and name N    ) (resid   89 and name CA   )
       (resid   89 and name C    ) (resid   90 and name N    )    1.0  -45.8   30.0 2
assign (resid   89 and name C    ) (resid   90 and name N    )
       (resid   90 and name CA   ) (resid   90 and name C    )    1.0  -59.2   30.0 2
assign (resid   90 and name N    ) (resid   90 and name CA   )
       (resid   90 and name C    ) (resid   91 and name N    )    1.0  -42.3   30.0 2
assign (resid   90 and name C    ) (resid   91 and name N    )
       (resid   91 and name CA   ) (resid   91 and name C    )    1.0  -67.5   30.0 2
assign (resid   91 and name N    ) (resid   91 and name CA   )
       (resid   91 and name C    ) (resid   92 and name N    )    1.0  -39.7   30.0 2
assign (resid   91 and name C    ) (resid   92 and name N    )
       (resid   92 and name CA   ) (resid   92 and name C    )    1.0  -61.0   30.0 2
assign (resid   92 and name N    ) (resid   92 and name CA   )
       (resid   92 and name C    ) (resid   93 and name N    )    1.0  -43.0   30.0 2
assign (resid   98 and name C    ) (resid   99 and name N    )
       (resid   99 and name CA   ) (resid   99 and name C    )    1.0  -98.9   30.0 2
assign (resid   99 and name N    ) (resid   99 and name CA   )
       (resid   99 and name C    ) (resid  100 and name N    )    1.0  143.4   30.0 2
assign (resid   99 and name C    ) (resid  100 and name N    )
       (resid  100 and name CA   ) (resid  100 and name C    )    1.0 -131.7   30.0 2
assign (resid  100 and name N    ) (resid  100 and name CA   )
       (resid  100 and name C    ) (resid  101 and name N    )    1.0  134.7   30.0 2
assign (resid  103 and name C    ) (resid  104 and name N    )
       (resid  104 and name CA   ) (resid  104 and name C    )    1.0 -113.1   30.0 2
assign (resid  104 and name N    ) (resid  104 and name CA   )
       (resid  104 and name C    ) (resid  105 and name N    )    1.0  132.5   30.0 2
assign (resid  104 and name C    ) (resid  105 and name N    )
       (resid  105 and name CA   ) (resid  105 and name C    )    1.0  -89.1   30.0 2
assign (resid  105 and name N    ) (resid  105 and name CA   )
       (resid  105 and name C    ) (resid  106 and name N    )    1.0  143.0   30.0 2
assign (resid  109 and name C    ) (resid  110 and name N    )
       (resid  110 and name CA   ) (resid  110 and name C    )    1.0 -111.5   30.0 2
assign (resid  110 and name N    ) (resid  110 and name CA   )
       (resid  110 and name C    ) (resid  111 and name N    )    1.0  127.5   30.0 2
assign (resid  110 and name C    ) (resid  111 and name N    )
       (resid  111 and name CA   ) (resid  111 and name C    )    1.0 -114.6   30.0 2
assign (resid  111 and name N    ) (resid  111 and name CA   )
       (resid  111 and name C    ) (resid  112 and name N    )    1.0  152.6   30.0 2
assign (resid  111 and name C    ) (resid  112 and name N    )
       (resid  112 and name CA   ) (resid  112 and name C    )    1.0 -137.7   30.0 2
assign (resid  112 and name N    ) (resid  112 and name CA   )
       (resid  112 and name C    ) (resid  113 and name N    )    1.0  142.2   30.0 2
assign (resid  112 and name C    ) (resid  113 and name N    )
       (resid  113 and name CA   ) (resid  113 and name C    )    1.0 -135.0   30.0 2
assign (resid  113 and name N    ) (resid  113 and name CA   )
       (resid  113 and name C    ) (resid  114 and name N    )    1.0  128.4   30.0 2
assign (resid  113 and name C    ) (resid  114 and name N    )
       (resid  114 and name CA   ) (resid  114 and name C    )    1.0 -119.9   30.0 2
assign (resid  114 and name N    ) (resid  114 and name CA   )
       (resid  114 and name C    ) (resid  115 and name N    )    1.0  128.6   30.0 2
assign (resid  114 and name C    ) (resid  115 and name N    )
       (resid  115 and name CA   ) (resid  115 and name C    )    1.0  -86.1   30.0 2
assign (resid  115 and name N    ) (resid  115 and name CA   )
       (resid  115 and name C    ) (resid  116 and name N    )    1.0  124.4   30.0 2
assign (resid   57 and name HE# ) (resid  114 and name HN  ) 4.5 5.1 3.9 !pk.6   # F.57.QE    L.114.H   
assign (resid   57 and name HZ  ) (resid  114 and name HN  ) 4.5 3.2 2.0 !pk.6   # F.57.HZ    L.114.H   
assign (resid   13 and name HA  ) (resid  114 and name HN  ) 4.5 2.7 1.5 !pk.7     H.13.HA    L.114.H   
assign (resid   11 and name HA  ) (resid  114 and name HN  ) 4.5 2.7 1.5 !pk.8     C.11.HA    L.114.H   
assign (resid   12 and name HB# ) (resid  114 and name HN  ) 4.5 3.7 2.5 !pk.9   # S.12.HB2   L.114.H   
assign (resid   13 and name HB# ) (resid  114 and name HN  ) 4.5 3.7 2.5 !pk.10  # H.13.HB3   L.114.H   
assign (resid   11 and name HB# ) (resid  114 and name HN  ) 4.5 3.7 2.5 !pk.11  # C.11.HB2   L.114.H   
assign (resid   11 and name HB# ) (resid  114 and name HN  ) 4.5 3.7 2.5 !pk.12  # C.11.HB3   L.114.H   
assign (resid  113 and name HB  ) (resid  114 and name HN  ) 4.5 2.7 1.5 !pk.13    I.113.HB   L.114.H   
assign (resid  112 and name HG2#) (resid  114 and name HN  ) 4.5 4.2 3.0 !pk.14  # I.112.QG2  L.114.H   
assign (resid  114 and name HN  ) (resid  116 and name HG2#) 4.5 4.2 3.0 !pk.14  # L.114.H    T.116.QG2 
assign (resid  113 and name HG2#) (resid  114 and name HN  ) 3.5 3.2 2.3 !pk.15  # I.113.QG2  L.114.H   
assign (resid  114 and name HN  ) (resid  114 and name HB# ) 3.5 2.7 1.8 !pk.15  # L.114.H    L.114.HB2 
assign (resid  113 and name HG1#) (resid  114 and name HN  ) 4.5 3.7 2.5 !pk.16  # I.113.HG13 L.114.H   
assign (resid  114 and name HN  ) (resid  114 and name HD1#) 4.5 4.2 3.0 !pk.16  # L.114.H    L.114.QD1 
assign (resid  114 and name HN  ) (resid  114 and name HB# ) 4.5 3.7 2.5 !pk.17  # L.114.H    L.114.HB3 
assign (resid  105 and name HN  ) (resid  105 and name HD# ) 3.5 4.1 3.2 !pk.19  # F.105.H    F.105.QD  
assign (resid   16 and name HN  ) (resid  111 and name HA  ) 4.5 2.7 1.5 !pk.20    V.16.H     H.111.HA  
assign (resid  104 and name HA  ) (resid  105 and name HN  ) 2.5 0.7 0.9 !pk.23    V.104.HA   F.105.H   
assign (resid  105 and name HN  ) (resid  105 and name HB# ) 3.5 2.7 1.8 !pk.25  # F.105.H    F.105.QB  
assign (resid   16 and name HN  ) (resid   16 and name HB  ) 3.5 1.7 0.8 !pk.28    V.16.H     V.16.HB   
assign (resid  104 and name HB  ) (resid  105 and name HN  ) 4.5 2.7 1.5 !pk.29    V.104.HB   F.105.H   
assign (resid   15 and name HB# ) (resid   16 and name HN  ) 4.5 3.7 2.5 !pk.30  # L.15.HB2   V.16.H    
assign (resid   16 and name HN  ) (resid  110 and name HB  ) 4.5 2.7 1.5 !pk.30    V.16.H     I.110.HB  
assign (resid  105 and name HN  ) (resid  106 and name HG2#) 4.5 4.2 3.0 !pk.31  # F.105.H    T.106.QG2 
assign (resid   16 and name HN  ) (resid   16 and name HG1#) 4.5 4.2 3.0 !pk.32  # V.16.H     V.16.QG1  
assign (resid   16 and name HN  ) (resid   16 and name HG2#) 3.5 3.2 2.3 !pk.33  # V.16.H     V.16.QG2  
assign (resid   28 and name HB# ) (resid   28 and name HE  ) 4.5 3.7 2.5 !pk.34  # R.28.HB2   R.28.HE   
assign (resid  104 and name HG2#) (resid  105 and name HN  ) 4.5 4.2 3.0 !pk.35  # V.104.QG2  F.105.H   
assign (resid  104 and name HG1#) (resid  105 and name HN  ) 3.5 3.2 2.3 !pk.37  # V.104.QG1  F.105.H   
assign (resid   15 and name HD1#) (resid   16 and name HN  ) 3.5 3.2 2.3 !pk.39  # L.15.QD1   V.16.H    
assign (resid   10 and name HE  ) (resid   77 and name HN  ) 4.5 2.7 1.5 !pk.41    R.10.HE    G.77.H    
assign (resid   10 and name HE  ) (resid   77 and name HA# ) 4.5 3.7 2.5 !pk.44  # R.10.HE    G.77.HA2  
assign (resid   10 and name HE  ) (resid   77 and name HA# ) 4.5 3.7 2.5 !pk.45  # R.10.HE    G.77.HA3  
assign (resid   10 and name HE  ) (resid  117 and name HB# ) 4.5 3.7 2.5 !pk.47  # R.10.HE    E.117.HB3 
assign (resid   10 and name HG# ) (resid   10 and name HE  ) 3.5 3.2 2.3 !pk.48  # R.10.HG3   R.10.HE   
assign (resid   10 and name HG# ) (resid   10 and name HE  ) 3.5 3.2 2.3 !pk.49  # R.10.HG2   R.10.HE   
assign (resid  115 and name HN  ) (resid  116 and name HN  ) 4.5 2.7 1.5 !pk.50    R.115.H    T.116.H   
assign (resid   98 and name HN  ) (resid  115 and name HN  ) 4.5 2.7 1.5 !pk.51    G.98.H     R.115.H   
assign (resid  114 and name HN  ) (resid  115 and name HN  ) 4.5 2.7 1.5 !pk.52    L.114.H    R.115.H   
assign (resid  100 and name HA  ) (resid  115 and name HN  ) 4.5 2.7 1.5 !pk.53    M.100.HA   R.115.H   
assign (resid   11 and name HB# ) (resid  115 and name HN  ) 4.5 3.7 2.5 !pk.55  # C.11.HB3   R.115.H   
assign (resid  100 and name HG# ) (resid  115 and name HN  ) 4.5 4.2 3.0 !pk.56  # M.100.HG3  R.115.H   
assign (resid  115 and name HN  ) (resid  115 and name HB# ) 3.5 2.7 1.8 !pk.57  # R.115.H    R.115.HB2 
assign (resid  115 and name HN  ) (resid  115 and name HG# ) 4.5 4.2 3.0 !pk.58  # R.115.H    R.115.HG2 
assign (resid  115 and name HN  ) (resid  115 and name HG# ) 4.5 4.2 3.0 !pk.59  # R.115.H    R.115.HG3 
assign (resid   95 and name HD1#) (resid  115 and name HN  ) 3.5 3.2 2.3 !pk.60  # L.95.QD1   R.115.H   
assign (resid  114 and name HD1#) (resid  115 and name HN  ) 3.5 3.2 2.3 !pk.61  # L.114.QD1  R.115.H   
assign (resid  104 and name HN  ) (resid  111 and name HN  ) 4.5 2.7 1.5 !pk.62    V.104.H    H.111.H   
assign (resid  103 and name HA  ) (resid  104 and name HN  ) 3.5 1.7 0.8 !pk.63    P.103.HA   V.104.H   
assign (resid  104 and name HN  ) (resid  111 and name HB# ) 4.5 3.7 2.5 !pk.64  # V.104.H    H.111.HB3 
assign (resid  104 and name HN  ) (resid  104 and name HB  ) 3.5 1.7 0.8 !pk.65    V.104.H    V.104.HB  
assign (resid   43 and name HD1#) (resid  104 and name HN  ) 4.5 4.2 3.0 !pk.68  # I.43.QD1   V.104.H   
assign (resid  104 and name HN  ) (resid  110 and name HG2#) 4.5 4.2 3.0 !pk.69  # V.104.H    I.110.QG2 
assign (resid  114 and name HB# ) (resid  115 and name HN  ) 4.5 3.7 2.5 !pk.70  # L.114.HB3  R.115.H   
assign (resid   15 and name HN  ) (resid   66 and name HN  ) 4.5 2.7 1.5 !pk.71    L.15.H     D.66.H    
assign (resid   15 and name HN  ) (resid   65 and name HG  ) 4.5 2.7 1.5 !pk.72    L.15.H     S.65.HG   
assign (resid  104 and name HN  ) (resid  110 and name HA  ) 4.5 2.7 1.5 !pk.73    V.104.H    I.110.HA  
assign (resid   15 and name HN  ) (resid   65 and name HB# ) 4.5 3.7 2.5 !pk.74  # L.15.H     S.65.HB2  
assign (resid   14 and name HA  ) (resid   15 and name HN  ) 3.5 1.7 0.8 !pk.75    L.14.HA    L.15.H    
assign (resid   15 and name HN  ) (resid   15 and name HB# ) 3.5 2.7 1.8 !pk.76  # L.15.H     L.15.HB2  
assign (resid   15 and name HN  ) (resid   67 and name HB# ) 4.5 4.2 3.0 !pk.76  # L.15.H     A.67.QB   
assign (resid  104 and name HN  ) (resid  113 and name HG1#) 4.5 3.7 2.5 !pk.77  # V.104.H    I.113.HG12
assign (resid   14 and name HG  ) (resid   15 and name HN  ) 4.5 2.7 1.5 !pk.78    L.14.HG    L.15.H    
assign (resid   15 and name HN  ) (resid   15 and name HB# ) 3.5 2.7 1.8 !pk.79  # L.15.H     L.15.HB3  
assign (resid   15 and name HN  ) (resid   15 and name HD1#) 4.5 4.2 3.0 !pk.81  # L.15.H     L.15.QD1  
assign (resid   14 and name HD1#) (resid   15 and name HN  ) 4.5 4.2 3.0 !pk.82  # L.14.QD1   L.15.H    
assign (resid  116 and name HN  ) (resid  117 and name HN  ) 3.5 1.7 0.8 !pk.83    T.116.H    E.117.H   
assign (resid   10 and name HN  ) (resid  117 and name HN  ) 4.5 2.7 1.5 !pk.84    R.10.H     E.117.H   
assign (resid  115 and name HE  ) (resid  117 and name HN  ) 4.5 2.7 1.5 !pk.85    R.115.HE   E.117.H   
assign (resid  115 and name HA  ) (resid  117 and name HN  ) 4.5 2.7 1.5 !pk.87    R.115.HA   E.117.H   
assign (resid   97 and name HA  ) (resid  117 and name HN  ) 4.5 2.7 1.5 !pk.90    T.97.HA    E.117.H   
assign (resid   10 and name HD# ) (resid  117 and name HN  ) 4.5 4.2 3.0 !pk.91  # R.10.HD3   E.117.H   
assign (resid  117 and name HN  ) (resid  117 and name HG# ) 4.5 4.2 3.0 !pk.92  # E.117.H    E.117.HG2 
assign (resid  117 and name HN  ) (resid  117 and name HG# ) 4.5 4.2 3.0 !pk.93  # E.117.H    E.117.HG3 
assign (resid  117 and name HN  ) (resid  117 and name HB# ) 4.5 3.7 2.5 !pk.94  # E.117.H    E.117.HB2 
assign (resid  117 and name HN  ) (resid  117 and name HB# ) 3.5 2.7 1.8 !pk.95  # E.117.H    E.117.HB3 
assign (resid   10 and name HB# ) (resid  117 and name HN  ) 4.5 3.7 2.5 !pk.96  # R.10.HB3   E.117.H   
assign (resid  115 and name HG# ) (resid  117 and name HN  ) 3.5 3.2 2.3 !pk.97  # R.115.HG3  E.117.H   
assign (resid  116 and name HG2#) (resid  117 and name HN  ) 4.5 4.2 3.0 !pk.98  # T.116.QG2  E.117.H   
assign (resid   25 and name HN  ) (resid   32 and name HN  ) 4.5 2.7 1.5 !pk.99    S.25.H     I.32.H    
assign (resid   26 and name HN  ) (resid   32 and name HN  ) 4.5 2.7 1.5 !pk.100   S.26.H     I.32.H    
assign (resid   32 and name HN  ) (resid   33 and name HN  ) 4.5 2.7 1.5 !pk.101   I.32.H     T.33.H    
assign (resid   31 and name HA  ) (resid   32 and name HN  ) 3.5 1.7 0.8 !pk.102   K.31.HA    I.32.H    
assign (resid   24 and name HA  ) (resid   32 and name HN  ) 4.5 2.7 1.5 !pk.103   P.24.HA    I.32.H    
assign (resid   25 and name HA  ) (resid   32 and name HN  ) 4.5 2.7 1.5 !pk.103   S.25.HA    I.32.H    
assign (resid   24 and name HB# ) (resid   32 and name HN  ) 4.5 3.7 2.5 !pk.105 # P.24.HB2   I.32.H    
assign (resid   24 and name HG# ) (resid   32 and name HN  ) 4.5 3.7 2.5 !pk.106 # P.24.HG3   I.32.H    
assign (resid   24 and name HB# ) (resid   32 and name HN  ) 4.5 3.7 2.5 !pk.107 # P.24.HB3   I.32.H    
assign (resid   31 and name HB# ) (resid   32 and name HN  ) 3.5 2.7 1.8 !pk.108 # K.31.QB    I.32.H    
assign (resid   32 and name HN  ) (resid   32 and name HB  ) 3.5 1.7 0.8 !pk.109   I.32.H     I.32.HB   
assign (resid   32 and name HN  ) (resid   32 and name HG2#) 4.5 4.2 3.0 !pk.110 # I.32.H     I.32.QG2  
assign (resid   85 and name HA  ) (resid   86 and name HN  ) 3.5 1.7 0.8 !pk.111   Q.85.HA    K.86.H    
assign (resid   86 and name HN  ) (resid   87 and name HD# ) 4.5 3.7 2.5 !pk.112 # K.86.H     P.87.HD2  
assign (resid   86 and name HN  ) (resid   87 and name HD# ) 4.5 3.7 2.5 !pk.113 # K.86.H     P.87.HD3  
assign (resid   85 and name HG# ) (resid   86 and name HN  ) 4.5 4.2 3.0 !pk.114 # Q.85.QG    K.86.H    
assign (resid   85 and name HB# ) (resid   86 and name HN  ) 4.5 3.7 2.5 !pk.115 # Q.85.HB3   K.86.H    
assign (resid   75 and name HN  ) (resid   76 and name HN  ) 4.5 2.7 1.5 !pk.117   D.75.H     L.76.H    
assign (resid   12 and name HA  ) (resid   76 and name HN  ) 3.5 1.7 0.8 !pk.119   S.12.HA    L.76.H    
assign (resid   12 and name HB# ) (resid   76 and name HN  ) 4.5 3.7 2.5 !pk.121 # S.12.HB2   L.76.H    
assign (resid   76 and name HN  ) (resid   77 and name HA# ) 4.5 3.7 2.5 !pk.122 # L.76.H     G.77.HA3  
assign (resid   75 and name HB# ) (resid   76 and name HN  ) 4.5 3.7 2.5 !pk.123 # D.75.QB    L.76.H    
assign (resid   17 and name HN  ) (resid   66 and name HB# ) 4.5 3.7 2.5 !pk.124 # K.17.H     D.66.HB3  
assign (resid   76 and name HN  ) (resid   76 and name HB# ) 3.5 2.7 1.8 !pk.125 # L.76.H     L.76.HB3  
assign (resid   76 and name HN  ) (resid   76 and name HG  ) 3.5 1.7 0.8 !pk.126   L.76.H     L.76.HG   
assign (resid   76 and name HN  ) (resid   76 and name HB# ) 4.5 3.7 2.5 !pk.127 # L.76.H     L.76.HB2  
assign (resid   86 and name HN  ) (resid   86 and name HG# ) 4.5 4.2 3.0 !pk.128 # K.86.H     K.86.HG2  
assign (resid   76 and name HN  ) (resid   76 and name HD2#) 4.5 4.2 3.0 !pk.129 # L.76.H     L.76.QD2  
assign (resid   17 and name HN  ) (resid   34 and name HH1#) 4.5 4.2 3.0 !pk.131 # K.17.H     R.34.HH12 
assign (resid   16 and name HA  ) (resid   17 and name HN  ) 3.5 1.7 0.8 !pk.132   V.16.HA    K.17.H    
assign (resid   17 and name HN  ) (resid   66 and name HB# ) 4.5 3.7 2.5 !pk.133 # K.17.H     D.66.HB2  
assign (resid   17 and name HN  ) (resid   17 and name HB# ) 3.5 2.7 1.8 !pk.134 # K.17.H     K.17.QB   
assign (resid   17 and name HN  ) (resid   17 and name HG# ) 4.5 4.2 3.0 !pk.135 # K.17.H     K.17.QG   
assign (resid   16 and name HG1#) (resid   17 and name HN  ) 4.5 4.2 3.0 !pk.136 # V.16.QG1   K.17.H    
assign (resid   16 and name HG2#) (resid   17 and name HN  ) 4.5 4.2 3.0 !pk.137 # V.16.QG2   K.17.H    
assign (resid   17 and name HN  ) (resid   32 and name HD1#) 4.5 4.2 3.0 !pk.138 # K.17.H     I.32.QD1  
assign (resid   57 and name HE# ) (resid  113 and name HN  ) 4.5 5.1 3.9 !pk.139 # F.57.QE    I.113.H   
assign (resid  112 and name HB  ) (resid  113 and name HN  ) 4.5 2.7 1.5 !pk.140   I.112.HB   I.113.H   
assign (resid  112 and name HN  ) (resid  113 and name HN  ) 4.5 2.7 1.5 !pk.142   I.112.H    I.113.H   
assign (resid  102 and name HN  ) (resid  113 and name HN  ) 4.5 2.7 1.5 !pk.144   G.102.H    I.113.H   
assign (resid   14 and name HN  ) (resid   57 and name HZ  ) 4.5 3.2 2.0 !pk.145 # L.14.H     F.57.HZ   
assign (resid  101 and name HG  ) (resid  113 and name HN  ) 3.5 1.7 0.8 !pk.146   S.101.HG   I.113.H   
assign (resid   13 and name HA  ) (resid   14 and name HN  ) 3.5 1.7 0.8 !pk.147   H.13.HA    L.14.H    
assign (resid  100 and name HA  ) (resid  113 and name HN  ) 4.5 2.7 1.5 !pk.149   M.100.HA   I.113.H   
assign (resid  112 and name HA  ) (resid  113 and name HN  ) 3.5 1.7 0.8 !pk.151   I.112.HA   I.113.H   
assign (resid  101 and name HB# ) (resid  113 and name HN  ) 4.5 3.7 2.5 !pk.153 # S.101.HB3  I.113.H   
assign (resid   13 and name HB# ) (resid   14 and name HN  ) 3.5 2.7 1.8 !pk.154 # H.13.HB2   L.14.H    
assign (resid   13 and name HB# ) (resid   14 and name HN  ) 4.5 3.7 2.5 !pk.155 # H.13.HB3   L.14.H    
assign (resid   14 and name HN  ) (resid  111 and name HB# ) 4.5 3.7 2.5 !pk.156 # L.14.H     H.111.HB2 
assign (resid   14 and name HN  ) (resid  112 and name HB  ) 4.5 2.7 1.5 !pk.158   L.14.H     I.112.HB  
assign (resid   14 and name HN  ) (resid   14 and name HB# ) 4.5 3.7 2.5 !pk.159 # L.14.H     L.14.HB2  
assign (resid  113 and name HN  ) (resid  113 and name HB  ) 3.5 1.7 0.8 !pk.160   I.113.H    I.113.HB  
assign (resid  113 and name HN  ) (resid  113 and name HG1#) 4.5 3.7 2.5 !pk.160 # I.113.H    I.113.HG12
assign (resid   14 and name HN  ) (resid   14 and name HB# ) 4.5 3.7 2.5 !pk.162 # L.14.H     L.14.HB3  
assign (resid   14 and name HN  ) (resid  112 and name HG1#) 4.5 3.7 2.5 !pk.162 # L.14.H     I.112.HG13
assign (resid  113 and name HN  ) (resid  113 and name HG2#) 4.5 4.2 3.0 !pk.163 # I.113.H    I.113.QG2 
assign (resid   14 and name HN  ) (resid   43 and name HD1#) 4.5 4.2 3.0 !pk.164 # L.14.H     I.43.QD1  
assign (resid  113 and name HN  ) (resid  113 and name HG1#) 4.5 3.7 2.5 !pk.166 # I.113.H    I.113.HG13
assign (resid   14 and name HN  ) (resid   14 and name HD1#) 4.5 4.2 3.0 !pk.167 # L.14.H     L.14.QD1  
assign (resid  113 and name HN  ) (resid  113 and name HD1#) 4.5 4.2 3.0 !pk.168 # I.113.H    I.113.QD1 
assign (resid  101 and name HG  ) (resid  102 and name HN  ) 3.5 1.7 0.8 !pk.172   S.101.HG   G.102.H   
assign (resid   13 and name HA  ) (resid  113 and name HN  ) 4.5 2.7 1.5 !pk.173   H.13.HA    I.113.H   
assign (resid  101 and name HA  ) (resid  102 and name HN  ) 2.5 0.7 0.9 !pk.174   S.101.HA   G.102.H   
assign (resid  101 and name HB# ) (resid  102 and name HN  ) 3.5 2.7 1.8 !pk.177 # S.101.HB3  G.102.H   
assign (resid   34 and name HB# ) (resid   34 and name HE  ) 3.5 2.7 1.8 !pk.179 # R.34.HB2   R.34.HE   
assign (resid   91 and name HB# ) (resid  102 and name HN  ) 4.5 4.2 3.0 !pk.180 # A.91.QB    G.102.H   
assign (resid  102 and name HN  ) (resid  113 and name HB  ) 4.5 2.7 1.5 !pk.180   G.102.H    I.113.HB  
assign (resid   34 and name HE  ) (resid   42 and name HD1#) 4.5 4.2 3.0 !pk.183 # R.34.HE    L.42.QD1  
assign (resid   95 and name HD1#) (resid  102 and name HN  ) 4.5 4.2 3.0 !pk.184 # L.95.QD1   G.102.H   
assign (resid   95 and name HD2#) (resid  102 and name HN  ) 4.5 4.2 3.0 !pk.185 # L.95.QD2   G.102.H   
assign (resid   72 and name HN  ) (resid   74 and name HN  ) 4.5 2.7 1.5 !pk.186   A.72.H     G.74.H    
assign (resid   74 and name HN  ) (resid   75 and name HB# ) 4.5 3.7 2.5 !pk.190 # G.74.H     D.75.QB   
assign (resid   73 and name HB# ) (resid   74 and name HN  ) 4.5 3.7 2.5 !pk.191 # R.73.HB2   G.74.H    
assign (resid   70 and name HB# ) (resid   74 and name HN  ) 4.5 4.2 3.0 !pk.192 # A.70.QB    G.74.H    
assign (resid   72 and name HB# ) (resid   74 and name HN  ) 4.5 4.2 3.0 !pk.193 # A.72.QB    G.74.H    
assign (resid   61 and name HB# ) (resid   74 and name HN  ) 4.5 4.2 3.0 !pk.194 # A.61.QB    G.74.H    
assign (resid   17 and name HN  ) (resid   66 and name HN  ) 4.5 2.7 1.5 !pk.195   K.17.H     D.66.H    
assign (resid   65 and name HN  ) (resid   66 and name HN  ) 4.5 2.7 1.5 !pk.197   S.65.H     D.66.H    
assign (resid   65 and name HG  ) (resid   66 and name HN  ) 4.5 2.7 1.5 !pk.198   S.65.HG    D.66.H    
assign (resid   65 and name HB# ) (resid   66 and name HN  ) 4.5 3.7 2.5 !pk.200 # S.65.HB3   D.66.H    
assign (resid   66 and name HN  ) (resid   66 and name HB# ) 4.5 3.7 2.5 !pk.201 # D.66.H     D.66.HB2  
assign (resid   66 and name HN  ) (resid   66 and name HB# ) 3.5 2.7 1.8 !pk.202 # D.66.H     D.66.HB3  
assign (resid   66 and name HN  ) (resid   67 and name HB# ) 4.5 4.2 3.0 !pk.203 # D.66.H     A.67.QB   
assign (resid   14 and name HG  ) (resid   66 and name HN  ) 4.5 2.7 1.5 !pk.204   L.14.HG    D.66.H    
assign (resid   15 and name HB# ) (resid   66 and name HN  ) 4.5 3.7 2.5 !pk.205 # L.15.HB3   D.66.H    
assign (resid   14 and name HD2#) (resid   66 and name HN  ) 4.5 4.2 3.0 !pk.206 # L.14.QD2   D.66.H    
assign (resid  111 and name HN  ) (resid  111 and name HD2 ) 4.5 3.2 2.0 !pk.208 # H.111.H    H.111.HD2 
assign (resid  110 and name HA  ) (resid  111 and name HN  ) 3.5 1.7 0.8 !pk.210   I.110.HA   H.111.H   
assign (resid    4 and name HA  ) (resid    5 and name HN  ) 2.5 0.7 0.9 !pk.212   M.4.HA     E.5.H     
assign (resid  103 and name HA  ) (resid  111 and name HN  ) 4.5 2.7 1.5 !pk.213   P.103.HA   H.111.H   
assign (resid  104 and name HA  ) (resid  111 and name HN  ) 4.5 2.7 1.5 !pk.213   V.104.HA   H.111.H   
assign (resid    5 and name HN  ) (resid    6 and name HD# ) 4.5 3.7 2.5 !pk.214 # E.5.H      P.6.QD    
assign (resid    5 and name HN  ) (resid    5 and name HG# ) 4.5 4.2 3.0 !pk.217 # E.5.H      E.5.QG    
assign (resid    5 and name HN  ) (resid    5 and name HB# ) 3.5 2.7 1.8 !pk.218 # E.5.H      E.5.QB    
assign (resid  104 and name HB  ) (resid  111 and name HN  ) 4.5 2.7 1.5 !pk.219   V.104.HB   H.111.H   
assign (resid  106 and name HG2#) (resid  111 and name HN  ) 4.5 4.2 3.0 !pk.220 # T.106.QG2  H.111.H   
assign (resid   43 and name HD1#) (resid  111 and name HN  ) 4.5 4.2 3.0 !pk.221 # I.43.QD1   H.111.H   
assign (resid   71 and name HN  ) (resid   72 and name HN  ) 3.5 1.7 0.8 !pk.223   K.71.H     A.72.H    
assign (resid   71 and name HA  ) (resid   72 and name HN  ) 3.5 1.7 0.8 !pk.224   K.71.HA    A.72.H    
assign (resid   34 and name HN  ) (resid   35 and name HN  ) 4.5 2.7 1.5 !pk.226   R.34.H     T.35.H    
assign (resid   33 and name HN  ) (resid   34 and name HN  ) 3.5 1.7 0.8 !pk.227   T.33.H     R.34.H    
assign (resid   69 and name HA  ) (resid   72 and name HN  ) 4.5 2.7 1.5 !pk.229   S.69.HA    A.72.H    
assign (resid   32 and name HA  ) (resid   34 and name HN  ) 4.5 2.7 1.5 !pk.230   I.32.HA    R.34.H    
assign (resid   19 and name HB# ) (resid   34 and name HN  ) 4.5 3.7 2.5 !pk.231 # S.19.HB3   R.34.H    
assign (resid   72 and name HN  ) (resid   73 and name HA  ) 4.5 2.7 1.5 !pk.231   A.72.H     R.73.HA   
assign (resid   34 and name HN  ) (resid   34 and name HD# ) 4.5 4.2 3.0 !pk.232 # R.34.H     R.34.HD2  
assign (resid   34 and name HN  ) (resid   34 and name HB# ) 3.5 2.7 1.8 !pk.233 # R.34.H     R.34.HB2  
assign (resid   72 and name HN  ) (resid   72 and name HB# ) 2.5 2.2 2.4 !pk.235 # A.72.H     A.72.QB   
assign (resid   71 and name HG# ) (resid   72 and name HN  ) 4.5 4.2 3.0 !pk.236 # K.71.HG3   A.72.H    
assign (resid   33 and name HG2#) (resid   34 and name HN  ) 4.5 4.2 3.0 !pk.237 # T.33.QG2   R.34.H    
assign (resid   32 and name HG2#) (resid   34 and name HN  ) 3.5 3.2 2.3 !pk.238 # I.32.QG2   R.34.H    
assign (resid  101 and name HN  ) (resid  113 and name HN  ) 4.5 2.7 1.5 !pk.239   S.101.H    I.113.H   
assign (resid  101 and name HN  ) (resid  102 and name HN  ) 4.5 2.7 1.5 !pk.241   S.101.H    G.102.H   
assign (resid  101 and name HN  ) (resid  101 and name HG  ) 4.5 2.7 1.5 !pk.242   S.101.H    S.101.HG  
assign (resid  100 and name HA  ) (resid  101 and name HN  ) 3.5 1.7 0.8 !pk.243   M.100.HA   S.101.H   
assign (resid  101 and name HN  ) (resid  101 and name HB# ) 4.5 3.7 2.5 !pk.244 # S.101.H    S.101.HB2 
assign (resid  100 and name HG# ) (resid  101 and name HN  ) 4.5 4.2 3.0 !pk.246 # M.100.HG2  S.101.H   
assign (resid  100 and name HG# ) (resid  101 and name HN  ) 4.5 4.2 3.0 !pk.247 # M.100.HG3  S.101.H   
assign (resid  100 and name HB# ) (resid  101 and name HN  ) 4.5 3.7 2.5 !pk.248 # M.100.HB2  S.101.H   
assign (resid  100 and name HB# ) (resid  101 and name HN  ) 4.5 3.7 2.5 !pk.249 # M.100.HB3  S.101.H   
assign (resid  101 and name HN  ) (resid  113 and name HB  ) 4.5 2.7 1.5 !pk.250   S.101.H    I.113.HB  
assign (resid  101 and name HN  ) (resid  112 and name HG2#) 4.5 4.2 3.0 !pk.251 # S.101.H    I.112.QG2 
assign (resid   95 and name HD1#) (resid  101 and name HN  ) 3.5 3.2 2.3 !pk.252 # L.95.QD1   S.101.H   
assign (resid   95 and name HD2#) (resid  101 and name HN  ) 4.5 4.2 3.0 !pk.253 # L.95.QD2   S.101.H   
assign (resid  101 and name HN  ) (resid  113 and name HD1#) 4.5 4.2 3.0 !pk.254 # S.101.H    I.113.QD1 
assign (resid   46 and name HN  ) (resid   48 and name HN  ) 4.5 2.7 1.5 !pk.255   Y.46.H     Q.48.H    
assign (resid   46 and name HN  ) (resid   47 and name HN  ) 3.5 1.7 0.8 !pk.256   Y.46.H     I.47.H    
assign (resid   46 and name HN  ) (resid   46 and name HD# ) 3.5 4.1 3.2 !pk.257 # Y.46.H     Y.46.QD   
assign (resid   46 and name HN  ) (resid   46 and name HE# ) 4.5 5.1 3.9 !pk.258 # Y.46.H     Y.46.QE   
assign (resid   45 and name HA# ) (resid   46 and name HN  ) 3.5 2.7 1.8 !pk.260 # G.45.QA    Y.46.H    
assign (resid   43 and name HA  ) (resid   46 and name HN  ) 3.5 1.7 0.8 !pk.261   I.43.HA    Y.46.H    
assign (resid   46 and name HN  ) (resid   46 and name HB# ) 3.5 2.7 1.8 !pk.262 # Y.46.H     Y.46.HB2  
assign (resid   46 and name HN  ) (resid   46 and name HB# ) 4.5 3.7 2.5 !pk.263 # Y.46.H     Y.46.HB3  
assign (resid   46 and name HN  ) (resid   48 and name HB# ) 4.5 3.7 2.5 !pk.264 # Y.46.H     Q.48.HB2  
assign (resid   46 and name HN  ) (resid   49 and name HB# ) 4.5 3.7 2.5 !pk.265 # Y.46.H     K.49.HB2  
assign (resid   43 and name HG2#) (resid   46 and name HN  ) 4.5 4.2 3.0 !pk.267 # I.43.QG2   Y.46.H    
assign (resid  110 and name HN  ) (resid  111 and name HN  ) 4.5 2.7 1.5 !pk.268   I.110.H    H.111.H   
assign (resid  100 and name HN  ) (resid  101 and name HN  ) 4.5 2.7 1.5 !pk.269   M.100.H    S.101.H   
assign (resid   16 and name HN  ) (resid  110 and name HN  ) 4.5 2.7 1.5 !pk.270   V.16.H     I.110.H   
assign (resid   96 and name HN  ) (resid  100 and name HN  ) 4.5 2.7 1.5 !pk.272   R.96.H     M.100.H   
assign (resid   88 and name HN  ) (resid   89 and name HN  ) 3.5 1.7 0.8 !pk.274   F.88.H     E.89.H    
assign (resid   18 and name HD2 ) (resid  110 and name HN  ) 4.5 3.2 2.0 !pk.275 # H.18.HD2   I.110.H   
assign (resid   88 and name HD# ) (resid   89 and name HN  ) 4.5 5.1 3.9 !pk.276 # F.88.QD    E.89.H    
assign (resid   99 and name HA  ) (resid  100 and name HN  ) 2.5 0.7 0.9 !pk.279   E.99.HA    M.100.H   
assign (resid   86 and name HA  ) (resid   89 and name HN  ) 4.5 2.7 1.5 !pk.280   K.86.HA    E.89.H    
assign (resid  109 and name HA# ) (resid  110 and name HN  ) 3.5 2.7 1.8 !pk.282 # G.109.HA2  I.110.H   
assign (resid  109 and name HA# ) (resid  110 and name HN  ) 3.5 2.7 1.8 !pk.284 # G.109.HA3  I.110.H   
assign (resid   88 and name HB# ) (resid   89 and name HN  ) 3.5 2.7 1.8 !pk.285 # F.88.HB2   E.89.H    
assign (resid   89 and name HN  ) (resid   89 and name HB# ) 3.5 2.7 1.8 !pk.287 # E.89.H     E.89.QB   
assign (resid   99 and name HG# ) (resid  100 and name HN  ) 3.5 3.2 2.3 !pk.288 # E.99.HG3   M.100.H   
assign (resid  100 and name HN  ) (resid  100 and name HB# ) 3.5 2.7 1.8 !pk.288 # M.100.H    M.100.HB2 
assign (resid   87 and name HB# ) (resid   89 and name HN  ) 4.5 3.7 2.5 !pk.289 # P.87.HB3   E.89.H    
assign (resid  100 and name HN  ) (resid  100 and name HB# ) 3.5 2.7 1.8 !pk.290 # M.100.H    M.100.HB3 
assign (resid  110 and name HN  ) (resid  110 and name HB  ) 3.5 1.7 0.8 !pk.291   I.110.H    I.110.HB  
assign (resid   16 and name HG1#) (resid  110 and name HN  ) 4.5 4.2 3.0 !pk.292 # V.16.QG1   I.110.H   
assign (resid   16 and name HG2#) (resid  110 and name HN  ) 4.5 4.2 3.0 !pk.293 # V.16.QG2   I.110.H   
assign (resid  110 and name HN  ) (resid  110 and name HD1#) 4.5 4.2 3.0 !pk.294 # I.110.H    I.110.QD1 
assign (resid  100 and name HN  ) (resid  114 and name HD1#) 4.5 4.2 3.0 !pk.295 # M.100.H    L.114.QD1 
assign (resid  110 and name HN  ) (resid  110 and name HG2#) 4.5 4.2 3.0 !pk.296 # I.110.H    I.110.QG2 
assign (resid    6 and name HA  ) (resid    7 and name HN  ) 3.5 1.7 0.8 !pk.299   P.6.HA     A.7.H     
assign (resid    6 and name HB# ) (resid    7 and name HN  ) 4.5 3.7 2.5 !pk.301 # P.6.HB2    A.7.H     
assign (resid    6 and name HB# ) (resid    7 and name HN  ) 3.5 2.7 1.8 !pk.302 # P.6.HB3    A.7.H     
assign (resid    7 and name HN  ) (resid    7 and name HB# ) 3.5 3.2 2.3 !pk.303 # A.7.H      A.7.QB    
assign (resid   56 and name HN  ) (resid   57 and name HN  ) 4.5 2.7 1.5 !pk.304   D.56.H     F.57.H    
assign (resid   36 and name HN  ) (resid   38 and name HN  ) 4.5 2.7 1.5 !pk.305   K.36.H     E.38.H    
assign (resid   57 and name HN  ) (resid   57 and name HD# ) 4.5 5.1 3.9 !pk.306 # F.57.H     F.57.QD   
assign (resid   57 and name HN  ) (resid   57 and name HB# ) 3.5 2.7 1.8 !pk.308 # F.57.H     F.57.HB2  
assign (resid   57 and name HN  ) (resid   57 and name HB# ) 3.5 2.7 1.8 !pk.309 # F.57.H     F.57.HB3  
assign (resid   56 and name HB# ) (resid   57 and name HN  ) 4.5 3.7 2.5 !pk.310 # D.56.HB3   F.57.H    
assign (resid   57 and name HN  ) (resid   58 and name HB# ) 4.5 3.7 2.5 !pk.311 # F.57.H     E.58.HB2  
assign (resid   50 and name HG1#) (resid   57 and name HN  ) 4.5 3.7 2.5 !pk.312 # I.50.HG13  F.57.H    
assign (resid   50 and name HG2#) (resid   57 and name HN  ) 4.5 4.2 3.0 !pk.313 # I.50.QG2   F.57.H    
assign (resid   50 and name HG1#) (resid   57 and name HN  ) 4.5 3.7 2.5 !pk.315 # I.50.HG12  F.57.H    
assign (resid   57 and name HN  ) (resid   60 and name HD1#) 4.5 4.2 3.0 !pk.315 # F.57.H     L.60.QD1  
assign (resid   60 and name HN  ) (resid   61 and name HN  ) 3.5 1.7 0.8 !pk.319   L.60.H     A.61.H    
assign (resid   61 and name HN  ) (resid   63 and name HN  ) 4.5 2.7 1.5 !pk.320   A.61.H     Q.63.H    
assign (resid   35 and name HA  ) (resid   36 and name HN  ) 3.5 1.7 0.8 !pk.321   T.35.HA    K.36.H    
assign (resid   58 and name HA  ) (resid   61 and name HN  ) 4.5 2.7 1.5 !pk.322   E.58.HA    A.61.H    
assign (resid   18 and name HB# ) (resid   36 and name HN  ) 4.5 3.7 2.5 !pk.325 # H.18.HB3   K.36.H    
assign (resid   36 and name HN  ) (resid   36 and name HB# ) 3.5 2.7 1.8 !pk.327 # K.36.H     K.36.HB2  
assign (resid   36 and name HN  ) (resid   36 and name HB# ) 3.5 2.7 1.8 !pk.328 # K.36.H     K.36.HB3  
assign (resid   61 and name HN  ) (resid   61 and name HB# ) 3.5 3.2 2.3 !pk.329 # A.61.H     A.61.QB   
assign (resid   60 and name HD2#) (resid   61 and name HN  ) 4.5 4.2 3.0 !pk.330 # L.60.QD2   A.61.H    
assign (resid   14 and name HD1#) (resid   61 and name HN  ) 4.5 4.2 3.0 !pk.331 # L.14.QD1   A.61.H    
assign (resid   96 and name HN  ) (resid   99 and name HN  ) 4.5 2.7 1.5 !pk.334   R.96.H     E.99.H    
assign (resid   38 and name HN  ) (resid   39 and name HN  ) 3.5 1.7 0.8 !pk.335   E.38.H     A.39.H    
assign (resid   34 and name HA  ) (resid   39 and name HN  ) 4.5 2.7 1.5 !pk.337   R.34.HA    A.39.H    
assign (resid   35 and name HA  ) (resid   39 and name HN  ) 4.5 2.7 1.5 !pk.337   T.35.HA    A.39.H    
assign (resid   95 and name HA  ) (resid   96 and name HN  ) 3.5 1.7 0.8 !pk.338   L.95.HA    R.96.H    
assign (resid   36 and name HA  ) (resid   39 and name HN  ) 4.5 2.7 1.5 !pk.339   K.36.HA    A.39.H    
assign (resid   18 and name HB# ) (resid   36 and name HN  ) 4.5 3.7 2.5 !pk.340 # H.18.HB2   K.36.H    
assign (resid   18 and name HB# ) (resid   39 and name HN  ) 4.5 3.7 2.5 !pk.341 # H.18.HB2   A.39.H    
assign (resid   38 and name HB# ) (resid   39 and name HN  ) 3.5 2.7 1.8 !pk.342 # E.38.HB2   A.39.H    
assign (resid   96 and name HN  ) (resid   99 and name HB# ) 3.5 2.7 1.8 !pk.343 # R.96.H     E.99.HB2  
assign (resid   96 and name HN  ) (resid   99 and name HB# ) 3.5 2.7 1.8 !pk.344 # R.96.H     E.99.HB3  
assign (resid   95 and name HB# ) (resid   96 and name HN  ) 4.5 3.7 2.5 !pk.345 # L.95.HB2   R.96.H    
assign (resid   96 and name HN  ) (resid   96 and name HB# ) 3.5 2.7 1.8 !pk.346 # R.96.H     R.96.HB3  
assign (resid   39 and name HN  ) (resid   39 and name HB# ) 3.5 3.2 2.3 !pk.347 # A.39.H     A.39.QB   
assign (resid   36 and name HN  ) (resid   36 and name HG# ) 4.5 4.2 3.0 !pk.348 # K.36.H     K.36.HG3  
assign (resid   95 and name HD1#) (resid   96 and name HN  ) 4.5 4.2 3.0 !pk.348 # L.95.QD1   R.96.H    
assign (resid   39 and name HN  ) (resid  110 and name HD1#) 4.5 4.2 3.0 !pk.349 # A.39.H     I.110.QD1 
assign (resid   27 and name HE1 ) (resid   67 and name HN  ) 4.5 3.2 2.0 !pk.351 # W.27.HE1   A.67.H    
assign (resid   66 and name HN  ) (resid   67 and name HN  ) 3.5 1.7 0.8 !pk.352   D.66.H     A.67.H    
assign (resid   35 and name HN  ) (resid   39 and name HN  ) 4.5 2.7 1.5 !pk.353   T.35.H     A.39.H    
assign (resid   98 and name HN  ) (resid   99 and name HN  ) 3.5 1.7 0.8 !pk.354   G.98.H     E.99.H    
assign (resid   65 and name HG  ) (resid   67 and name HN  ) 3.5 1.7 0.8 !pk.356   S.65.HG    A.67.H    
assign (resid   65 and name HB# ) (resid   67 and name HN  ) 4.5 3.7 2.5 !pk.361 # S.65.HB3   A.67.H    
assign (resid   22 and name HN  ) (resid   22 and name HD# ) 4.5 4.2 3.0 !pk.364 # R.22.H     R.22.HD2  
assign (resid   99 and name HN  ) (resid  115 and name HD# ) 4.5 4.2 3.0 !pk.365 # E.99.H     R.115.HD2 
assign (resid   18 and name HB# ) (resid   39 and name HN  ) 4.5 3.7 2.5 !pk.366 # H.18.HB3   A.39.H    
assign (resid   66 and name HB# ) (resid   67 and name HN  ) 4.5 3.7 2.5 !pk.367 # D.66.HB2   A.67.H    
assign (resid   99 and name HN  ) (resid   99 and name HB# ) 3.5 2.7 1.8 !pk.368 # E.99.H     E.99.HB2  
assign (resid   38 and name HB# ) (resid   39 and name HN  ) 4.5 3.7 2.5 !pk.369 # E.38.HB3   A.39.H    
assign (resid   99 and name HN  ) (resid   99 and name HB# ) 3.5 2.7 1.8 !pk.370 # E.99.H     E.99.HB3  
assign (resid   67 and name HN  ) (resid   70 and name HB# ) 4.5 4.2 3.0 !pk.371 # A.67.H     A.70.QB   
assign (resid   22 and name HN  ) (resid   22 and name HG# ) 3.5 3.2 2.3 !pk.372 # R.22.H     R.22.QG   
assign (resid   67 and name HN  ) (resid   67 and name HB# ) 3.5 3.2 2.3 !pk.373 # A.67.H     A.67.QB   
assign (resid   97 and name HG2#) (resid   99 and name HN  ) 4.5 4.2 3.0 !pk.374 # T.97.QG2   E.99.H    
assign (resid   15 and name HB# ) (resid   67 and name HN  ) 4.5 3.7 2.5 !pk.375 # L.15.HB3   A.67.H    
assign (resid   95 and name HD1#) (resid   99 and name HN  ) 4.5 4.2 3.0 !pk.376 # L.95.QD1   E.99.H    
assign (resid   15 and name HD2#) (resid   67 and name HN  ) 4.5 4.2 3.0 !pk.377 # L.15.QD2   A.67.H    
assign (resid   99 and name HN  ) (resid  114 and name HD1#) 4.5 4.2 3.0 !pk.378 # E.99.H     L.114.QD1 
assign (resid   66 and name HB# ) (resid   67 and name HN  ) 4.5 3.7 2.5 !pk.379 # D.66.HB3   A.67.H    
assign (resid   35 and name HN  ) (resid   38 and name HN  ) 4.5 2.7 1.5 !pk.381   T.35.H     E.38.H    
assign (resid   38 and name HN  ) (resid   40 and name HN  ) 4.5 2.7 1.5 !pk.384   E.38.H     L.40.H    
assign (resid   35 and name HA  ) (resid   38 and name HN  ) 4.5 2.7 1.5 !pk.387   T.35.HA    E.38.H    
assign (resid   36 and name HA  ) (resid   38 and name HN  ) 4.5 2.7 1.5 !pk.390   K.36.HA    E.38.H    
assign (resid   38 and name HN  ) (resid   38 and name HB# ) 3.5 2.7 1.8 !pk.391 # E.38.H     E.38.HB2  
assign (resid   54 and name HN  ) (resid   54 and name HG# ) 3.5 3.2 2.3 !pk.392 # E.54.H     E.54.HG2  
assign (resid   38 and name HN  ) (resid   38 and name HG# ) 3.5 3.2 2.3 !pk.393 # E.38.H     E.38.HG3  
assign (resid   54 and name HN  ) (resid   54 and name HG# ) 3.5 3.2 2.3 !pk.394 # E.54.H     E.54.HG3  
assign (resid   54 and name HN  ) (resid   54 and name HB# ) 2.5 1.7 1.9 !pk.395 # E.54.H     E.54.QB   
assign (resid   37 and name HB# ) (resid   38 and name HN  ) 3.5 2.7 1.8 !pk.396 # E.37.HB2   E.38.H    
assign (resid   37 and name HB# ) (resid   38 and name HN  ) 4.5 3.7 2.5 !pk.397 # E.37.HB3   E.38.H    
assign (resid   35 and name HG2#) (resid   38 and name HN  ) 4.5 4.2 3.0 !pk.398 # T.35.QG2   E.38.H    
assign (resid   36 and name HG# ) (resid   38 and name HN  ) 4.5 4.2 3.0 !pk.399 # K.36.HG3   E.38.H    
assign (resid   42 and name HN  ) (resid   44 and name HN  ) 4.5 2.7 1.5 !pk.401   L.42.H     N.44.H    
assign (resid   80 and name HN  ) (resid   81 and name HN  ) 4.5 2.7 1.5 !pk.402   S.80.H     R.81.H    
assign (resid   42 and name HN  ) (resid   43 and name HN  ) 3.5 1.7 0.8 !pk.403   L.42.H     I.43.H    
assign (resid   81 and name HN  ) (resid   93 and name HZ  ) 4.5 3.2 2.0 !pk.404 # R.81.H     F.93.HZ   
assign (resid   80 and name HA  ) (resid   81 and name HN  ) 3.5 1.7 0.8 !pk.405   S.80.HA    R.81.H    
assign (resid    8 and name HA  ) (resid   81 and name HN  ) 4.5 2.7 1.5 !pk.406   R.8.HA     R.81.H    
assign (resid   39 and name HA  ) (resid   42 and name HN  ) 3.5 1.7 0.8 !pk.407   A.39.HA    L.42.H    
assign (resid   80 and name HB# ) (resid   81 and name HN  ) 3.5 2.7 1.8 !pk.408 # S.80.HB3   R.81.H    
assign (resid   81 and name HN  ) (resid   81 and name HD# ) 4.5 4.2 3.0 !pk.410 # R.81.H     R.81.QD   
assign (resid   41 and name HG# ) (resid   42 and name HN  ) 4.5 4.2 3.0 !pk.411 # E.41.HG2   L.42.H    
assign (resid   42 and name HN  ) (resid   43 and name HB  ) 4.5 2.7 1.5 !pk.411   L.42.H     I.43.HB   
assign (resid   41 and name HB# ) (resid   42 and name HN  ) 3.5 2.7 1.8 !pk.412 # E.41.QB    L.42.H    
assign (resid   42 and name HN  ) (resid   42 and name HB# ) 3.5 2.7 1.8 !pk.413 # L.42.H     L.42.HB2  
assign (resid   81 and name HN  ) (resid   81 and name HB# ) 3.5 2.7 1.8 !pk.414 # R.81.H     R.81.HB2  
assign (resid   42 and name HN  ) (resid   42 and name HG  ) 3.5 1.7 0.8 !pk.415   L.42.H     L.42.HG   
assign (resid   16 and name HG1#) (resid   42 and name HN  ) 4.5 4.2 3.0 !pk.416 # V.16.QG1   L.42.H    
assign (resid   81 and name HN  ) (resid   81 and name HG# ) 3.5 3.2 2.3 !pk.417 # R.81.H     R.81.HG2  
assign (resid   42 and name HN  ) (resid   42 and name HB# ) 3.5 2.7 1.8 !pk.418 # L.42.H     L.42.HB3  
assign (resid   81 and name HN  ) (resid   81 and name HG# ) 4.5 4.2 3.0 !pk.421 # R.81.H     R.81.HG3  
assign (resid   50 and name HN  ) (resid   51 and name HN  ) 3.5 1.7 0.8 !pk.422   I.50.H     K.51.H    
assign (resid   47 and name HA  ) (resid   51 and name HN  ) 4.5 2.7 1.5 !pk.426   I.47.HA    K.51.H    
assign (resid   51 and name HN  ) (resid   51 and name HE# ) 4.5 4.2 3.0 !pk.427 # K.51.H     K.51.QE   
assign (resid   11 and name HB# ) (resid  116 and name HN  ) 4.5 3.7 2.5 !pk.428 # C.11.HB3   T.116.H   
assign (resid  115 and name HD# ) (resid  116 and name HN  ) 4.5 4.2 3.0 !pk.428 # R.115.HD2  T.116.H   
assign (resid   51 and name HN  ) (resid   51 and name HB# ) 3.5 2.7 1.8 !pk.430 # K.51.H     K.51.HB3  
assign (resid   51 and name HN  ) (resid   51 and name HG# ) 4.5 4.2 3.0 !pk.431 # K.51.H     K.51.HG3  
assign (resid   50 and name HD1#) (resid   51 and name HN  ) 4.5 4.2 3.0 !pk.433 # I.50.QD1   K.51.H    
assign (resid   50 and name HG1#) (resid   51 and name HN  ) 4.5 3.7 2.5 !pk.434 # I.50.HG12  K.51.H    
assign (resid   19 and name HN  ) (resid   21 and name HN  ) 4.5 2.7 1.5 !pk.435   S.19.H     S.21.H    
assign (resid   20 and name HN  ) (resid   21 and name HN  ) 3.5 1.7 0.8 !pk.436   Q.20.H     S.21.H    
assign (resid   10 and name HN  ) (resid  116 and name HN  ) 4.5 2.7 1.5 !pk.437   R.10.H     T.116.H   
assign (resid   25 and name HN  ) (resid   26 and name HN  ) 4.5 2.7 1.5 !pk.438   S.25.H     S.26.H    
assign (resid   18 and name HN  ) (resid   21 and name HN  ) 4.5 2.7 1.5 !pk.439   H.18.H     S.21.H    
assign (resid   18 and name HE1 ) (resid   21 and name HN  ) 4.5 3.2 2.0 !pk.441 # H.18.HE1   S.21.H    
assign (resid   11 and name HA  ) (resid  116 and name HN  ) 3.5 1.7 0.8 !pk.443   C.11.HA    T.116.H   
assign (resid  115 and name HA  ) (resid  116 and name HN  ) 3.5 1.7 0.8 !pk.444   R.115.HA   T.116.H   
assign (resid   10 and name HN  ) (resid  115 and name HA  ) 4.5 2.7 1.5 !pk.445   R.10.H     R.115.HA  
assign (resid   21 and name HN  ) (resid   24 and name HA  ) 4.5 2.7 1.5 !pk.446   S.21.H     P.24.HA   
assign (resid   24 and name HA  ) (resid   25 and name HN  ) 3.5 1.7 0.8 !pk.447   P.24.HA    S.25.H    
assign (resid   19 and name HA  ) (resid   21 and name HN  ) 4.5 2.7 1.5 !pk.448   S.19.HA    S.21.H    
assign (resid   25 and name HN  ) (resid   25 and name HB# ) 4.5 3.7 2.5 !pk.450 # S.25.H     S.25.HB2  
assign (resid   57 and name HA  ) (resid   60 and name HN  ) 4.5 2.7 1.5 !pk.451   F.57.HA    L.60.H    
assign (resid   21 and name HN  ) (resid   21 and name HB# ) 3.5 2.7 1.8 !pk.452 # S.21.H     S.21.QB   
assign (resid   25 and name HN  ) (resid   25 and name HB# ) 3.5 2.7 1.8 !pk.453 # S.25.H     S.25.HB3  
assign (resid   20 and name HB# ) (resid   21 and name HN  ) 4.5 3.7 2.5 !pk.454 # Q.20.HB2   S.21.H    
assign (resid   20 and name HG# ) (resid   21 and name HN  ) 4.5 4.2 3.0 !pk.455 # Q.20.QG    S.21.H    
assign (resid   20 and name HB# ) (resid   21 and name HN  ) 4.5 3.7 2.5 !pk.456 # Q.20.HB3   S.21.H    
assign (resid   17 and name HD# ) (resid   25 and name HN  ) 4.5 4.2 3.0 !pk.458 # K.17.HD2   S.25.H    
assign (resid  115 and name HB# ) (resid  116 and name HN  ) 4.5 3.7 2.5 !pk.458 # R.115.HB3  T.116.H   
assign (resid   21 and name HN  ) (resid   24 and name HB# ) 4.5 3.7 2.5 !pk.459 # S.21.H     P.24.HB3  
assign (resid   10 and name HB# ) (resid  116 and name HN  ) 4.5 3.7 2.5 !pk.460 # R.10.HB2   T.116.H   
assign (resid   17 and name HB# ) (resid   21 and name HN  ) 4.5 3.7 2.5 !pk.461 # K.17.QB    S.21.H    
assign (resid   17 and name HD# ) (resid   25 and name HN  ) 3.5 3.2 2.3 !pk.462 # K.17.HD3   S.25.H    
assign (resid  115 and name HG# ) (resid  116 and name HN  ) 4.5 4.2 3.0 !pk.463 # R.115.HG3  T.116.H   
assign (resid  116 and name HN  ) (resid  116 and name HG2#) 3.5 3.2 2.3 !pk.464 # T.116.H    T.116.QG2 
assign (resid   60 and name HN  ) (resid   61 and name HB# ) 4.5 4.2 3.0 !pk.465 # L.60.H     A.61.QB   
assign (resid   25 and name HN  ) (resid   32 and name HD1#) 4.5 4.2 3.0 !pk.466 # S.25.H     I.32.QD1  
assign (resid   10 and name HN  ) (resid   11 and name HN  ) 4.5 2.7 1.5 !pk.472   R.10.H     C.11.H    
assign (resid   60 and name HN  ) (resid   63 and name HE2#) 4.5 4.2 3.0 !pk.473 # L.60.H     Q.63.HE21 
assign (resid   60 and name HN  ) (resid   64 and name HD# ) 4.5 5.1 3.9 !pk.473 # L.60.H     F.64.QD   
assign (resid   10 and name HN  ) (resid   78 and name HA  ) 4.5 2.7 1.5 !pk.474   R.10.H     A.78.HA   
assign (resid    9 and name HA  ) (resid   10 and name HN  ) 3.5 1.7 0.8 !pk.475   V.9.HA     R.10.H    
assign (resid   10 and name HN  ) (resid   10 and name HD# ) 4.5 4.2 3.0 !pk.479 # R.10.H     R.10.HD3  
assign (resid   55 and name HG# ) (resid   60 and name HN  ) 4.5 4.2 3.0 !pk.480 # E.55.QG    L.60.H    
assign (resid   58 and name HB# ) (resid   60 and name HN  ) 4.5 3.7 2.5 !pk.480 # E.58.HB2   L.60.H    
assign (resid   10 and name HN  ) (resid  117 and name HB# ) 4.5 3.7 2.5 !pk.481 # R.10.H     E.117.HB3 
assign (resid   60 and name HN  ) (resid   60 and name HG  ) 4.5 2.7 1.5 !pk.482   L.60.H     L.60.HG   
assign (resid   60 and name HN  ) (resid   60 and name HB# ) 3.5 2.7 1.8 !pk.483 # L.60.H     L.60.HB2  
assign (resid    9 and name HB  ) (resid   10 and name HN  ) 3.5 1.7 0.8 !pk.484   V.9.HB     R.10.H    
assign (resid   60 and name HN  ) (resid   60 and name HD2#) 3.5 3.2 2.3 !pk.485 # L.60.H     L.60.QD2  
assign (resid   14 and name HD1#) (resid   60 and name HN  ) 4.5 4.2 3.0 !pk.486 # L.14.QD1   L.60.H    
assign (resid    9 and name HG1#) (resid   10 and name HN  ) 4.5 4.2 3.0 !pk.487 # V.9.QG1    R.10.H    
assign (resid    9 and name HG2#) (resid   10 and name HN  ) 4.5 4.2 3.0 !pk.488 # V.9.QG2    R.10.H    
assign (resid   18 and name HE1 ) (resid   20 and name HN  ) 4.5 3.2 2.0 !pk.491 # H.18.HE1   Q.20.H    
assign (resid   19 and name HB# ) (resid   20 and name HN  ) 4.5 3.7 2.5 !pk.492 # S.19.HB2   Q.20.H    
assign (resid   18 and name HB# ) (resid   20 and name HN  ) 4.5 3.7 2.5 !pk.493 # H.18.HB2   Q.20.H    
assign (resid   20 and name HN  ) (resid   20 and name HB# ) 3.5 2.7 1.8 !pk.494 # Q.20.H     Q.20.HB2  
assign (resid   20 and name HN  ) (resid   20 and name HG# ) 4.5 4.2 3.0 !pk.495 # Q.20.H     Q.20.QG   
assign (resid   20 and name HN  ) (resid   20 and name HB# ) 3.5 2.7 1.8 !pk.496 # Q.20.H     Q.20.HB3  
assign (resid   40 and name HA  ) (resid   43 and name HN  ) 4.5 2.7 1.5 !pk.499   L.40.HA    I.43.H    
assign (resid   43 and name HN  ) (resid   44 and name HB# ) 4.5 3.7 2.5 !pk.501 # I.43.H     N.44.HB2  
assign (resid   43 and name HN  ) (resid   43 and name HB  ) 3.5 1.7 0.8 !pk.502   I.43.H     I.43.HB   
assign (resid   42 and name HB# ) (resid   43 and name HN  ) 3.5 2.7 1.8 !pk.503 # L.42.HB2   I.43.H    
assign (resid   43 and name HN  ) (resid   43 and name HG1#) 3.5 2.7 1.8 !pk.504 # I.43.H     I.43.HG12 
assign (resid   43 and name HN  ) (resid   43 and name HG1#) 3.5 2.7 1.8 !pk.505 # I.43.H     I.43.HG13 
assign (resid   16 and name HG2#) (resid   43 and name HN  ) 4.5 4.2 3.0 !pk.506 # V.16.QG2   I.43.H    
assign (resid   43 and name HN  ) (resid   43 and name HG2#) 4.5 4.2 3.0 !pk.507 # I.43.H     I.43.QG2  
assign (resid   43 and name HN  ) (resid  110 and name HG2#) 4.5 4.2 3.0 !pk.508 # I.43.H     I.110.QG2 
assign (resid   49 and name HN  ) (resid   51 and name HN  ) 4.5 2.7 1.5 !pk.509   K.49.H     K.51.H    
assign (resid   39 and name HN  ) (resid   40 and name HN  ) 3.5 1.7 0.8 !pk.510   A.39.H     L.40.H    
assign (resid   43 and name HN  ) (resid   46 and name HD# ) 4.5 5.1 3.9 !pk.512 # I.43.H     Y.46.QD   
assign (resid   46 and name HA  ) (resid   49 and name HN  ) 4.5 2.7 1.5 !pk.513   Y.46.HA    K.49.H    
assign (resid   48 and name HG# ) (resid   49 and name HN  ) 4.5 4.2 3.0 !pk.516 # Q.48.QG    K.49.H    
assign (resid   49 and name HN  ) (resid   49 and name HB# ) 3.5 2.7 1.8 !pk.517 # K.49.H     K.49.HB2  
assign (resid   40 and name HN  ) (resid   40 and name HB# ) 3.5 2.7 1.8 !pk.518 # L.40.H     L.40.HB2  
assign (resid   49 and name HN  ) (resid   49 and name HG# ) 3.5 3.2 2.3 !pk.519 # K.49.H     K.49.HG2  
assign (resid   39 and name HB# ) (resid   40 and name HN  ) 3.5 3.2 2.3 !pk.520 # A.39.QB    L.40.H    
assign (resid   40 and name HN  ) (resid   40 and name HB# ) 3.5 2.7 1.8 !pk.520 # L.40.H     L.40.HB3  
assign (resid   95 and name HN  ) (resid   96 and name HN  ) 4.5 2.7 1.5 !pk.521   L.95.H     R.96.H    
assign (resid   93 and name HN  ) (resid   95 and name HN  ) 4.5 2.7 1.5 !pk.522   F.93.H     L.95.H    
assign (resid   95 and name HN  ) (resid  115 and name HD# ) 4.5 4.2 3.0 !pk.525 # L.95.H     R.115.HD3 
assign (resid   95 and name HN  ) (resid   95 and name HG  ) 3.5 1.7 0.8 !pk.526   L.95.H     L.95.HG   
assign (resid   50 and name HN  ) (resid   50 and name HB  ) 3.5 1.7 0.8 !pk.527   I.50.H     I.50.HB   
assign (resid   95 and name HN  ) (resid   95 and name HB# ) 3.5 2.7 1.8 !pk.528 # L.95.H     L.95.HB2  
assign (resid   94 and name HB# ) (resid   95 and name HN  ) 4.5 4.2 3.0 !pk.529 # A.94.QB    L.95.H    
assign (resid   50 and name HN  ) (resid   50 and name HD1#) 3.5 3.2 2.3 !pk.531 # I.50.H     I.50.QD1  
assign (resid   50 and name HN  ) (resid   50 and name HG1#) 3.5 2.7 1.8 !pk.532 # I.50.H     I.50.HG12 
assign (resid   93 and name HA  ) (resid   95 and name HN  ) 4.5 2.7 1.5 !pk.535   F.93.HA    L.95.H    
assign (resid   61 and name HB# ) (resid   75 and name HN  ) 4.5 4.2 3.0 !pk.537 # A.61.QB    D.75.H    
assign (resid   13 and name HN  ) (resid   75 and name HN  ) 4.5 2.7 1.5 !pk.538   H.13.H     D.75.H    
assign (resid   74 and name HN  ) (resid   75 and name HN  ) 3.5 1.7 0.8 !pk.540   G.74.H     D.75.H    
assign (resid   72 and name HN  ) (resid   75 and name HN  ) 4.5 2.7 1.5 !pk.541   A.72.H     D.75.H    
assign (resid   12 and name HA  ) (resid   75 and name HN  ) 4.5 2.7 1.5 !pk.542   S.12.HA    D.75.H    
assign (resid   13 and name HN  ) (resid   74 and name HA# ) 4.5 3.7 2.5 !pk.544 # H.13.H     G.74.HA2  
assign (resid   75 and name HN  ) (resid   75 and name HB# ) 2.5 1.7 1.9 !pk.547 # D.75.H     D.75.QB   
assign (resid   73 and name HB# ) (resid   75 and name HN  ) 4.5 3.7 2.5 !pk.548 # R.73.HB3   D.75.H    
assign (resid   72 and name HB# ) (resid   75 and name HN  ) 3.5 3.2 2.3 !pk.549 # A.72.QB    D.75.H    
assign (resid   13 and name HN  ) (resid   76 and name HD2#) 4.5 4.2 3.0 !pk.550 # H.13.H     L.76.QD2  
assign (resid   13 and name HN  ) (resid   76 and name HN  ) 4.5 2.7 1.5 !pk.551   H.13.H     L.76.H    
assign (resid   77 and name HN  ) (resid   78 and name HN  ) 4.5 2.7 1.5 !pk.552   G.77.H     A.78.H    
assign (resid   13 and name HN  ) (resid   13 and name HD2 ) 3.5 2.2 1.3 !pk.553 # H.13.H     H.13.HD2  
assign (resid   13 and name HN  ) (resid   57 and name HE# ) 4.5 5.1 3.9 !pk.554 # H.13.H     F.57.QE   
assign (resid   12 and name HA  ) (resid   13 and name HN  ) 3.5 1.7 0.8 !pk.556   S.12.HA    H.13.H    
assign (resid   77 and name HA# ) (resid   78 and name HN  ) 3.5 2.7 1.8 !pk.558 # G.77.HA2   A.78.H    
assign (resid   12 and name HB# ) (resid   13 and name HN  ) 3.5 2.7 1.8 !pk.559 # S.12.HB2   H.13.H    
assign (resid   13 and name HN  ) (resid   74 and name HA# ) 4.5 3.7 2.5 !pk.560 # H.13.H     G.74.HA3  
assign (resid   77 and name HA# ) (resid   78 and name HN  ) 3.5 2.7 1.8 !pk.561 # G.77.HA3   A.78.H    
assign (resid   12 and name HB# ) (resid   13 and name HN  ) 4.5 3.7 2.5 !pk.563 # S.12.HB3   H.13.H    
assign (resid   41 and name HN  ) (resid   41 and name HB# ) 2.5 1.7 1.9 !pk.565 # E.41.H     E.41.QB   
assign (resid   13 and name HN  ) (resid   76 and name HG  ) 4.5 2.7 1.5 !pk.566   H.13.H     L.76.HG   
assign (resid   78 and name HN  ) (resid   78 and name HB# ) 2.5 2.2 2.4 !pk.567 # A.78.H     A.78.QB   
assign (resid   13 and name HN  ) (resid   14 and name HB# ) 4.5 3.7 2.5 !pk.568 # H.13.H     L.14.HB3  
assign (resid   13 and name HN  ) (resid   61 and name HB# ) 4.5 4.2 3.0 !pk.568 # H.13.H     A.61.QB   
assign (resid   13 and name HN  ) (resid   76 and name HD1#) 4.5 4.2 3.0 !pk.569 # H.13.H     L.76.QD1  
assign (resid   39 and name HN  ) (resid   41 and name HN  ) 4.5 2.7 1.5 !pk.570   A.39.H     E.41.H    
assign (resid   40 and name HN  ) (resid   41 and name HN  ) 3.5 1.7 0.8 !pk.571   L.40.H     E.41.H    
assign (resid   41 and name HN  ) (resid   41 and name HG# ) 3.5 3.2 2.3 !pk.573 # E.41.H     E.41.HG2  
assign (resid   40 and name HG  ) (resid   41 and name HN  ) 4.5 2.7 1.5 !pk.574   L.40.HG    E.41.H    
assign (resid   40 and name HB# ) (resid   41 and name HN  ) 3.5 2.7 1.8 !pk.575 # L.40.HB3   E.41.H    
assign (resid   40 and name HD1#) (resid   41 and name HN  ) 4.5 4.2 3.0 !pk.576 # L.40.QD1   E.41.H    
assign (resid   82 and name HN  ) (resid   83 and name HN  ) 3.5 1.7 0.8 !pk.578   G.82.H     Q.83.H    
assign (resid   83 and name HN  ) (resid   84 and name HN  ) 3.5 1.7 0.8 !pk.579   Q.83.H     M.84.H    
assign (resid   89 and name HN  ) (resid   91 and name HN  ) 4.5 2.7 1.5 !pk.580   E.89.H     A.91.H    
assign (resid   93 and name HN  ) (resid   94 and name HN  ) 3.5 1.7 0.8 !pk.582   F.93.H     A.94.H    
assign (resid   43 and name HN  ) (resid   44 and name HN  ) 3.5 1.7 0.8 !pk.583   I.43.H     N.44.H    
assign (resid   92 and name HN  ) (resid   94 and name HN  ) 4.5 2.7 1.5 !pk.586   S.92.H     A.94.H    
assign (resid   93 and name HD# ) (resid   94 and name HN  ) 4.5 5.1 3.9 !pk.587 # F.93.QD    A.94.H    
assign (resid   26 and name HN  ) (resid   29 and name HN  ) 4.5 2.7 1.5 !pk.588   S.26.H     Q.29.H    
assign (resid   44 and name HN  ) (resid   44 and name HD2#) 4.5 4.2 3.0 !pk.589 # N.44.H     N.44.HD22 
assign (resid   26 and name HN  ) (resid   26 and name HB# ) 4.5 3.7 2.5 !pk.590 # S.26.H     S.26.HB3  
assign (resid   25 and name HA  ) (resid   26 and name HN  ) 3.5 1.7 0.8 !pk.593   S.25.HA    S.26.H    
assign (resid   91 and name HA  ) (resid   94 and name HN  ) 4.5 2.7 1.5 !pk.596   A.91.HA    A.94.H    
assign (resid   81 and name HA  ) (resid   83 and name HN  ) 4.5 2.7 1.5 !pk.598   R.81.HA    Q.83.H    
assign (resid   91 and name HN  ) (resid   92 and name HB# ) 4.5 3.7 2.5 !pk.599 # A.91.H     S.92.HB2  
assign (resid   25 and name HB# ) (resid   26 and name HN  ) 3.5 2.7 1.8 !pk.602 # S.25.HB2   S.26.H    
assign (resid   88 and name HA  ) (resid   91 and name HN  ) 4.5 2.7 1.5 !pk.603   F.88.HA    A.91.H    
assign (resid   25 and name HB# ) (resid   26 and name HN  ) 4.5 3.7 2.5 !pk.604 # S.25.HB3   S.26.H    
assign (resid   93 and name HB# ) (resid   94 and name HN  ) 4.5 3.7 2.5 !pk.605 # F.93.HB2   A.94.H    
assign (resid   93 and name HB# ) (resid   94 and name HN  ) 4.5 3.7 2.5 !pk.606 # F.93.HB3   A.94.H    
assign (resid   44 and name HN  ) (resid   44 and name HB# ) 3.5 2.7 1.8 !pk.607 # N.44.H     N.44.HB2  
assign (resid   43 and name HB  ) (resid   44 and name HN  ) 3.5 1.7 0.8 !pk.609   I.43.HB    N.44.H    
assign (resid   83 and name HN  ) (resid   83 and name HB# ) 3.5 2.7 1.8 !pk.610 # Q.83.H     Q.83.HB2  
assign (resid   83 and name HN  ) (resid   83 and name HB# ) 3.5 2.7 1.8 !pk.611 # Q.83.H     Q.83.HB3  
assign (resid   94 and name HN  ) (resid   95 and name HG  ) 4.5 2.7 1.5 !pk.612   A.94.H     L.95.HG   
assign (resid   41 and name HB# ) (resid   44 and name HN  ) 4.5 3.7 2.5 !pk.613 # E.41.QB    N.44.H    
assign (resid   83 and name HN  ) (resid   84 and name HB# ) 4.5 3.7 2.5 !pk.614 # Q.83.H     M.84.HB2  
assign (resid   86 and name HD# ) (resid   90 and name HN  ) 4.5 4.2 3.0 !pk.615 # K.86.HD2   D.90.H    
assign (resid   87 and name HB# ) (resid   90 and name HN  ) 4.5 3.7 2.5 !pk.615 # P.87.HB3   D.90.H    
assign (resid   94 and name HN  ) (resid   95 and name HB# ) 4.5 3.7 2.5 !pk.616 # A.94.H     L.95.HB2  
assign (resid   43 and name HG1#) (resid   44 and name HN  ) 4.5 3.7 2.5 !pk.617 # I.43.HG12  N.44.H    
assign (resid   86 and name HG# ) (resid   90 and name HN  ) 4.5 4.2 3.0 !pk.618 # K.86.HG2   D.90.H    
assign (resid   94 and name HN  ) (resid   95 and name HD1#) 4.5 4.2 3.0 !pk.620 # A.94.H     L.95.QD1  
assign (resid   26 and name HN  ) (resid   32 and name HD1#) 4.5 4.2 3.0 !pk.621 # S.26.H     I.32.QD1  
assign (resid   89 and name HN  ) (resid   90 and name HN  ) 3.5 1.7 0.8 !pk.623   E.89.H     D.90.H    
assign (resid   26 and name HN  ) (resid   27 and name HN  ) 4.5 2.7 1.5 !pk.624   S.26.H     W.27.H    
assign (resid   45 and name HN  ) (resid   47 and name HN  ) 4.5 2.7 1.5 !pk.626   G.45.H     I.47.H    
assign (resid   27 and name HN  ) (resid   27 and name HD1 ) 4.5 3.2 2.0 !pk.629 # W.27.H     W.27.HD1  
assign (resid   44 and name HN  ) (resid   44 and name HD2#) 4.5 4.2 3.0 !pk.630 # N.44.H     N.44.HD21 
assign (resid   90 and name HN  ) (resid   91 and name HN  ) 3.5 1.7 0.8 !pk.631   D.90.H     A.91.H    
assign (resid   46 and name HD# ) (resid   47 and name HN  ) 4.5 5.1 3.9 !pk.633 # Y.46.QD    I.47.H    
assign (resid   44 and name HA  ) (resid   47 and name HN  ) 4.5 2.7 1.5 !pk.636   N.44.HA    I.47.H    
assign (resid   86 and name HA  ) (resid   90 and name HN  ) 4.5 2.7 1.5 !pk.640   K.86.HA    D.90.H    
assign (resid   45 and name HA# ) (resid   47 and name HN  ) 4.5 3.7 2.5 !pk.646 # G.45.QA    I.47.H    
assign (resid   88 and name HA  ) (resid   90 and name HN  ) 4.5 2.7 1.5 !pk.647   F.88.HA    D.90.H    
assign (resid   43 and name HA  ) (resid   47 and name HN  ) 4.5 2.7 1.5 !pk.649   I.43.HA    I.47.H    
assign (resid   88 and name HB# ) (resid   90 and name HN  ) 4.5 3.7 2.5 !pk.652 # F.88.HB2   D.90.H    
assign (resid   27 and name HN  ) (resid   27 and name HB# ) 4.5 3.7 2.5 !pk.653 # W.27.H     W.27.HB3  
assign (resid   79 and name HB# ) (resid   83 and name HN  ) 4.5 3.7 2.5 !pk.654 # F.79.QB    Q.83.H    
assign (resid   46 and name HB# ) (resid   47 and name HN  ) 3.5 2.7 1.8 !pk.655 # Y.46.HB2   I.47.H    
assign (resid   91 and name HN  ) (resid   92 and name HG  ) 4.5 2.7 1.5 !pk.656   A.91.H     S.92.HG   
assign (resid   46 and name HB# ) (resid   47 and name HN  ) 4.5 3.7 2.5 !pk.657 # Y.46.HB3   I.47.H    
assign (resid   90 and name HB# ) (resid   91 and name HN  ) 3.5 2.7 1.8 !pk.658 # D.90.HB3   A.91.H    
assign (resid   90 and name HN  ) (resid   90 and name HB# ) 3.5 2.7 1.8 !pk.659 # D.90.H     D.90.HB3  
assign (resid   89 and name HB# ) (resid   90 and name HN  ) 3.5 2.7 1.8 !pk.660 # E.89.QB    D.90.H    
assign (resid   89 and name HB# ) (resid   91 and name HN  ) 4.5 3.7 2.5 !pk.661 # E.89.QB    A.91.H    
assign (resid   47 and name HN  ) (resid   47 and name HB  ) 3.5 1.7 0.8 !pk.662   I.47.H     I.47.HB   
assign (resid   26 and name HN  ) (resid   29 and name HB# ) 4.5 3.7 2.5 !pk.664 # S.26.H     Q.29.QB   
assign (resid   40 and name HG  ) (resid   44 and name HN  ) 4.5 2.7 1.5 !pk.665   L.40.HG    N.44.H    
assign (resid   44 and name HN  ) (resid  103 and name HB# ) 4.5 3.7 2.5 !pk.665 # N.44.H     P.103.HB3 
assign (resid   67 and name HB# ) (resid   68 and name HN  ) 4.5 4.2 3.0 !pk.666 # A.67.QB    S.68.H    
assign (resid   90 and name HN  ) (resid   91 and name HB# ) 4.5 4.2 3.0 !pk.667 # D.90.H     A.91.QB   
assign (resid   91 and name HN  ) (resid   91 and name HB# ) 3.5 3.2 2.3 !pk.668 # A.91.H     A.91.QB   
assign (resid   43 and name HG1#) (resid   44 and name HN  ) 4.5 3.7 2.5 !pk.669 # I.43.HG13  N.44.H    
assign (resid   40 and name HD1#) (resid   44 and name HN  ) 4.5 4.2 3.0 !pk.670 # L.40.QD1   N.44.H    
assign (resid   44 and name HN  ) (resid   47 and name HD1#) 4.5 4.2 3.0 !pk.670 # N.44.H     I.47.QD1  
assign (resid   47 and name HN  ) (resid   47 and name HG1#) 3.5 2.7 1.8 !pk.671 # I.47.H     I.47.HG13 
assign (resid   43 and name HG2#) (resid   44 and name HN  ) 3.5 3.2 2.3 !pk.673 # I.43.QG2   N.44.H    
assign (resid   43 and name HG2#) (resid   47 and name HN  ) 4.5 4.2 3.0 !pk.674 # I.43.QG2   I.47.H    
assign (resid   47 and name HN  ) (resid   50 and name HD1#) 4.5 4.2 3.0 !pk.674 # I.47.H     I.50.QD1  
assign (resid   91 and name HN  ) (resid  104 and name HG1#) 4.5 4.2 3.0 !pk.675 # A.91.H     V.104.QG1 
assign (resid   91 and name HN  ) (resid  113 and name HG2#) 4.5 4.2 3.0 !pk.675 # A.91.H     I.113.QG2 
assign (resid   94 and name HN  ) (resid   95 and name HD2#) 4.5 4.2 3.0 !pk.676 # A.94.H     L.95.QD2  
assign (resid   56 and name HN  ) (resid   59 and name HN  ) 4.5 2.7 1.5 !pk.678   D.56.H     S.59.H    
assign (resid   56 and name HN  ) (resid   60 and name HN  ) 4.5 2.7 1.5 !pk.679   D.56.H     L.60.H    
assign (resid   55 and name HA  ) (resid   56 and name HN  ) 3.5 1.7 0.8 !pk.681   E.55.HA    D.56.H    
assign (resid   56 and name HN  ) (resid   56 and name HB# ) 3.5 2.7 1.8 !pk.683 # D.56.H     D.56.HB2  
assign (resid   85 and name HN  ) (resid   85 and name HB# ) 3.5 2.7 1.8 !pk.685 # Q.85.H     Q.85.HB2  
assign (resid   55 and name HB# ) (resid   56 and name HN  ) 3.5 2.7 1.8 !pk.686 # E.55.HB2   D.56.H    
assign (resid   55 and name HB# ) (resid   56 and name HN  ) 4.5 3.7 2.5 !pk.687 # E.55.HB3   D.56.H    
assign (resid   56 and name HN  ) (resid   60 and name HD1#) 4.5 4.2 3.0 !pk.688 # D.56.H     L.60.QD1  
assign (resid   36 and name HN  ) (resid   37 and name HN  ) 3.5 1.7 0.8 !pk.691   K.36.H     E.37.H    
assign (resid   84 and name HN  ) (resid   85 and name HN  ) 4.5 2.7 1.5 !pk.692   M.84.H     Q.85.H    
assign (resid   37 and name HN  ) (resid   38 and name HN  ) 3.5 1.7 0.8 !pk.693   E.37.H     E.38.H    
assign (resid   85 and name HN  ) (resid   88 and name HB# ) 4.5 3.7 2.5 !pk.697 # Q.85.H     F.88.HB2  
assign (resid   85 and name HN  ) (resid   85 and name HG# ) 3.5 3.2 2.3 !pk.698 # Q.85.H     Q.85.QG   
assign (resid   37 and name HN  ) (resid   37 and name HG# ) 4.5 4.2 3.0 !pk.699 # E.37.H     E.37.HG2  
assign (resid   37 and name HN  ) (resid   37 and name HG# ) 3.5 3.2 2.3 !pk.700 # E.37.H     E.37.HG3  
assign (resid   37 and name HN  ) (resid   37 and name HB# ) 3.5 2.7 1.8 !pk.701 # E.37.H     E.37.HB2  
assign (resid   37 and name HN  ) (resid   37 and name HB# ) 3.5 2.7 1.8 !pk.702 # E.37.H     E.37.HB3  
assign (resid   36 and name HB# ) (resid   37 and name HN  ) 3.5 2.7 1.8 !pk.703 # K.36.HB2   E.37.H    
assign (resid   36 and name HB# ) (resid   37 and name HN  ) 4.5 3.7 2.5 !pk.704 # K.36.HB3   E.37.H    
assign (resid   36 and name HG# ) (resid   37 and name HN  ) 4.5 4.2 3.0 !pk.705 # K.36.HG3   E.37.H    
assign (resid   79 and name HN  ) (resid   80 and name HN  ) 4.5 2.7 1.5 !pk.707   F.79.H     S.80.H    
assign (resid   78 and name HN  ) (resid   79 and name HN  ) 4.5 2.7 1.5 !pk.708   A.78.H     F.79.H    
assign (resid    9 and name HN  ) (resid   79 and name HN  ) 3.5 1.7 0.8 !pk.710   V.9.H      F.79.H    
assign (resid   79 and name HN  ) (resid   79 and name HD# ) 3.5 4.1 3.2 !pk.711 # F.79.H     F.79.QD   
assign (resid   79 and name HN  ) (resid   79 and name HZ  ) 4.5 3.2 2.0 !pk.712 # F.79.H     F.79.HZ   
assign (resid   78 and name HA  ) (resid   79 and name HN  ) 3.5 1.7 0.8 !pk.713   A.78.HA    F.79.H    
assign (resid   79 and name HN  ) (resid   79 and name HB# ) 4.5 3.7 2.5 !pk.717 # F.79.H     F.79.QB   
assign (resid    8 and name HD# ) (resid   79 and name HN  ) 4.5 4.2 3.0 !pk.718 # R.8.QD     F.79.H    
assign (resid   36 and name HE# ) (resid   37 and name HN  ) 4.5 4.2 3.0 !pk.719 # K.36.QE    E.37.H    
assign (resid   83 and name HB# ) (resid   84 and name HN  ) 3.5 2.7 1.8 !pk.720 # Q.83.HB2   M.84.H    
assign (resid   83 and name HB# ) (resid   84 and name HN  ) 4.5 3.7 2.5 !pk.721 # Q.83.HB3   M.84.H    
assign (resid   84 and name HN  ) (resid   84 and name HB# ) 3.5 2.7 1.8 !pk.722 # M.84.H     M.84.HB2  
assign (resid    8 and name HB# ) (resid   79 and name HN  ) 4.5 3.7 2.5 !pk.723 # R.8.QB     F.79.H    
assign (resid   84 and name HN  ) (resid   84 and name HG# ) 4.5 4.2 3.0 !pk.724 # M.84.H     M.84.QG   
assign (resid   78 and name HB# ) (resid   79 and name HN  ) 3.5 3.2 2.3 !pk.725 # A.78.QB    F.79.H    
assign (resid    9 and name HG2#) (resid   79 and name HN  ) 4.5 4.2 3.0 !pk.726 # V.9.QG2    F.79.H    
assign (resid   30 and name HN  ) (resid   31 and name HN  ) 4.5 2.7 1.5 !pk.727   E.30.H     K.31.H    
assign (resid   31 and name HN  ) (resid   32 and name HN  ) 4.5 2.7 1.5 !pk.728   K.31.H     I.32.H    
assign (resid   30 and name HB# ) (resid   31 and name HN  ) 4.5 3.7 2.5 !pk.731 # E.30.HB2   K.31.H    
assign (resid   31 and name HN  ) (resid   31 and name HG# ) 4.5 4.2 3.0 !pk.733 # K.31.H     K.31.HG3  
assign (resid   26 and name HN  ) (resid   28 and name HN  ) 4.5 2.7 1.5 !pk.734   S.26.H     R.28.H    
assign (resid   27 and name HN  ) (resid   28 and name HN  ) 4.5 2.7 1.5 !pk.735   W.27.H     R.28.H    
assign (resid   27 and name HD1 ) (resid   28 and name HN  ) 4.5 3.2 2.0 !pk.736 # W.27.HD1   R.28.H    
assign (resid   26 and name HA  ) (resid   28 and name HN  ) 4.5 2.7 1.5 !pk.737   S.26.HA    R.28.H    
assign (resid   28 and name HN  ) (resid   29 and name HA  ) 4.5 2.7 1.5 !pk.739   R.28.H     Q.29.HA   
assign (resid   27 and name HB# ) (resid   28 and name HN  ) 4.5 3.7 2.5 !pk.741 # W.27.HB3   R.28.H    
assign (resid   22 and name HB# ) (resid   23 and name HN  ) 3.5 2.7 1.8 !pk.742 # R.22.QB    R.23.H    
assign (resid   28 and name HN  ) (resid   29 and name HB# ) 4.5 3.7 2.5 !pk.743 # R.28.H     Q.29.QB   
assign (resid   22 and name HG# ) (resid   23 and name HN  ) 3.5 3.2 2.3 !pk.744 # R.22.QG    R.23.H    
assign (resid   23 and name HN  ) (resid   23 and name HB# ) 3.5 2.7 1.8 !pk.744 # R.23.H     R.23.HB3  
assign (resid   28 and name HN  ) (resid   28 and name HB# ) 3.5 2.7 1.8 !pk.745 # R.28.H     R.28.HB2  
assign (resid   28 and name HN  ) (resid   28 and name HB# ) 4.5 3.7 2.5 !pk.746 # R.28.H     R.28.HB3  
assign (resid   28 and name HN  ) (resid   28 and name HG# ) 3.5 3.2 2.3 !pk.747 # R.28.H     R.28.HG2  
assign (resid   22 and name HN  ) (resid   23 and name HN  ) 3.5 1.7 0.8 !pk.748   R.22.H     R.23.H    
assign (resid   26 and name HB# ) (resid   28 and name HN  ) 4.5 3.7 2.5 !pk.749 # S.26.HB3   R.28.H    
assign (resid   23 and name HN  ) (resid   24 and name HA  ) 4.5 2.7 1.5 !pk.750   R.23.H     P.24.HA   
assign (resid   21 and name HA  ) (resid   23 and name HN  ) 4.5 2.7 1.5 !pk.752   S.21.HA    R.23.H    
assign (resid   26 and name HB# ) (resid   28 and name HN  ) 4.5 3.7 2.5 !pk.753 # S.26.HB2   R.28.H    
assign (resid   21 and name HB# ) (resid   23 and name HN  ) 4.5 3.7 2.5 !pk.754 # S.21.QB    R.23.H    
assign (resid   22 and name HD# ) (resid   23 and name HN  ) 4.5 4.2 3.0 !pk.755 # R.22.HD2   R.23.H    
assign (resid   28 and name HN  ) (resid   28 and name HD# ) 4.5 4.2 3.0 !pk.756 # R.28.H     R.28.HD2  
assign (resid   28 and name HN  ) (resid   28 and name HD# ) 4.5 4.2 3.0 !pk.757 # R.28.H     R.28.HD3  
assign (resid   28 and name HN  ) (resid   28 and name HG# ) 4.5 4.2 3.0 !pk.758 # R.28.H     R.28.HG3  
assign (resid   11 and name HN  ) (resid  116 and name HN  ) 4.5 2.7 1.5 !pk.760   C.11.H     T.116.H   
assign (resid   11 and name HN  ) (resid   79 and name HN  ) 4.5 2.7 1.5 !pk.761   C.11.H     F.79.H    
assign (resid   11 and name HN  ) (resid   76 and name HN  ) 4.5 2.7 1.5 !pk.762   C.11.H     L.76.H    
assign (resid   11 and name HN  ) (resid   11 and name HB# ) 3.5 2.7 1.8 !pk.767 # C.11.H     C.11.HB3  
assign (resid   10 and name HB# ) (resid   11 and name HN  ) 4.5 3.7 2.5 !pk.769 # R.10.HB2   C.11.H    
assign (resid   10 and name HG# ) (resid   11 and name HN  ) 3.5 3.2 2.3 !pk.771 # R.10.HG2   C.11.H    
assign (resid   48 and name HN  ) (resid   50 and name HD1#) 4.5 4.2 3.0 !pk.772 # Q.48.H     I.50.QD1  
assign (resid   11 and name HN  ) (resid   76 and name HD1#) 4.5 4.2 3.0 !pk.773 # C.11.H     L.76.QD1  
assign (resid    9 and name HG2#) (resid   11 and name HN  ) 4.5 4.2 3.0 !pk.774 # V.9.QG2    C.11.H    
assign (resid   48 and name HN  ) (resid   51 and name HN  ) 4.5 2.7 1.5 !pk.775   Q.48.H     K.51.H    
assign (resid   47 and name HN  ) (resid   48 and name HN  ) 3.5 1.7 0.8 !pk.776   I.47.H     Q.48.H    
assign (resid   48 and name HN  ) (resid   49 and name HN  ) 3.5 1.7 0.8 !pk.777   Q.48.H     K.49.H    
assign (resid   44 and name HA  ) (resid   48 and name HN  ) 4.5 2.7 1.5 !pk.778   N.44.HA    Q.48.H    
assign (resid   97 and name HN  ) (resid   97 and name HB  ) 3.5 1.7 0.8 !pk.780   T.97.H     T.97.HB   
assign (resid   45 and name HA# ) (resid   48 and name HN  ) 4.5 3.7 2.5 !pk.781 # G.45.QA    Q.48.H    
assign (resid   97 and name HN  ) (resid  115 and name HD# ) 4.5 4.2 3.0 !pk.783 # T.97.H     R.115.HD2 
assign (resid   48 and name HN  ) (resid   48 and name HG# ) 3.5 3.2 2.3 !pk.784 # Q.48.H     Q.48.QG   
assign (resid   48 and name HN  ) (resid   48 and name HB# ) 3.5 2.7 1.8 !pk.785 # Q.48.H     Q.48.HB2  
assign (resid   47 and name HB  ) (resid   48 and name HN  ) 3.5 1.7 0.8 !pk.786   I.47.HB    Q.48.H    
assign (resid   96 and name HB# ) (resid   97 and name HN  ) 3.5 2.7 1.8 !pk.787 # R.96.HB2   T.97.H    
assign (resid   48 and name HN  ) (resid   49 and name HG# ) 4.5 4.2 3.0 !pk.788 # Q.48.H     K.49.HG2  
assign (resid   48 and name HN  ) (resid   51 and name HG# ) 4.5 4.2 3.0 !pk.788 # Q.48.H     K.51.HG2  
assign (resid   96 and name HB# ) (resid   97 and name HN  ) 4.5 3.7 2.5 !pk.789 # R.96.HB3   T.97.H    
assign (resid   47 and name HG2#) (resid   48 and name HN  ) 3.5 3.2 2.3 !pk.790 # I.47.QG2   Q.48.H    
assign (resid   97 and name HN  ) (resid  115 and name HH1#) 4.5 4.2 3.0 !pk.791 # T.97.H     R.115.QH1 
assign (resid   96 and name HA  ) (resid   97 and name HN  ) 3.5 1.7 0.8 !pk.792   R.96.HA    T.97.H    
assign (resid   96 and name HG# ) (resid   97 and name HN  ) 3.5 3.2 2.3 !pk.794 # R.96.QG    T.97.H    
assign (resid   97 and name HN  ) (resid   97 and name HG2#) 4.5 4.2 3.0 !pk.795 # T.97.H     T.97.QG2  
assign (resid   88 and name HN  ) (resid   90 and name HN  ) 4.5 2.7 1.5 !pk.796   F.88.H     D.90.H    
assign (resid   58 and name HN  ) (resid   60 and name HN  ) 4.5 2.7 1.5 !pk.800   E.58.H     L.60.H    
assign (resid   57 and name HD# ) (resid   58 and name HN  ) 4.5 5.1 3.9 !pk.802 # F.57.QD    E.58.H    
assign (resid   85 and name HA  ) (resid   88 and name HN  ) 4.5 2.7 1.5 !pk.806   Q.85.HA    F.88.H    
assign (resid   86 and name HA  ) (resid   88 and name HN  ) 4.5 2.7 1.5 !pk.806   K.86.HA    F.88.H    
assign (resid   87 and name HD# ) (resid   88 and name HN  ) 4.5 3.7 2.5 !pk.807 # P.87.HD2   F.88.H    
assign (resid   32 and name HA  ) (resid   33 and name HN  ) 3.5 1.7 0.8 !pk.809   I.32.HA    T.33.H    
assign (resid   87 and name HD# ) (resid   88 and name HN  ) 3.5 2.7 1.8 !pk.810 # P.87.HD3   F.88.H    
assign (resid   88 and name HN  ) (resid   88 and name HB# ) 3.5 2.7 1.8 !pk.812 # F.88.H     F.88.HB2  
assign (resid   57 and name HB# ) (resid   58 and name HN  ) 3.5 2.7 1.8 !pk.813 # F.57.HB2   E.58.H    
assign (resid   58 and name HN  ) (resid   58 and name HG# ) 3.5 3.2 2.3 !pk.814 # E.58.H     E.58.QG   
assign (resid   88 and name HN  ) (resid   88 and name HB# ) 3.5 2.7 1.8 !pk.815 # F.88.H     F.88.HB3  
assign (resid   87 and name HG# ) (resid   88 and name HN  ) 4.5 3.7 2.5 !pk.816 # P.87.HG2   F.88.H    
assign (resid   58 and name HN  ) (resid   58 and name HB# ) 3.5 2.7 1.8 !pk.817 # E.58.H     E.58.HB2  
assign (resid   58 and name HN  ) (resid   58 and name HB# ) 3.5 2.7 1.8 !pk.818 # E.58.H     E.58.HB3  
assign (resid   33 and name HN  ) (resid   34 and name HB# ) 4.5 3.7 2.5 !pk.819 # T.33.H     R.34.HB2  
assign (resid   85 and name HB# ) (resid   88 and name HN  ) 4.5 3.7 2.5 !pk.820 # Q.85.HB3   F.88.H    
assign (resid   87 and name HB# ) (resid   88 and name HN  ) 4.5 3.7 2.5 !pk.821 # P.87.HB3   F.88.H    
assign (resid   33 and name HN  ) (resid   34 and name HG# ) 4.5 4.2 3.0 !pk.822 # T.33.H     R.34.HG2  
assign (resid   88 and name HN  ) (resid  106 and name HG2#) 4.5 4.2 3.0 !pk.823 # F.88.H     T.106.QG2 
assign (resid   33 and name HN  ) (resid   33 and name HG2#) 4.5 4.2 3.0 !pk.825 # T.33.H     T.33.QG2  
assign (resid   58 and name HN  ) (resid   61 and name HB# ) 4.5 4.2 3.0 !pk.826 # E.58.H     A.61.QB   
assign (resid   88 and name HN  ) (resid  104 and name HG1#) 4.5 4.2 3.0 !pk.827 # F.88.H     V.104.QG1 
assign (resid   32 and name HG2#) (resid   33 and name HN  ) 4.5 4.2 3.0 !pk.828 # I.32.QG2   T.33.H    
assign (resid   12 and name HN  ) (resid   13 and name HN  ) 4.5 2.7 1.5 !pk.829   S.12.H     H.13.H    
assign (resid   12 and name HN  ) (resid  116 and name HN  ) 4.5 2.7 1.5 !pk.830   S.12.H     T.116.H   
assign (resid   12 and name HN  ) (resid  114 and name HN  ) 4.5 2.7 1.5 !pk.831   S.12.H     L.114.H   
assign (resid   11 and name HN  ) (resid   12 and name HN  ) 4.5 2.7 1.5 !pk.832   C.11.H     S.12.H    
assign (resid   11 and name HA  ) (resid   12 and name HN  ) 3.5 1.7 0.8 !pk.834   C.11.HA    S.12.H    
assign (resid   12 and name HN  ) (resid  115 and name HA  ) 4.5 2.7 1.5 !pk.835   S.12.H     R.115.HA  
assign (resid   12 and name HN  ) (resid   12 and name HB# ) 4.5 3.7 2.5 !pk.836 # S.12.H     S.12.HB2  
assign (resid   12 and name HN  ) (resid   12 and name HB# ) 3.5 2.7 1.8 !pk.837 # S.12.H     S.12.HB3  
assign (resid   11 and name HB# ) (resid   12 and name HN  ) 3.5 2.7 1.8 !pk.838 # C.11.HB2   S.12.H    
assign (resid   11 and name HB# ) (resid   12 and name HN  ) 4.5 3.7 2.5 !pk.839 # C.11.HB3   S.12.H    
assign (resid   12 and name HN  ) (resid  116 and name HG2#) 4.5 4.2 3.0 !pk.840 # S.12.H     T.116.QG2 
assign (resid   12 and name HN  ) (resid  114 and name HB# ) 4.5 3.7 2.5 !pk.841 # S.12.H     L.114.HB2 
assign (resid   12 and name HN  ) (resid   76 and name HD1#) 4.5 4.2 3.0 !pk.842 # S.12.H     L.76.QD1  
assign (resid   12 and name HN  ) (resid  114 and name HD2#) 4.5 4.2 3.0 !pk.842 # S.12.H     L.114.QD2 
assign (resid   58 and name HN  ) (resid  114 and name HD2#) 4.5 4.2 3.0 !pk.843 # E.58.H     L.114.QD2 
assign (resid   12 and name HN  ) (resid  114 and name HB# ) 4.5 3.7 2.5 !pk.844 # S.12.H     L.114.HB3 
assign (resid   59 and name HN  ) (resid   61 and name HB# ) 4.5 4.2 3.0 !pk.845 # S.59.H     A.61.QB   
assign (resid   58 and name HN  ) (resid   59 and name HN  ) 3.5 1.7 0.8 !pk.846   E.58.H     S.59.H    
assign (resid   59 and name HN  ) (resid   61 and name HN  ) 4.5 2.7 1.5 !pk.847   S.59.H     A.61.H    
assign (resid   59 and name HN  ) (resid   60 and name HN  ) 3.5 1.7 0.8 !pk.849   S.59.H     L.60.H    
assign (resid   97 and name HB  ) (resid   98 and name HN  ) 4.5 2.7 1.5 !pk.852   T.97.HB    G.98.H    
assign (resid   62 and name HB# ) (resid   73 and name HN  ) 4.5 3.7 2.5 !pk.853 # S.62.HB3   R.73.H    
assign (resid   57 and name HB# ) (resid   59 and name HN  ) 4.5 3.7 2.5 !pk.854 # F.57.HB2   S.59.H    
assign (resid   56 and name HB# ) (resid   59 and name HN  ) 4.5 3.7 2.5 !pk.855 # D.56.HB2   S.59.H    
assign (resid   58 and name HG# ) (resid   59 and name HN  ) 4.5 4.2 3.0 !pk.856 # E.58.QG    S.59.H    
assign (resid   98 and name HN  ) (resid   99 and name HB# ) 4.5 3.7 2.5 !pk.857 # G.98.H     E.99.HB2  
assign (resid   58 and name HB# ) (resid   59 and name HN  ) 3.5 2.7 1.8 !pk.858 # E.58.HB2   S.59.H    
assign (resid   98 and name HN  ) (resid  115 and name HB# ) 4.5 3.7 2.5 !pk.859 # G.98.H     R.115.HB2 
assign (resid   58 and name HB# ) (resid   59 and name HN  ) 3.5 2.7 1.8 !pk.860 # E.58.HB3   S.59.H    
assign (resid   98 and name HN  ) (resid   99 and name HB# ) 4.5 3.7 2.5 !pk.861 # G.98.H     E.99.HB3  
assign (resid   98 and name HN  ) (resid  115 and name HB# ) 4.5 3.7 2.5 !pk.861 # G.98.H     R.115.HB3 
assign (resid   59 and name HN  ) (resid   60 and name HB# ) 4.5 3.7 2.5 !pk.862 # S.59.H     L.60.HB2  
assign (resid   59 and name HN  ) (resid   73 and name HG# ) 4.5 4.2 3.0 !pk.862 # S.59.H     R.73.QG   
assign (resid   98 and name HN  ) (resid  115 and name HG# ) 4.5 4.2 3.0 !pk.863 # G.98.H     R.115.HG3 
assign (resid   59 and name HN  ) (resid   60 and name HD2#) 4.5 4.2 3.0 !pk.864 # S.59.H     L.60.QD2  
assign (resid   98 and name HN  ) (resid  114 and name HD1#) 4.5 4.2 3.0 !pk.865 # G.98.H     L.114.QD1 
assign (resid   72 and name HN  ) (resid   73 and name HN  ) 3.5 1.7 0.8 !pk.868   A.72.H     R.73.H    
assign (resid   71 and name HN  ) (resid   73 and name HN  ) 4.5 2.7 1.5 !pk.869   K.71.H     R.73.H    
assign (resid   62 and name HA  ) (resid   73 and name HN  ) 4.5 2.7 1.5 !pk.870   S.62.HA    R.73.H    
assign (resid   98 and name HN  ) (resid  116 and name HA  ) 4.5 2.7 1.5 !pk.871   G.98.H     T.116.HA  
assign (resid   71 and name HA  ) (resid   73 and name HN  ) 4.5 2.7 1.5 !pk.873   K.71.HA    R.73.H    
assign (resid   73 and name HN  ) (resid   73 and name HA  ) 3.5 1.7 0.8 !pk.874   R.73.H     R.73.HA   
assign (resid   97 and name HA  ) (resid   98 and name HN  ) 3.5 1.7 0.8 !pk.876   T.97.HA    G.98.H    
assign (resid   73 and name HN  ) (resid   73 and name HD# ) 4.5 4.2 3.0 !pk.877 # R.73.H     R.73.HD3  
assign (resid   98 and name HN  ) (resid  115 and name HD# ) 4.5 4.2 3.0 !pk.878 # G.98.H     R.115.HD3 
assign (resid   73 and name HN  ) (resid   73 and name HB# ) 4.5 3.7 2.5 !pk.879 # R.73.H     R.73.HB3  
assign (resid   73 and name HN  ) (resid   73 and name HB# ) 4.5 3.7 2.5 !pk.880 # R.73.H     R.73.HB2  
assign (resid   70 and name HB# ) (resid   73 and name HN  ) 4.5 4.2 3.0 !pk.881 # A.70.QB    R.73.H    
assign (resid   71 and name HB# ) (resid   73 and name HN  ) 4.5 3.7 2.5 !pk.881 # K.71.QB    R.73.H    
assign (resid   98 and name HN  ) (resid  115 and name HG# ) 4.5 4.2 3.0 !pk.882 # G.98.H     R.115.HG2 
assign (resid   72 and name HB# ) (resid   73 and name HN  ) 4.5 4.2 3.0 !pk.883 # A.72.QB    R.73.H    
assign (resid   73 and name HN  ) (resid   73 and name HG# ) 4.5 4.2 3.0 !pk.883 # R.73.H     R.73.QG   
assign (resid   61 and name HB# ) (resid   73 and name HN  ) 4.5 4.2 3.0 !pk.884 # A.61.QB    R.73.H    
assign (resid    7 and name HN  ) (resid    8 and name HN  ) 3.5 1.7 0.8 !pk.886   A.7.H      R.8.H     
assign (resid    8 and name HN  ) (resid   93 and name HE# ) 4.5 5.1 3.9 !pk.887 # R.8.H      F.93.QE   
assign (resid    6 and name HA  ) (resid    8 and name HN  ) 4.5 2.7 1.5 !pk.889   P.6.HA     R.8.H     
assign (resid    7 and name HA  ) (resid    8 and name HN  ) 3.5 1.7 0.8 !pk.890   A.7.HA     R.8.H     
assign (resid    6 and name HB# ) (resid    8 and name HN  ) 4.5 3.7 2.5 !pk.891 # P.6.HB2    R.8.H     
assign (resid    6 and name HB# ) (resid    8 and name HN  ) 3.5 2.7 1.8 !pk.892 # P.6.HB3    R.8.H     
assign (resid    7 and name HB# ) (resid    8 and name HN  ) 3.5 3.2 2.3 !pk.893 # A.7.QB     R.8.H     
assign (resid    8 and name HN  ) (resid    8 and name HB# ) 3.5 2.7 1.8 !pk.893 # R.8.H      R.8.QB    
assign (resid    8 and name HN  ) (resid    9 and name HG1#) 4.5 4.2 3.0 !pk.894 # R.8.H      V.9.QG1   
assign (resid   61 and name HA  ) (resid   63 and name HN  ) 4.5 2.7 1.5 !pk.900   A.61.HA    Q.63.H    
assign (resid   63 and name HN  ) (resid   63 and name HB# ) 3.5 2.7 1.8 !pk.903 # Q.63.H     Q.63.HB2  
assign (resid   63 and name HN  ) (resid   63 and name HB# ) 4.5 3.7 2.5 !pk.904 # Q.63.H     Q.63.HB3  
assign (resid   93 and name HN  ) (resid   93 and name HD# ) 3.5 4.1 3.2 !pk.906 # F.93.H     F.93.QD   
assign (resid   91 and name HN  ) (resid   93 and name HN  ) 4.5 2.7 1.5 !pk.907   A.91.H     F.93.H    
assign (resid   90 and name HA  ) (resid   93 and name HN  ) 4.5 2.7 1.5 !pk.909   D.90.HA    F.93.H    
assign (resid   92 and name HB# ) (resid   93 and name HN  ) 4.5 3.7 2.5 !pk.912 # S.92.HB3   F.93.H    
assign (resid   93 and name HN  ) (resid   93 and name HB# ) 3.5 2.7 1.8 !pk.913 # F.93.H     F.93.HB2  
assign (resid   93 and name HN  ) (resid   93 and name HB# ) 3.5 2.7 1.8 !pk.914 # F.93.H     F.93.HB3  
assign (resid   93 and name HN  ) (resid   94 and name HB# ) 4.5 4.2 3.0 !pk.915 # F.93.H     A.94.QB   
assign (resid    9 and name HG2#) (resid   93 and name HN  ) 4.5 4.2 3.0 !pk.916 # V.9.QG2    F.93.H    
assign (resid  111 and name HN  ) (resid  112 and name HN  ) 4.5 2.7 1.5 !pk.917   H.111.H    I.112.H   
assign (resid   14 and name HN  ) (resid  112 and name HN  ) 4.5 2.7 1.5 !pk.918   L.14.H     I.112.H   
assign (resid  111 and name HA  ) (resid  112 and name HN  ) 3.5 1.7 0.8 !pk.919   H.111.HA   I.112.H   
assign (resid   13 and name HB# ) (resid  112 and name HN  ) 4.5 3.7 2.5 !pk.921 # H.13.HB2   I.112.H   
assign (resid  111 and name HB# ) (resid  112 and name HN  ) 3.5 2.7 1.8 !pk.922 # H.111.HB2  I.112.H   
assign (resid  111 and name HB# ) (resid  112 and name HN  ) 4.5 3.7 2.5 !pk.923 # H.111.HB3  I.112.H   
assign (resid   14 and name HB# ) (resid  112 and name HN  ) 4.5 3.7 2.5 !pk.925 # L.14.HB2   I.112.H   
assign (resid  112 and name HN  ) (resid  112 and name HG1#) 3.5 2.7 1.8 !pk.926 # I.112.H    I.112.HG13
assign (resid   43 and name HD1#) (resid  112 and name HN  ) 4.5 4.2 3.0 !pk.927 # I.43.QD1   I.112.H   
assign (resid   50 and name HG1#) (resid   55 and name HN  ) 4.5 3.7 2.5 !pk.929 # I.50.HG12  E.55.H    
assign (resid   55 and name HN  ) (resid   56 and name HN  ) 4.5 2.7 1.5 !pk.930   E.55.H     D.56.H    
assign (resid   54 and name HN  ) (resid   55 and name HN  ) 3.5 1.7 0.8 !pk.931   E.54.H     E.55.H    
assign (resid   70 and name HN  ) (resid   71 and name HN  ) 3.5 1.7 0.8 !pk.932   A.70.H     K.71.H    
assign (resid   53 and name HN  ) (resid   55 and name HN  ) 4.5 2.7 1.5 !pk.933   G.53.H     E.55.H    
assign (resid   69 and name HA  ) (resid   71 and name HN  ) 4.5 2.7 1.5 !pk.936   S.69.HA    K.71.H    
assign (resid   50 and name HA  ) (resid   55 and name HN  ) 3.5 1.7 0.8 !pk.937   I.50.HA    E.55.H    
assign (resid   55 and name HN  ) (resid   55 and name HG# ) 4.5 4.2 3.0 !pk.940 # E.55.H     E.55.QG   
assign (resid   54 and name HB# ) (resid   55 and name HN  ) 3.5 2.7 1.8 !pk.941 # E.54.QB    E.55.H    
assign (resid   70 and name HB# ) (resid   71 and name HN  ) 3.5 3.2 2.3 !pk.942 # A.70.QB    K.71.H    
assign (resid   71 and name HN  ) (resid   71 and name HB# ) 3.5 2.7 1.8 !pk.942 # K.71.H     K.71.QB   
assign (resid   49 and name HB# ) (resid   55 and name HN  ) 4.5 3.7 2.5 !pk.943 # K.49.HB3   E.55.H    
assign (resid   71 and name HN  ) (resid   72 and name HB# ) 4.5 4.2 3.0 !pk.944 # K.71.H     A.72.QB   
assign (resid   55 and name HN  ) (resid   55 and name HB# ) 3.5 2.7 1.8 !pk.945 # E.55.H     E.55.HB3  
assign (resid   71 and name HN  ) (resid   71 and name HG# ) 3.5 3.2 2.3 !pk.946 # K.71.H     K.71.HG2  
assign (resid   50 and name HG2#) (resid   55 and name HN  ) 4.5 4.2 3.0 !pk.947 # I.50.QG2   E.55.H    
assign (resid   17 and name HN  ) (resid   18 and name HN  ) 4.5 2.7 1.5 !pk.948   K.17.H     H.18.H    
assign (resid   18 and name HN  ) (resid   20 and name HN  ) 4.5 2.7 1.5 !pk.948   H.18.H     Q.20.H    
assign (resid   19 and name HN  ) (resid   20 and name HN  ) 4.5 2.7 1.5 !pk.949   S.19.H     Q.20.H    
assign (resid   19 and name HN  ) (resid   36 and name HN  ) 4.5 2.7 1.5 !pk.951   S.19.H     K.36.H    
assign (resid   18 and name HN  ) (resid   19 and name HN  ) 4.5 2.7 1.5 !pk.952   H.18.H     S.19.H    
assign (resid   19 and name HN  ) (resid   34 and name HN  ) 4.5 2.7 1.5 !pk.954   S.19.H     R.34.H    
assign (resid   79 and name HD# ) (resid   80 and name HN  ) 4.5 5.1 3.9 !pk.955 # F.79.QD    S.80.H    
assign (resid   79 and name HA  ) (resid   80 and name HN  ) 3.5 1.7 0.8 !pk.957   F.79.HA    S.80.H    
assign (resid   17 and name HA  ) (resid   18 and name HN  ) 3.5 1.7 0.8 !pk.959   K.17.HA    H.18.H    
assign (resid   19 and name HN  ) (resid   19 and name HB# ) 3.5 2.7 1.8 !pk.960 # S.19.H     S.19.HB2  
assign (resid   80 and name HN  ) (resid   80 and name HB# ) 3.5 2.7 1.8 !pk.961 # S.80.H     S.80.HB3  
assign (resid   18 and name HN  ) (resid   21 and name HA  ) 4.5 2.7 1.5 !pk.962   H.18.H     S.21.HA   
assign (resid   19 and name HN  ) (resid   19 and name HB# ) 3.5 2.7 1.8 !pk.963 # S.19.H     S.19.HB3  
assign (resid   18 and name HN  ) (resid   21 and name HB# ) 4.5 3.7 2.5 !pk.964 # H.18.H     S.21.QB   
assign (resid   19 and name HN  ) (resid   36 and name HA  ) 4.5 2.7 1.5 !pk.965   S.19.H     K.36.HA   
assign (resid   79 and name HB# ) (resid   80 and name HN  ) 3.5 2.7 1.8 !pk.966 # F.79.QB    S.80.H    
assign (resid   18 and name HB# ) (resid   19 and name HN  ) 3.5 2.7 1.8 !pk.967 # H.18.HB2   S.19.H    
assign (resid   18 and name HB# ) (resid   19 and name HN  ) 3.5 2.7 1.8 !pk.968 # H.18.HB3   S.19.H    
assign (resid   80 and name HN  ) (resid   83 and name HB# ) 4.5 3.7 2.5 !pk.970 # S.80.H     Q.83.HB2  
assign (resid   80 and name HN  ) (resid   83 and name HG# ) 4.5 4.2 3.0 !pk.970 # S.80.H     Q.83.HG3  
assign (resid   80 and name HN  ) (resid   83 and name HB# ) 4.5 3.7 2.5 !pk.971 # S.80.H     Q.83.HB3  
assign (resid   17 and name HB# ) (resid   18 and name HN  ) 3.5 2.7 1.8 !pk.972 # K.17.QB    H.18.H    
assign (resid   19 and name HN  ) (resid   34 and name HG# ) 4.5 4.2 3.0 !pk.973 # S.19.H     R.34.HG2  
assign (resid   17 and name HD# ) (resid   18 and name HN  ) 4.5 4.2 3.0 !pk.974 # K.17.HD3   H.18.H    
assign (resid   19 and name HN  ) (resid   39 and name HB# ) 4.5 4.2 3.0 !pk.975 # S.19.H     A.39.QB   
assign (resid    8 and name HG# ) (resid   80 and name HN  ) 4.5 4.2 3.0 !pk.976 # R.8.QG     S.80.H    
assign (resid   17 and name HG# ) (resid   18 and name HN  ) 4.5 4.2 3.0 !pk.977 # K.17.QG    H.18.H    
assign (resid   19 and name HN  ) (resid   32 and name HG2#) 4.5 4.2 3.0 !pk.979 # S.19.H     I.32.QG2  
assign (resid   92 and name HN  ) (resid   93 and name HN  ) 3.5 1.7 0.8 !pk.981   S.92.H     F.93.H    
assign (resid   92 and name HN  ) (resid   93 and name HD# ) 4.5 5.1 3.9 !pk.982 # S.92.H     F.93.QD   
assign (resid   91 and name HN  ) (resid   92 and name HN  ) 3.5 1.7 0.8 !pk.983   A.91.H     S.92.H    
assign (resid    9 and name HN  ) (resid   78 and name HA  ) 4.5 2.7 1.5 !pk.985   V.9.H      A.78.HA   
assign (resid    8 and name HA  ) (resid    9 and name HN  ) 3.5 1.7 0.8 !pk.986   R.8.HA     V.9.H     
assign (resid   89 and name HA  ) (resid   92 and name HN  ) 3.5 1.7 0.8 !pk.988   E.89.HA    S.92.H    
assign (resid   92 and name HN  ) (resid   92 and name HB# ) 3.5 2.7 1.8 !pk.989 # S.92.H     S.92.HB2  
assign (resid   92 and name HN  ) (resid   92 and name HB# ) 3.5 2.7 1.8 !pk.990 # S.92.H     S.92.HB3  
assign (resid   92 and name HN  ) (resid   92 and name HG  ) 3.5 1.7 0.8 !pk.991   S.92.H     S.92.HG   
assign (resid   89 and name HB# ) (resid   92 and name HN  ) 4.5 3.7 2.5 !pk.992 # E.89.QB    S.92.H    
assign (resid    8 and name HB# ) (resid    9 and name HN  ) 3.5 2.7 1.8 !pk.993 # R.8.QB     V.9.H     
assign (resid   91 and name HB# ) (resid   92 and name HN  ) 3.5 3.2 2.3 !pk.994 # A.91.QB    S.92.H    
assign (resid    9 and name HN  ) (resid   78 and name HB# ) 4.5 4.2 3.0 !pk.995 # V.9.H      A.78.QB   
assign (resid   92 and name HN  ) (resid  113 and name HG2#) 4.5 4.2 3.0 !pk.996 # S.92.H     I.113.QG2 
assign (resid    9 and name HN  ) (resid    9 and name HG1#) 4.5 4.2 3.0 !pk.997 # V.9.H      V.9.QG1   
assign (resid   92 and name HN  ) (resid  113 and name HD1#) 4.5 4.2 3.0 !pk.998 # S.92.H     I.113.QD1 
assign (resid    9 and name HN  ) (resid    9 and name HG2#) 3.5 3.2 2.3 !pk.999 # V.9.H      V.9.QG2   
assign (resid   35 and name HN  ) (resid   36 and name HN  ) 4.5 2.7 1.5 !pk.1000   T.35.H     K.36.H    
assign (resid   34 and name HA  ) (resid   35 and name HN  ) 3.5 1.7 0.8 !pk.1004   R.34.HA    T.35.H    
assign (resid   35 and name HN  ) (resid   38 and name HA  ) 4.5 2.7 1.5 !pk.1005   T.35.H     E.38.HA   
assign (resid   35 and name HN  ) (resid   38 and name HB# ) 3.5 2.7 1.8 !pk.1006 # T.35.H     E.38.HB2  
assign (resid   35 and name HN  ) (resid   38 and name HG# ) 4.5 4.2 3.0 !pk.1007 # T.35.H     E.38.HG3  
assign (resid   34 and name HB# ) (resid   35 and name HN  ) 4.5 3.7 2.5 !pk.1008 # R.34.HB3   T.35.H    
assign (resid   34 and name HG# ) (resid   35 and name HN  ) 4.5 4.2 3.0 !pk.1009 # R.34.HG2   T.35.H    
assign (resid   35 and name HN  ) (resid   35 and name HG2#) 3.5 3.2 2.3 !pk.1010 # T.35.H     T.35.QG2  
assign (resid   61 and name HA  ) (resid   64 and name HN  ) 4.5 2.7 1.5 !pk.1011   A.61.HA    F.64.H    
assign (resid   64 and name HN  ) (resid   65 and name HN  ) 3.5 1.7 0.8 !pk.1012   F.64.H     S.65.H    
assign (resid   64 and name HN  ) (resid   64 and name HE# ) 4.5 5.1 3.9 !pk.1013 # F.64.H     F.64.QE   
assign (resid   63 and name HN  ) (resid   64 and name HN  ) 3.5 1.7 0.8 !pk.1014   Q.63.H     F.64.H    
assign (resid   64 and name HN  ) (resid   65 and name HB# ) 4.5 3.7 2.5 !pk.1015 # F.64.H     S.65.HB2  
assign (resid   60 and name HA  ) (resid   64 and name HN  ) 4.5 2.7 1.5 !pk.1016   L.60.HA    F.64.H    
assign (resid   64 and name HN  ) (resid   64 and name HB# ) 3.5 2.7 1.8 !pk.1017 # F.64.H     F.64.HB2  
assign (resid   64 and name HN  ) (resid   64 and name HB# ) 3.5 2.7 1.8 !pk.1018 # F.64.H     F.64.HB3  
assign (resid   63 and name HB# ) (resid   64 and name HN  ) 3.5 2.7 1.8 !pk.1019 # Q.63.HB2   F.64.H    
assign (resid   63 and name HB# ) (resid   64 and name HN  ) 4.5 3.7 2.5 !pk.1020 # Q.63.HB3   F.64.H    
assign (resid   81 and name HN  ) (resid   82 and name HN  ) 4.5 2.7 1.5 !pk.1022   R.81.H     G.82.H    
assign (resid   81 and name HD# ) (resid   82 and name HN  ) 4.5 4.2 3.0 !pk.1026 # R.81.QD    G.82.H    
assign (resid   82 and name HN  ) (resid   83 and name HB# ) 4.5 3.7 2.5 !pk.1027 # G.82.H     Q.83.HB2  
assign (resid   81 and name HG# ) (resid   82 and name HN  ) 4.5 4.2 3.0 !pk.1028 # R.81.HG2   G.82.H    
assign (resid   81 and name HG# ) (resid   82 and name HN  ) 4.5 4.2 3.0 !pk.1029 # R.81.HG3   G.82.H    
assign (resid   82 and name HN  ) (resid   84 and name HN  ) 4.5 2.7 1.5 !pk.1030   G.82.H     M.84.H    
assign (resid   20 and name HG# ) (resid   20 and name HE2#) 4.5 5.7 4.5 !pk.1034 # Q.20.QG    Q.20.HE21 
assign (resid   81 and name HB# ) (resid   82 and name HN  ) 4.5 3.7 2.5 !pk.1035 # R.81.HB3   G.82.H    
assign (resid   79 and name HB# ) (resid   83 and name HE2#) 4.5 5.2 4.0 !pk.1038 # F.79.QB    Q.83.HE21 
assign (resid   85 and name HG# ) (resid   85 and name HE2#) 3.5 4.7 3.8 !pk.1039 # Q.85.QG    Q.85.HE21 
assign (resid   85 and name HB# ) (resid   85 and name HE2#) 4.5 5.2 4.0 !pk.1041 # Q.85.HB2   Q.85.HE21 
assign (resid   20 and name HE2#) (resid   36 and name HD# ) 4.5 5.7 4.5 !pk.1042 # Q.20.HE22  K.36.QD   
assign (resid   85 and name HE2#) (resid  106 and name HG2#) 4.5 5.7 4.5 !pk.1043 # Q.85.HE21  T.106.QG2 
assign (resid   80 and name HN  ) (resid   83 and name HE2#) 4.5 4.2 3.0 !pk.1044 # S.80.H     Q.83.HE21 
assign (resid   79 and name HB# ) (resid   83 and name HE2#) 4.5 5.2 4.0 !pk.1048 # F.79.QB    Q.83.HE22 
assign (resid   83 and name HG# ) (resid   83 and name HE2#) 3.5 4.7 3.8 !pk.1049 # Q.83.HG3   Q.83.HE21 
assign (resid   83 and name HG# ) (resid   83 and name HE2#) 4.5 5.7 4.5 !pk.1050 # Q.83.HG3   Q.83.HE22 
assign (resid   83 and name HB# ) (resid   83 and name HE2#) 4.5 5.2 4.0 !pk.1051 # Q.83.HB3   Q.83.HE21 
assign (resid   48 and name HE2#) (resid   51 and name HD# ) 4.5 5.7 4.5 !pk.1052 # Q.48.HE22  K.51.QD   
assign (resid   83 and name HE2#) (resid   84 and name HE# ) 4.5 5.7 4.5 !pk.1053 # Q.83.HE21  M.84.QE   
assign (resid   48 and name HE2#) (resid   52 and name HB# ) 4.5 5.2 4.0 !pk.1055 # Q.48.HE21  S.52.HB3  
assign (resid   48 and name HE2#) (resid   52 and name HB# ) 4.5 5.2 4.0 !pk.1056 # Q.48.HE22  S.52.HB3  
assign (resid   48 and name HG# ) (resid   48 and name HE2#) 4.5 5.7 4.5 !pk.1057 # Q.48.QG    Q.48.HE21 
assign (resid   83 and name HE2#) (resid   84 and name HE# ) 4.5 5.7 4.5 !pk.1059 # Q.83.HE22  M.84.QE   
assign (resid   47 and name HG2#) (resid   48 and name HE2#) 4.5 5.7 4.5 !pk.1060 # I.47.QG2   Q.48.HE21 
assign (resid   51 and name HN  ) (resid   52 and name HN  ) 3.5 1.7 0.8 !pk.1061   K.51.H     S.52.H    
assign (resid   52 and name HN  ) (resid   52 and name HB# ) 3.5 2.7 1.8 !pk.1064 # S.52.H     S.52.HB3  
assign (resid   51 and name HB# ) (resid   52 and name HN  ) 3.5 2.7 1.8 !pk.1065 # K.51.HB3   S.52.H    
assign (resid   51 and name HG# ) (resid   52 and name HN  ) 4.5 4.2 3.0 !pk.1066 # K.51.HG2   S.52.H    
assign (resid   63 and name HN  ) (resid   65 and name HN  ) 4.5 2.7 1.5 !pk.1069   Q.63.H     S.65.H    
assign (resid   63 and name HA  ) (resid   63 and name HE2#) 4.5 4.2 3.0 !pk.1072 # Q.63.HA    Q.63.HE22 
assign (resid   60 and name HA  ) (resid   63 and name HE2#) 4.5 4.2 3.0 !pk.1073 # L.60.HA    Q.63.HE21 
assign (resid   60 and name HA  ) (resid   63 and name HE2#) 4.5 4.2 3.0 !pk.1074 # L.60.HA    Q.63.HE22 
assign (resid   63 and name HG# ) (resid   63 and name HE2#) 4.5 5.7 4.5 !pk.1075 # Q.63.HG2   Q.63.HE21 
assign (resid   29 and name HG# ) (resid   29 and name HE2#) 3.5 4.7 3.8 !pk.1076 # Q.29.QG    Q.29.HE21 
assign (resid   29 and name HG# ) (resid   29 and name HE2#) 3.5 4.7 3.8 !pk.1077 # Q.29.QG    Q.29.HE22 
assign (resid   29 and name HB# ) (resid   29 and name HE2#) 4.5 5.2 4.0 !pk.1078 # Q.29.QB    Q.29.HE21 
assign (resid   29 and name HB# ) (resid   29 and name HE2#) 4.5 5.2 4.0 !pk.1079 # Q.29.QB    Q.29.HE22 
assign (resid   63 and name HG# ) (resid   63 and name HE2#) 4.5 5.7 4.5 !pk.1081 # Q.63.HG3   Q.63.HE22 
assign (resid   14 and name HG  ) (resid   65 and name HN  ) 4.5 2.7 1.5 !pk.1082   L.14.HG    S.65.H    
assign (resid   63 and name HB# ) (resid   63 and name HE2#) 4.5 5.2 4.0 !pk.1083 # Q.63.HB2   Q.63.HE21 
assign (resid   60 and name HD2#) (resid   63 and name HE2#) 4.5 5.7 4.5 !pk.1085 # L.60.QD2   Q.63.HE22 
assign (resid   27 and name HZ2 ) (resid   65 and name HN  ) 4.5 3.2 2.0 !pk.1088 # W.27.HZ2   S.65.H    
assign (resid   65 and name HN  ) (resid   65 and name HG  ) 4.5 2.7 1.5 !pk.1088   S.65.H     S.65.HG   
assign (resid   65 and name HN  ) (resid   65 and name HB# ) 3.5 2.7 1.8 !pk.1089 # S.65.H     S.65.HB2  
assign (resid   61 and name HA  ) (resid   65 and name HN  ) 4.5 2.7 1.5 !pk.1090   A.61.HA    S.65.H    
assign (resid   64 and name HB# ) (resid   65 and name HN  ) 4.5 3.7 2.5 !pk.1091 # F.64.HB2   S.65.H    
assign (resid   64 and name HB# ) (resid   65 and name HN  ) 4.5 3.7 2.5 !pk.1092 # F.64.HB3   S.65.H    
assign (resid   63 and name HG# ) (resid   63 and name HE2#) 3.5 4.7 3.8 !pk.1093 # Q.63.HG2   Q.63.HE22 
assign (resid   65 and name HN  ) (resid   70 and name HB# ) 4.5 4.2 3.0 !pk.1094 # S.65.H     A.70.QB   
assign (resid   63 and name HB# ) (resid   63 and name HE2#) 4.5 5.2 4.0 !pk.1095 # Q.63.HB2   Q.63.HE22 
assign (resid   61 and name HB# ) (resid   65 and name HN  ) 4.5 4.2 3.0 !pk.1096 # A.61.QB    S.65.H    
assign (resid   14 and name HD2#) (resid   65 and name HN  ) 4.5 4.2 3.0 !pk.1097 # L.14.QD2   S.65.H    
assign (resid   14 and name HD1#) (resid   65 and name HN  ) 4.5 4.2 3.0 !pk.1098 # L.14.QD1   S.65.H    
assign (resid   27 and name HE1 ) (resid   66 and name HA  ) 4.5 3.2 2.0 !pk.1102 # W.27.HE1   D.66.HA   
assign (resid   27 and name HE1 ) (resid   70 and name HB# ) 3.5 3.7 2.8 !pk.1103 # W.27.HE1   A.70.QB   
assign (resid   27 and name HE1 ) (resid   28 and name HG# ) 4.5 4.7 3.5 !pk.1104 # W.27.HE1   R.28.HG2  
assign (resid   53 and name HN  ) (resid   54 and name HN  ) 3.5 1.7 0.8 !pk.1105   G.53.H     E.54.H    
assign (resid   52 and name HN  ) (resid   53 and name HN  ) 3.5 1.7 0.8 !pk.1106   S.52.H     G.53.H    
assign (resid   52 and name HB# ) (resid   53 and name HN  ) 3.5 2.7 1.8 !pk.1109 # S.52.HB3   G.53.H    
assign (resid   53 and name HN  ) (resid   54 and name HG# ) 4.5 4.2 3.0 !pk.1111 # G.53.H     E.54.HG3  
assign (resid   53 and name HN  ) (resid   54 and name HB# ) 4.5 3.7 2.5 !pk.1112 # G.53.H     E.54.QB   
assign (resid   51 and name HB# ) (resid   53 and name HN  ) 4.5 3.7 2.5 !pk.1113 # K.51.HB3   G.53.H    
assign (resid   50 and name HG2#) (resid   53 and name HN  ) 4.5 4.2 3.0 !pk.1114 # I.50.QG2   G.53.H    
assign (resid    9 and name HG2#) (resid  115 and name HE  ) 4.5 4.2 3.0 !pk.1115 # V.9.QG2    R.115.HE  
assign (resid  115 and name HE  ) (resid  116 and name HN  ) 4.5 2.7 1.5 !pk.1116   R.115.HE   T.116.H   
assign (resid   51 and name HN  ) (resid   53 and name HN  ) 4.5 2.7 1.5 !pk.1117   K.51.H     G.53.H    
assign (resid   98 and name HN  ) (resid  115 and name HE  ) 4.5 2.7 1.5 !pk.1118   G.98.H     R.115.HE  
assign (resid   44 and name HN  ) (resid   45 and name HN  ) 3.5 1.7 0.8 !pk.1119   N.44.H     G.45.H    
assign (resid   45 and name HN  ) (resid   46 and name HN  ) 3.5 1.7 0.8 !pk.1120   G.45.H     Y.46.H    
assign (resid   45 and name HN  ) (resid   46 and name HD# ) 4.5 5.1 3.9 !pk.1124 # G.45.H     Y.46.QD   
assign (resid  115 and name HA  ) (resid  115 and name HE  ) 4.5 2.7 1.5 !pk.1125   R.115.HA   R.115.HE  
assign (resid    9 and name HA  ) (resid  115 and name HE  ) 4.5 2.7 1.5 !pk.1127   V.9.HA     R.115.HE  
assign (resid   45 and name HN  ) (resid   45 and name HA# ) 2.5 1.7 1.9 !pk.1128 # G.45.H     G.45.QA   
assign (resid   42 and name HA  ) (resid   45 and name HN  ) 4.5 2.7 1.5 !pk.1129   L.42.HA    G.45.H    
assign (resid   43 and name HA  ) (resid   45 and name HN  ) 4.5 2.7 1.5 !pk.1129   I.43.HA    G.45.H    
assign (resid   97 and name HA  ) (resid  115 and name HE  ) 4.5 2.7 1.5 !pk.1130   T.97.HA    R.115.HE  
assign (resid   45 and name HN  ) (resid   46 and name HB# ) 4.5 3.7 2.5 !pk.1131 # G.45.H     Y.46.HB2  
assign (resid   44 and name HB# ) (resid   45 and name HN  ) 3.5 2.7 1.8 !pk.1133 # N.44.HB2   G.45.H    
assign (resid   44 and name HB# ) (resid   45 and name HN  ) 4.5 3.7 2.5 !pk.1134 # N.44.HB3   G.45.H    
assign (resid   43 and name HB  ) (resid   45 and name HN  ) 4.5 2.7 1.5 !pk.1136   I.43.HB    G.45.H    
assign (resid  115 and name HB# ) (resid  115 and name HE  ) 4.5 3.7 2.5 !pk.1137 # R.115.HB3  R.115.HE  
assign (resid    9 and name HB  ) (resid  115 and name HE  ) 4.5 2.7 1.5 !pk.1138   V.9.HB     R.115.HE  
assign (resid  115 and name HG# ) (resid  115 and name HE  ) 3.5 3.2 2.3 !pk.1139 # R.115.HG3  R.115.HE  
assign (resid   42 and name HB# ) (resid   45 and name HN  ) 4.5 3.7 2.5 !pk.1140 # L.42.HB3   G.45.H    
assign (resid   45 and name HN  ) (resid   47 and name HG1#) 4.5 3.7 2.5 !pk.1140 # G.45.H     I.47.HG13 
assign (resid   45 and name HN  ) (resid   47 and name HD1#) 4.5 4.2 3.0 !pk.1140 # G.45.H     I.47.QD1  
assign (resid   43 and name HG2#) (resid   45 and name HN  ) 4.5 4.2 3.0 !pk.1141 # I.43.QG2   G.45.H    
assign (resid   10 and name HN  ) (resid  115 and name HE  ) 4.5 2.7 1.5 !pk.1144   R.10.H     R.115.HE  
assign (resid   44 and name HA  ) (resid   44 and name HD2#) 4.5 4.2 3.0 !pk.1147 # N.44.HA    N.44.HD21 
assign (resid   44 and name HB# ) (resid   44 and name HD2#) 3.5 4.2 3.3 !pk.1148 # N.44.HB2   N.44.HD22 
assign (resid   43 and name HB  ) (resid   44 and name HD2#) 4.5 4.2 3.0 !pk.1150 # I.43.HB    N.44.HD21 
assign (resid   40 and name HB# ) (resid   44 and name HD2#) 4.5 5.2 4.0 !pk.1151 # L.40.HB2   N.44.HD21 
assign (resid   41 and name HB# ) (resid   44 and name HD2#) 4.5 5.2 4.0 !pk.1151 # E.41.QB    N.44.HD21 
assign (resid   40 and name HB# ) (resid   44 and name HD2#) 4.5 5.2 4.0 !pk.1152 # L.40.HB2   N.44.HD22 
assign (resid   44 and name HA  ) (resid   44 and name HD2#) 4.5 4.2 3.0 !pk.1155 # N.44.HA    N.44.HD22 
assign (resid   41 and name HA  ) (resid   44 and name HD2#) 4.5 4.2 3.0 !pk.1157 # E.41.HA    N.44.HD22 
assign (resid   44 and name HB# ) (resid   44 and name HD2#) 3.5 4.2 3.3 !pk.1158 # N.44.HB2   N.44.HD21 
assign (resid   44 and name HB# ) (resid   44 and name HD2#) 4.5 5.2 4.0 !pk.1159 # N.44.HB3   N.44.HD21 
assign (resid   43 and name HB  ) (resid   44 and name HD2#) 4.5 4.2 3.0 !pk.1160 # I.43.HB    N.44.HD22 
assign (resid  109 and name HN  ) (resid  110 and name HN  ) 4.5 2.7 1.5 !pk.1164   G.109.H    I.110.H   
assign (resid   15 and name HD1#) (resid  109 and name HN  ) 4.5 4.2 3.0 !pk.1167 # L.15.QD1   G.109.H   
assign (resid   70 and name HN  ) (resid   71 and name HG# ) 4.5 4.2 3.0 !pk.1168 # A.70.H     K.71.HG3  
assign (resid   27 and name HE1 ) (resid   70 and name HN  ) 4.5 3.2 2.0 !pk.1169 # W.27.HE1   A.70.H    
assign (resid   70 and name HN  ) (resid   72 and name HN  ) 4.5 2.7 1.5 !pk.1171   A.70.H     A.72.H    
assign (resid   65 and name HG  ) (resid   70 and name HN  ) 4.5 2.7 1.5 !pk.1172   S.65.HG    A.70.H    
assign (resid   69 and name HB# ) (resid   70 and name HN  ) 4.5 3.7 2.5 !pk.1175 # S.69.QB    A.70.H    
assign (resid   70 and name HN  ) (resid   70 and name HB# ) 3.5 3.2 2.3 !pk.1177 # A.70.H     A.70.QB   
assign (resid   67 and name HB# ) (resid   70 and name HN  ) 4.5 4.2 3.0 !pk.1178 # A.67.QB    A.70.H    
assign (resid   61 and name HN  ) (resid   62 and name HN  ) 3.5 1.7 0.8 !pk.1179   A.61.H     S.62.H    
assign (resid   62 and name HN  ) (resid   64 and name HN  ) 4.5 2.7 1.5 !pk.1180   S.62.H     F.64.H    
assign (resid   62 and name HN  ) (resid   63 and name HN  ) 3.5 1.7 0.8 !pk.1181   S.62.H     Q.63.H    
assign (resid   62 and name HN  ) (resid   70 and name HB# ) 4.5 4.2 3.0 !pk.1185 # S.62.H     A.70.QB   
assign (resid   62 and name HN  ) (resid   73 and name HG# ) 4.5 4.2 3.0 !pk.1186 # S.62.H     R.73.QG   
assign (resid   61 and name HB# ) (resid   62 and name HN  ) 3.5 3.2 2.3 !pk.1187 # A.61.QB    S.62.H    
assign (resid   76 and name HN  ) (resid   77 and name HN  ) 3.5 1.7 0.8 !pk.1188   L.76.H     G.77.H    
assign (resid   11 and name HN  ) (resid   77 and name HN  ) 4.5 2.7 1.5 !pk.1190   C.11.H     G.77.H    
assign (resid   12 and name HA  ) (resid   77 and name HN  ) 4.5 2.7 1.5 !pk.1191   S.12.HA    G.77.H    
assign (resid   75 and name HB# ) (resid   77 and name HN  ) 4.5 3.7 2.5 !pk.1195 # D.75.QB    G.77.H    
assign (resid   62 and name HN  ) (resid   63 and name HG# ) 4.5 4.2 3.0 !pk.1196 # S.62.H     Q.63.HG2  
assign (resid   76 and name HB# ) (resid   77 and name HN  ) 4.5 3.7 2.5 !pk.1197 # L.76.HB3   G.77.H    
assign (resid   76 and name HG  ) (resid   77 and name HN  ) 4.5 2.7 1.5 !pk.1198   L.76.HG    G.77.H    
assign (resid   76 and name HB# ) (resid   77 and name HN  ) 4.5 3.7 2.5 !pk.1199 # L.76.HB2   G.77.H    
assign (resid   10 and name HG# ) (resid   77 and name HN  ) 4.5 4.2 3.0 !pk.1200 # R.10.HG2   G.77.H    
assign (resid   76 and name HD1#) (resid   77 and name HN  ) 4.5 4.2 3.0 !pk.1201 # L.76.QD1   G.77.H    
assign (resid   97 and name HN  ) (resid   98 and name HN  ) 4.5 2.7 1.5 !pk.1202   T.97.H     G.98.H    
assign (resid   27 and name HN  ) (resid   27 and name HE1 ) 4.5 3.2 2.0 !pk.1204 # W.27.H     W.27.HE1  
assign (resid   27 and name HE1 ) (resid   63 and name HA  ) 4.5 3.2 2.0 !pk.1205 # W.27.HE1   Q.63.HA   
assign (resid   27 and name HE1 ) (resid   28 and name HD# ) 4.5 4.7 3.5 !pk.1206 # W.27.HE1   R.28.HD3  
assign (resid   27 and name HE1 ) (resid   66 and name HB# ) 4.5 4.2 3.0 !pk.1207 # W.27.HE1   D.66.HB2  
assign (resid   18 and name HN  ) (resid   32 and name HD1#) 4.5 4.2 3.0 !pk.3   # H.18.H     I.32.QD1  
assign (resid   32 and name HD1#) (resid   33 and name HN  ) 4.5 4.2 3.0 !pk.3   # I.32.QD1   T.33.H    
assign (resid   32 and name HN  ) (resid   32 and name HD1#) 4.5 4.2 3.0 !pk.6   # I.32.H     I.32.QD1  
assign (resid   32 and name HD1#) (resid   34 and name HH1#) 4.5 5.7 4.5 !pk.8   # I.32.QD1   R.34.HH12 
assign (resid   29 and name HN  ) (resid   32 and name HD1#) 4.5 4.2 3.0 !pk.9   # Q.29.H     I.32.QD1  
assign (resid   26 and name HB# ) (resid   32 and name HD1#) 4.5 5.2 4.0 !pk.10  # S.26.HB3   I.32.QD1  
assign (resid   31 and name HA  ) (resid   32 and name HD1#) 4.5 4.2 3.0 !pk.10  # K.31.HA    I.32.QD1  
assign (resid   24 and name HA  ) (resid   32 and name HD1#) 4.5 4.2 3.0 !pk.11  # P.24.HA    I.32.QD1  
assign (resid   25 and name HA  ) (resid   32 and name HD1#) 4.5 4.2 3.0 !pk.11  # S.25.HA    I.32.QD1  
assign (resid   17 and name HA  ) (resid   32 and name HD1#) 4.5 4.2 3.0 !pk.12  # K.17.HA    I.32.QD1  
assign (resid   18 and name HD2 ) (resid  109 and name HA# ) 4.5 4.2 3.0 !pk.13  # H.18.HD2   G.109.HA2 
assign (resid   32 and name HA  ) (resid   32 and name HD1#) 4.5 4.2 3.0 !pk.14  # I.32.HA    I.32.QD1  
assign (resid   18 and name HD2 ) (resid   36 and name HA  ) 4.5 3.2 2.0 !pk.15  # H.18.HD2   K.36.HA   
assign (resid   44 and name HB# ) (resid   45 and name HA# ) 4.5 4.7 3.5 !pk.17  # N.44.HB2   G.45.QA   
assign (resid   32 and name HD1#) (resid   66 and name HB# ) 4.5 5.2 4.0 !pk.19  # I.32.QD1   D.66.HB2  
assign (resid   17 and name HD# ) (resid   32 and name HD1#) 4.5 5.7 4.5 !pk.23  # K.17.HD2   I.32.QD1  
assign (resid   17 and name HB# ) (resid   32 and name HD1#) 3.5 4.2 3.3 !pk.24  # K.17.QB    I.32.QD1  
assign (resid   18 and name HD2 ) (resid  110 and name HG1#) 3.5 3.2 2.3 !pk.25  # H.18.HD2   I.110.HG12
assign (resid   18 and name HD2 ) (resid   39 and name HB# ) 3.5 3.7 2.8 !pk.27  # H.18.HD2   A.39.QB   
assign (resid   42 and name HB# ) (resid   45 and name HA# ) 4.5 4.7 3.5 !pk.29  # L.42.HB3   G.45.QA   
assign (resid   45 and name HA# ) (resid   47 and name HD1#) 4.5 5.2 4.0 !pk.29  # G.45.QA    I.47.QD1  
assign (resid   18 and name HD2 ) (resid  110 and name HD1#) 4.5 4.7 3.5 !pk.30  # H.18.HD2   I.110.QD1 
assign (resid   44 and name HN  ) (resid   45 and name HA# ) 4.5 3.7 2.5 !pk.31  # N.44.H     G.45.QA   
assign (resid   27 and name HZ2 ) (resid   63 and name HA  ) 4.5 3.2 2.0 !pk.32  # W.27.HZ2   Q.63.HA   
assign (resid   15 and name HB# ) (resid   67 and name HN  ) 4.5 3.7 2.5 !pk.42  # L.15.HB2   A.67.H    
assign (resid   53 and name HA# ) (resid   55 and name HN  ) 4.5 3.7 2.5 !pk.44  # G.53.HA2   E.55.H    
assign (resid   14 and name HB# ) (resid   57 and name HZ  ) 4.5 4.2 3.0 !pk.46  # L.14.HB2   F.57.HZ   
assign (resid   14 and name HB# ) (resid   57 and name HE# ) 4.5 6.1 4.9 !pk.47  # L.14.HB3   F.57.QE   
assign (resid   14 and name HB# ) (resid   57 and name HZ  ) 4.5 4.2 3.0 !pk.47  # L.14.HB3   F.57.HZ   
assign (resid   57 and name HE# ) (resid  114 and name HB# ) 4.5 6.1 4.9 !pk.48  # F.57.QE    L.114.HB3 
assign (resid   14 and name HB# ) (resid   61 and name HA  ) 4.5 3.7 2.5 !pk.52  # L.14.HB2   A.61.HA   
assign (resid   14 and name HB# ) (resid   61 and name HA  ) 4.5 3.7 2.5 !pk.53  # L.14.HB3   A.61.HA   
assign (resid  114 and name HB# ) (resid  116 and name HG2#) 4.5 5.2 4.0 !pk.59  # L.114.HB3  T.116.QG2 
assign (resid   14 and name HB# ) (resid   14 and name HD2#) 4.5 5.2 4.0 !pk.62  # L.14.HB3   L.14.QD2  
assign (resid  114 and name HB# ) (resid  114 and name HD2#) 3.5 4.2 3.3 !pk.64  # L.114.HB3  L.114.QD2 
assign (resid   16 and name HN  ) (resid   43 and name HD1#) 4.5 4.2 3.0 !pk.70  # V.16.H     I.43.QD1  
assign (resid   43 and name HN  ) (resid   43 and name HD1#) 4.5 4.2 3.0 !pk.72  # I.43.H     I.43.QD1  
assign (resid   53 and name HA# ) (resid   55 and name HN  ) 4.5 3.7 2.5 !pk.76  # G.53.HA3   E.55.H    
assign (resid   43 and name HD1#) (resid   46 and name HD# ) 3.5 5.6 4.7 !pk.77  # I.43.QD1   Y.46.QD   
assign (resid   43 and name HD1#) (resid   46 and name HE# ) 4.5 6.6 5.4 !pk.78  # I.43.QD1   Y.46.QE   
assign (resid   43 and name HD1#) (resid  103 and name HA  ) 4.5 4.2 3.0 !pk.80  # I.43.QD1   P.103.HA  
assign (resid   12 and name HB# ) (resid   74 and name HA# ) 4.5 4.7 3.5 !pk.81  # S.12.HB2   G.74.HA2  
assign (resid   40 and name HA  ) (resid   43 and name HD1#) 4.5 4.2 3.0 !pk.82  # L.40.HA    I.43.QD1  
assign (resid   43 and name HD1#) (resid   46 and name HB# ) 4.5 5.2 4.0 !pk.87  # I.43.QD1   Y.46.HB2  
assign (resid   57 and name HB# ) (resid  114 and name HB# ) 4.5 4.7 3.5 !pk.87  # F.57.HB2   L.114.HB2 
assign (resid   43 and name HD1#) (resid   46 and name HB# ) 4.5 5.2 4.0 !pk.88  # I.43.QD1   Y.46.HB3  
assign (resid   43 and name HB  ) (resid   43 and name HD1#) 3.5 3.2 2.3 !pk.89  # I.43.HB    I.43.QD1  
assign (resid   43 and name HD1#) (resid  112 and name HG1#) 3.5 4.2 3.3 !pk.90  # I.43.QD1   I.112.HG12
assign (resid   98 and name HA# ) (resid  116 and name HG2#) 4.5 5.2 4.0 !pk.93  # G.98.HA3   T.116.QG2 
assign (resid   16 and name HG2#) (resid   43 and name HD1#) 2.5 3.7 3.9 !pk.94  # V.16.QG2   I.43.QD1  
assign (resid   43 and name HD1#) (resid  112 and name HD1#) 3.5 4.7 3.8 !pk.94  # I.43.QD1   I.112.QD1 
assign (resid   43 and name HD1#) (resid  110 and name HG2#) 4.5 5.7 4.5 !pk.95  # I.43.QD1   I.110.QG2 
assign (resid  109 and name HA# ) (resid  110 and name HG1#) 4.5 4.7 3.5 !pk.110 # G.109.HA3  I.110.HG12
assign (resid   61 and name HB# ) (resid   74 and name HA# ) 4.5 5.2 4.0 !pk.112 # A.61.QB    G.74.HA3  
assign (resid   97 and name HG2#) (resid   98 and name HA# ) 4.5 5.2 4.0 !pk.113 # T.97.QG2   G.98.HA2  
assign (resid  109 and name HA# ) (resid  110 and name HD1#) 4.5 5.2 4.0 !pk.114 # G.109.HA3  I.110.QD1 
assign (resid   10 and name HD# ) (resid   77 and name HA# ) 4.5 5.2 4.0 !pk.124 # R.10.HD2   G.77.HA3  
assign (resid  102 and name HA# ) (resid  103 and name HG# ) 4.5 4.7 3.5 !pk.125 # G.102.HA3  P.103.HG3 
assign (resid   10 and name HG# ) (resid   77 and name HA# ) 4.5 5.2 4.0 !pk.126 # R.10.HG2   G.77.HA3  
assign (resid   77 and name HA# ) (resid   78 and name HB# ) 4.5 5.2 4.0 !pk.127 # G.77.HA2   A.78.QB   
assign (resid  102 and name HA# ) (resid  103 and name HG# ) 4.5 4.7 3.5 !pk.133 # G.102.HA3  P.103.HG2 
assign (resid   47 and name HD1#) (resid  102 and name HA# ) 4.5 5.2 4.0 !pk.134 # I.47.QD1   G.102.HA2 
assign (resid   47 and name HD1#) (resid  102 and name HA# ) 4.5 5.2 4.0 !pk.135 # I.47.QD1   G.102.HA3 
assign (resid   76 and name HB# ) (resid   79 and name HD# ) 4.5 6.1 4.9 !pk.140 # L.76.HB3   F.79.QD   
assign (resid   11 and name HN  ) (resid   76 and name HB# ) 4.5 3.7 2.5 !pk.142 # C.11.H     L.76.HB3  
assign (resid   11 and name HN  ) (resid   76 and name HB# ) 4.5 3.7 2.5 !pk.143 # C.11.H     L.76.HB2  
assign (resid   10 and name HD# ) (resid  117 and name HG# ) 4.5 5.7 4.5 !pk.146 # R.10.HD3   E.117.HG3 
assign (resid   10 and name HD# ) (resid  117 and name HB# ) 4.5 5.2 4.0 !pk.150 # R.10.HD2   E.117.HB3 
assign (resid   10 and name HD# ) (resid  117 and name HB# ) 4.5 5.2 4.0 !pk.151 # R.10.HD3   E.117.HB3 
assign (resid   10 and name HB# ) (resid   10 and name HD# ) 3.5 4.2 3.3 !pk.153 # R.10.HB3   R.10.HD2  
assign (resid   76 and name HB# ) (resid   84 and name HE# ) 4.5 5.2 4.0 !pk.155 # L.76.HB3   M.84.QE   
assign (resid   76 and name HB# ) (resid   84 and name HE# ) 4.5 5.2 4.0 !pk.156 # L.76.HB2   M.84.QE   
assign (resid   76 and name HB# ) (resid   76 and name HD2#) 3.5 4.2 3.3 !pk.158 # L.76.HB2   L.76.QD2  
assign (resid    8 and name HD# ) (resid   80 and name HB# ) 4.5 5.2 4.0 !pk.165 # R.8.QD     S.80.HB2  
assign (resid   17 and name HG# ) (resid   66 and name HB# ) 4.5 5.2 4.0 !pk.168 # K.17.QG    D.66.HB2  
assign (resid   17 and name HG# ) (resid   66 and name HB# ) 4.5 5.2 4.0 !pk.169 # K.17.QG    D.66.HB3  
assign (resid    8 and name HD# ) (resid   78 and name HB# ) 3.5 4.7 3.8 !pk.170 # R.8.QD     A.78.QB   
assign (resid   15 and name HB# ) (resid   66 and name HB# ) 4.5 4.7 3.5 !pk.171 # L.15.HB3   D.66.HB3  
assign (resid   15 and name HG  ) (resid   66 and name HB# ) 4.5 3.7 2.5 !pk.171 # L.15.HG    D.66.HB3  
assign (resid   15 and name HD2#) (resid   66 and name HB# ) 4.5 5.2 4.0 !pk.172 # L.15.QD2   D.66.HB3  
assign (resid  115 and name HN  ) (resid  115 and name HD# ) 4.5 4.2 3.0 !pk.173 # R.115.H    R.115.HD2 
assign (resid   73 and name HN  ) (resid   73 and name HD# ) 4.5 4.2 3.0 !pk.174 # R.73.H     R.73.HD2  
assign (resid   34 and name HD# ) (resid   34 and name HH1#) 4.5 5.7 4.5 !pk.180 # R.34.HD2   R.34.HH12 
assign (resid   95 and name HN  ) (resid  115 and name HD# ) 4.5 4.2 3.0 !pk.182 # L.95.H     R.115.HD2 
assign (resid    8 and name HA  ) (resid    8 and name HD# ) 4.5 4.2 3.0 !pk.183 # R.8.HA     R.8.QD    
assign (resid   96 and name HA  ) (resid  115 and name HD# ) 4.5 4.2 3.0 !pk.184 # R.96.HA    R.115.HD3 
assign (resid   96 and name HA  ) (resid  115 and name HD# ) 4.5 4.2 3.0 !pk.185 # R.96.HA    R.115.HD2 
assign (resid   22 and name HA  ) (resid   22 and name HD# ) 4.5 4.2 3.0 !pk.186 # R.22.HA    R.22.HD2  
assign (resid   73 and name HB# ) (resid   73 and name HD# ) 3.5 4.2 3.3 !pk.195 # R.73.HB2   R.73.HD2  
assign (resid  115 and name HB# ) (resid  115 and name HD# ) 4.5 5.2 4.0 !pk.198 # R.115.HB3  R.115.HD2 
assign (resid  115 and name HB# ) (resid  115 and name HD# ) 4.5 5.2 4.0 !pk.199 # R.115.HB3  R.115.HD3 
assign (resid   23 and name HG# ) (resid   23 and name HD# ) 3.5 4.7 3.8 !pk.202 # R.23.QG    R.23.QD   
assign (resid   34 and name HD# ) (resid   39 and name HB# ) 4.5 5.7 4.5 !pk.203 # R.34.HD3   A.39.QB   
assign (resid   34 and name HD# ) (resid   39 and name HB# ) 4.5 5.7 4.5 !pk.204 # R.34.HD2   A.39.QB   
assign (resid    8 and name HG# ) (resid    8 and name HD# ) 3.5 4.7 3.8 !pk.205 # R.8.QG     R.8.QD    
assign (resid   34 and name HD# ) (resid   42 and name HD1#) 4.5 5.7 4.5 !pk.211 # R.34.HD3   L.42.QD1  
assign (resid   95 and name HD1#) (resid  115 and name HD# ) 4.5 5.7 4.5 !pk.212 # L.95.QD1   R.115.HD2 
assign (resid   95 and name HD1#) (resid  115 and name HD# ) 4.5 5.7 4.5 !pk.213 # L.95.QD1   R.115.HD3 
assign (resid    9 and name HG1#) (resid  115 and name HD# ) 4.5 5.7 4.5 !pk.215 # V.9.QG1    R.115.HD3 
assign (resid   81 and name HD# ) (resid   81 and name HH1#) 4.5 5.7 4.5 !pk.217 # R.81.QD    R.81.HH12 
assign (resid   81 and name HD# ) (resid   81 and name HH1#) 4.5 5.7 4.5 !pk.218 # R.81.QD    R.81.HH11 
assign (resid   22 and name HA  ) (resid   22 and name HD# ) 4.5 4.2 3.0 !pk.219 # R.22.HA    R.22.HD3  
assign (resid   56 and name HB# ) (resid   59 and name HB# ) 4.5 4.7 3.5 !pk.220 # D.56.HB3   S.59.HB3  
assign (resid   22 and name HB# ) (resid   22 and name HD# ) 3.5 4.2 3.3 !pk.222 # R.22.QB    R.22.HD2  
assign (resid   22 and name HB# ) (resid   22 and name HD# ) 3.5 4.2 3.3 !pk.223 # R.22.QB    R.22.HD3  
assign (resid   81 and name HB# ) (resid   81 and name HD# ) 3.5 4.2 3.3 !pk.224 # R.81.HB3   R.81.QD   
assign (resid   56 and name HB# ) (resid   57 and name HN  ) 4.5 3.7 2.5 !pk.227 # D.56.HB2   F.57.H    
assign (resid   95 and name HB# ) (resid   96 and name HN  ) 4.5 3.7 2.5 !pk.229 # L.95.HB3   R.96.H    
assign (resid   96 and name HD# ) (resid   97 and name HN  ) 4.5 4.2 3.0 !pk.231 # R.96.QD    T.97.H    
assign (resid   56 and name HN  ) (resid   56 and name HB# ) 4.5 3.7 2.5 !pk.233 # D.56.H     D.56.HB3  
assign (resid   95 and name HB# ) (resid   99 and name HN  ) 4.5 3.7 2.5 !pk.234 # L.95.HB3   E.99.H    
assign (resid   95 and name HB# ) (resid  115 and name HN  ) 4.5 3.7 2.5 !pk.234 # L.95.HB3   R.115.H   
assign (resid   56 and name HB# ) (resid   59 and name HN  ) 4.5 3.7 2.5 !pk.236 # D.56.HB3   S.59.H    
assign (resid   95 and name HN  ) (resid   95 and name HB# ) 4.5 3.7 2.5 !pk.238 # L.95.H     L.95.HB3  
assign (resid   56 and name HB# ) (resid   59 and name HB# ) 4.5 4.7 3.5 !pk.241 # D.56.HB2   S.59.HB3  
assign (resid   95 and name HB# ) (resid  115 and name HD# ) 4.5 5.2 4.0 !pk.243 # L.95.HB2   R.115.HD2 
assign (resid   95 and name HB# ) (resid  115 and name HD# ) 4.5 5.2 4.0 !pk.244 # L.95.HB3   R.115.HD2 
assign (resid   95 and name HB# ) (resid  115 and name HD# ) 4.5 5.2 4.0 !pk.246 # L.95.HB2   R.115.HD3 
assign (resid   95 and name HB# ) (resid  115 and name HB# ) 4.5 4.7 3.5 !pk.249 # L.95.HB2   R.115.HB3 
assign (resid   95 and name HB# ) (resid   95 and name HD1#) 3.5 4.2 3.3 !pk.252 # L.95.HB2   L.95.QD1  
assign (resid   95 and name HB# ) (resid   95 and name HD1#) 3.5 4.2 3.3 !pk.253 # L.95.HB3   L.95.QD1  
assign (resid   15 and name HD2#) (resid   17 and name HE# ) 4.5 5.7 4.5 !pk.258 # L.15.QD2   K.17.HE3  
assign (resid   15 and name HD2#) (resid   17 and name HE# ) 4.5 5.7 4.5 !pk.259 # L.15.QD2   K.17.HE2  
assign (resid   27 and name HZ2 ) (resid   28 and name HD# ) 4.5 4.7 3.5 !pk.260 # W.27.HZ2   R.28.HD3  
assign (resid   27 and name HZ2 ) (resid   28 and name HD# ) 4.5 4.7 3.5 !pk.271 # W.27.HZ2   R.28.HD2  
assign (resid   46 and name HD# ) (resid   49 and name HE# ) 4.5 6.6 5.4 !pk.272 # Y.46.QD    K.49.QE   
assign (resid   86 and name HG# ) (resid   86 and name HE# ) 4.5 5.7 4.5 !pk.276 # K.86.HG2   K.86.HE2  
assign (resid   86 and name HG# ) (resid   86 and name HE# ) 3.5 4.7 3.8 !pk.277 # K.86.HG2   K.86.HE3  
assign (resid   46 and name HN  ) (resid   49 and name HE# ) 4.5 4.2 3.0 !pk.283 # Y.46.H     K.49.QE   
assign (resid  101 and name HG  ) (resid  113 and name HB  ) 4.5 2.7 1.5 !pk.285   S.101.HG   I.113.HB  
assign (resid   46 and name HE# ) (resid   49 and name HE# ) 4.5 6.6 5.4 !pk.286 # Y.46.QE    K.49.QE   
assign (resid   46 and name HA  ) (resid   49 and name HE# ) 4.5 4.2 3.0 !pk.287 # Y.46.HA    K.49.QE   
assign (resid  101 and name HB# ) (resid  113 and name HB  ) 4.5 3.7 2.5 !pk.288 # S.101.HB2  I.113.HB  
assign (resid  112 and name HA  ) (resid  113 and name HB  ) 4.5 2.7 1.5 !pk.289   I.112.HA   I.113.HB  
assign (resid   49 and name HA  ) (resid   49 and name HE# ) 4.5 4.2 3.0 !pk.290 # K.49.HA    K.49.QE   
assign (resid   51 and name HA  ) (resid   51 and name HE# ) 4.5 4.2 3.0 !pk.290 # K.51.HA    K.51.QE   
assign (resid   51 and name HB# ) (resid   51 and name HE# ) 4.5 5.2 4.0 !pk.292 # K.51.HB2   K.51.QE   
assign (resid   51 and name HB# ) (resid   51 and name HE# ) 4.5 5.2 4.0 !pk.292 # K.51.HB3   K.51.QE   
assign (resid   31 and name HD# ) (resid   31 and name HE# ) 2.5 3.7 3.9 !pk.294 # K.31.QD    K.31.QE   
assign (resid   49 and name HG# ) (resid   49 and name HE# ) 3.5 4.7 3.8 !pk.295 # K.49.HG3   K.49.QE   
assign (resid   31 and name HG# ) (resid   31 and name HE# ) 4.5 5.7 4.5 !pk.297 # K.31.HG2   K.31.QE   
assign (resid   31 and name HG# ) (resid   31 and name HE# ) 4.5 5.7 4.5 !pk.298 # K.31.HG3   K.31.QE   
assign (resid   47 and name HG2#) (resid   51 and name HE# ) 3.5 4.7 3.8 !pk.299 # I.47.QG2   K.51.QE   
assign (resid  113 and name HB  ) (resid  113 and name HD1#) 3.5 3.2 2.3 !pk.302 # I.113.HB   I.113.QD1 
assign (resid  112 and name HN  ) (resid  112 and name HB  ) 4.5 2.7 1.5 !pk.304   I.112.H    I.112.HB  
assign (resid   42 and name HB# ) (resid   43 and name HN  ) 4.5 3.7 2.5 !pk.306 # L.42.HB3   I.43.H    
assign (resid   36 and name HE# ) (resid  105 and name HD# ) 4.5 6.6 5.4 !pk.309 # K.36.QE    F.105.QD  
assign (resid   57 and name HE# ) (resid  112 and name HB  ) 4.5 5.1 3.9 !pk.310 # F.57.QE    I.112.HB  
assign (resid  101 and name HG  ) (resid  112 and name HB  ) 4.5 2.7 1.5 !pk.311   S.101.HG   I.112.HB  
assign (resid   42 and name HB# ) (resid   46 and name HE# ) 4.5 6.1 4.9 !pk.313 # L.42.HB3   Y.46.QE   
assign (resid   39 and name HA  ) (resid   42 and name HB# ) 4.5 3.7 2.5 !pk.316 # A.39.HA    L.42.HB3  
assign (resid  100 and name HG# ) (resid  112 and name HB  ) 4.5 4.2 3.0 !pk.319 # M.100.HG3  I.112.HB  
assign (resid   42 and name HB# ) (resid   43 and name HB  ) 4.5 3.7 2.5 !pk.320 # L.42.HB2   I.43.HB   
assign (resid   14 and name HB# ) (resid  112 and name HB  ) 4.5 3.7 2.5 !pk.324 # L.14.HB2   I.112.HB  
assign (resid   16 and name HG1#) (resid   42 and name HB# ) 4.5 5.2 4.0 !pk.329 # V.16.QG1   L.42.HB2  
assign (resid   16 and name HG1#) (resid   42 and name HB# ) 4.5 5.2 4.0 !pk.330 # V.16.QG1   L.42.HB3  
assign (resid   36 and name HG# ) (resid   36 and name HE# ) 3.5 4.7 3.8 !pk.331 # K.36.HG2   K.36.QE   
assign (resid  112 and name HB  ) (resid  112 and name HD1#) 3.5 3.2 2.3 !pk.333 # I.112.HB   I.112.QD1 
assign (resid   42 and name HB# ) (resid   42 and name HD1#) 3.5 4.2 3.3 !pk.334 # L.42.HB3   L.42.QD1  
assign (resid   36 and name HG# ) (resid   36 and name HE# ) 3.5 4.7 3.8 !pk.335 # K.36.HG3   K.36.QE   
assign (resid   43 and name HD1#) (resid  112 and name HB  ) 4.5 4.2 3.0 !pk.337 # I.43.QD1   I.112.HB  
assign (resid   14 and name HD1#) (resid  112 and name HB  ) 4.5 4.2 3.0 !pk.340 # L.14.QD1   I.112.HB  
assign (resid   60 and name HB# ) (resid   61 and name HN  ) 4.5 3.7 2.5 !pk.341 # L.60.HB2   A.61.H    
assign (resid   60 and name HB# ) (resid   61 and name HN  ) 4.5 3.7 2.5 !pk.342 # L.60.HB3   A.61.H    
assign (resid   40 and name HB# ) (resid   41 and name HN  ) 4.5 3.7 2.5 !pk.345 # L.40.HB2   E.41.H    
assign (resid   60 and name HN  ) (resid   60 and name HB# ) 4.5 3.7 2.5 !pk.347 # L.60.H     L.60.HB3  
assign (resid   40 and name HB# ) (resid  105 and name HZ  ) 4.5 4.2 3.0 !pk.348 # L.40.HB2   F.105.HZ  
assign (resid   40 and name HB# ) (resid   44 and name HD2#) 4.5 5.2 4.0 !pk.349 # L.40.HB3   N.44.HD21 
assign (resid   60 and name HB# ) (resid   64 and name HD# ) 4.5 6.1 4.9 !pk.351 # L.60.HB3   F.64.QD   
assign (resid   57 and name HA  ) (resid   60 and name HB# ) 4.5 3.7 2.5 !pk.355 # F.57.HA    L.60.HB2  
assign (resid   57 and name HA  ) (resid   60 and name HB# ) 4.5 3.7 2.5 !pk.356 # F.57.HA    L.60.HB3  
assign (resid   60 and name HB# ) (resid   61 and name HA  ) 4.5 3.7 2.5 !pk.356 # L.60.HB3   A.61.HA   
assign (resid   14 and name HD1#) (resid   64 and name HB# ) 4.5 5.2 4.0 !pk.374 # L.14.QD1   F.64.HB2  
assign (resid   79 and name HB# ) (resid   83 and name HB# ) 4.5 4.7 3.5 !pk.379 # F.79.QB    Q.83.HB2  
assign (resid   79 and name HB# ) (resid   84 and name HB# ) 4.5 4.7 3.5 !pk.381 # F.79.QB    M.84.HB2  
assign (resid   60 and name HD1#) (resid   64 and name HB# ) 4.5 5.2 4.0 !pk.383 # L.60.QD1   F.64.HB2  
assign (resid   85 and name HB# ) (resid   88 and name HB# ) 4.5 4.7 3.5 !pk.392 # Q.85.HB3   F.88.HB3  
assign (resid   88 and name HB# ) (resid   89 and name HN  ) 4.5 3.7 2.5 !pk.399 # F.88.HB3   E.89.H    
assign (resid   57 and name HB# ) (resid   58 and name HG# ) 4.5 5.2 4.0 !pk.407 # F.57.HB3   E.58.QG   
assign (resid   50 and name HD1#) (resid   57 and name HB# ) 4.5 5.2 4.0 !pk.411 # I.50.QD1   F.57.HB2  
assign (resid   57 and name HB# ) (resid  114 and name HD2#) 4.5 5.2 4.0 !pk.414 # F.57.HB3   L.114.QD2 
assign (resid   90 and name HN  ) (resid   90 and name HB# ) 4.5 3.7 2.5 !pk.415 # D.90.H     D.90.HB2  
assign (resid   90 and name HB# ) (resid   91 and name HN  ) 4.5 3.7 2.5 !pk.420 # D.90.HB2   A.91.H    
assign (resid  105 and name HB# ) (resid  110 and name HD1#) 4.5 5.2 4.0 !pk.425 # F.105.QB   I.110.QD1 
assign (resid   16 and name HB  ) (resid  110 and name HB  ) 4.5 2.7 1.5 !pk.428   V.16.HB    I.110.HB  
assign (resid   43 and name HG1#) (resid  110 and name HB  ) 4.5 3.7 2.5 !pk.429 # I.43.HG13  I.110.HB  
assign (resid  110 and name HB  ) (resid  110 and name HD1#) 3.5 3.2 2.3 !pk.431 # I.110.HB   I.110.QD1 
assign (resid   50 and name HB  ) (resid   51 and name HN  ) 3.5 1.7 0.8 !pk.433   I.50.HB    K.51.H    
assign (resid   90 and name HA  ) (resid   93 and name HB# ) 4.5 3.7 2.5 !pk.441 # D.90.HA    F.93.HB2  
assign (resid   93 and name HB# ) (resid   94 and name HA  ) 4.5 3.7 2.5 !pk.441 # F.93.HB2   A.94.HA   
assign (resid   50 and name HB  ) (resid   51 and name HA  ) 4.5 2.7 1.5 !pk.443   I.50.HB    K.51.HA   
assign (resid   47 and name HG2#) (resid   50 and name HB  ) 4.5 4.2 3.0 !pk.449 # I.47.QG2   I.50.HB   
assign (resid   46 and name HN  ) (resid   47 and name HB  ) 4.5 2.7 1.5 !pk.454   Y.46.H     I.47.HB   
assign (resid   44 and name HA  ) (resid   47 and name HB  ) 3.5 1.7 0.8 !pk.456   N.44.HA    I.47.HB   
assign (resid   44 and name HN  ) (resid   44 and name HB# ) 3.5 2.7 1.8 !pk.463 # N.44.H     N.44.HB3  
assign (resid   57 and name HE# ) (resid   58 and name HG# ) 4.5 6.6 5.4 !pk.468 # F.57.QE    E.58.QG   
assign (resid   58 and name HG# ) (resid   73 and name HA  ) 4.5 4.2 3.0 !pk.477 # E.58.QG    R.73.HA   
assign (resid   57 and name HB# ) (resid   58 and name HG# ) 4.5 5.2 4.0 !pk.478 # F.57.HB2   E.58.QG   
assign (resid   41 and name HB# ) (resid   44 and name HB# ) 4.5 4.7 3.5 !pk.481 # E.41.QB    N.44.HB2  
assign (resid   58 and name HG# ) (resid   73 and name HG# ) 4.5 5.7 4.5 !pk.483 # E.58.QG    R.73.QG   
assign (resid   44 and name HB# ) (resid   47 and name HD1#) 4.5 5.2 4.0 !pk.484 # N.44.HB2   I.47.QD1  
assign (resid   44 and name HB# ) (resid   47 and name HD1#) 4.5 5.2 4.0 !pk.485 # N.44.HB3   I.47.QD1  
assign (resid   89 and name HG# ) (resid   90 and name HN  ) 4.5 4.2 3.0 !pk.487 # E.89.HG2   D.90.H    
assign (resid   89 and name HN  ) (resid   89 and name HG# ) 4.5 4.2 3.0 !pk.488 # E.89.H     E.89.HG2  
assign (resid   89 and name HG# ) (resid   93 and name HD# ) 4.5 6.6 5.4 !pk.492 # E.89.HG2   F.93.QD   
assign (resid   89 and name HG# ) (resid   93 and name HE# ) 4.5 6.6 5.4 !pk.493 # E.89.HG2   F.93.QE   
assign (resid   99 and name HA  ) (resid  100 and name HB# ) 4.5 3.7 2.5 !pk.496 # E.99.HA    M.100.HB3 
assign (resid   89 and name HA  ) (resid   89 and name HG# ) 4.5 4.2 3.0 !pk.497 # E.89.HA    E.89.HG2  
assign (resid   37 and name HA  ) (resid   37 and name HG# ) 3.5 3.2 2.3 !pk.498 # E.37.HA    E.37.HG2  
assign (resid   24 and name HB# ) (resid   32 and name HB  ) 4.5 3.7 2.5 !pk.506 # P.24.HB3   I.32.HB   
assign (resid   17 and name HB# ) (resid   32 and name HB  ) 4.5 3.7 2.5 !pk.507 # K.17.QB    I.32.HB   
assign (resid   96 and name HN  ) (resid   99 and name HG# ) 4.5 4.2 3.0 !pk.512 # R.96.H     E.99.HG2  
assign (resid   54 and name HG# ) (resid   55 and name HN  ) 4.5 4.2 3.0 !pk.516 # E.54.HG2   E.55.H    
assign (resid   99 and name HA  ) (resid   99 and name HG# ) 3.5 3.2 2.3 !pk.517 # E.99.HA    E.99.HG3  
assign (resid   52 and name HB# ) (resid   54 and name HG# ) 4.5 5.2 4.0 !pk.519 # S.52.HB3   E.54.HG2  
assign (resid   54 and name HA  ) (resid   54 and name HG# ) 4.5 4.2 3.0 !pk.520 # E.54.HA    E.54.HG3  
assign (resid   10 and name HD# ) (resid  117 and name HG# ) 4.5 5.7 4.5 !pk.521 # R.10.HD3   E.117.HG2 
assign (resid   95 and name HD2#) (resid   99 and name HG# ) 3.5 4.7 3.8 !pk.525 # L.95.QD2   E.99.HG2  
assign (resid   41 and name HN  ) (resid   41 and name HG# ) 3.5 3.2 2.3 !pk.536 # E.41.H     E.41.HG3  
assign (resid   41 and name HA  ) (resid   41 and name HG# ) 4.5 4.2 3.0 !pk.539 # E.41.HA    E.41.HG3  
assign (resid   46 and name HB# ) (resid   47 and name HG1#) 4.5 4.7 3.5 !pk.540 # Y.46.HB2   I.47.HG12 
assign (resid   46 and name HB# ) (resid   49 and name HB# ) 4.5 4.7 3.5 !pk.541 # Y.46.HB3   K.49.HB2  
assign (resid   55 and name HG# ) (resid   56 and name HN  ) 4.5 4.2 3.0 !pk.547 # E.55.QG    D.56.H    
assign (resid    5 and name HA  ) (resid    5 and name HG# ) 4.5 4.2 3.0 !pk.553 # E.5.HA     E.5.QG    
assign (resid   43 and name HA  ) (resid   46 and name HB# ) 4.5 3.7 2.5 !pk.557 # I.43.HA    Y.46.HB2  
assign (resid    5 and name HG# ) (resid   93 and name HB# ) 4.5 5.2 4.0 !pk.560 # E.5.QG     F.93.HB2  
assign (resid   43 and name HB  ) (resid   44 and name HB# ) 4.5 3.7 2.5 !pk.562 # I.43.HB    N.44.HB2  
assign (resid   49 and name HB# ) (resid   55 and name HG# ) 3.5 4.2 3.3 !pk.563 # K.49.HB3   E.55.QG   
assign (resid   46 and name HB# ) (resid  112 and name HD1#) 3.5 4.2 3.3 !pk.566 # Y.46.HB3   I.112.QD1 
assign (resid    9 and name HB  ) (resid  115 and name HD# ) 4.5 4.2 3.0 !pk.573 # V.9.HB     R.115.HD2 
assign (resid  116 and name HB  ) (resid  117 and name HN  ) 4.5 2.7 1.5 !pk.582   T.116.HB   E.117.H   
assign (resid   83 and name HN  ) (resid   83 and name HG# ) 4.5 4.2 3.0 !pk.583 # Q.83.H     Q.83.HG3  
assign (resid   83 and name HN  ) (resid   83 and name HG# ) 4.5 4.2 3.0 !pk.584 # Q.83.H     Q.83.HG2  
assign (resid   18 and name HE1 ) (resid   20 and name HG# ) 4.5 4.7 3.5 !pk.587 # H.18.HE1   Q.20.QG   
assign (resid   83 and name HA  ) (resid   83 and name HG# ) 4.5 4.2 3.0 !pk.594 # Q.83.HA    Q.83.HG2  
assign (resid   83 and name HA  ) (resid   83 and name HG# ) 4.5 4.2 3.0 !pk.595 # Q.83.HA    Q.83.HG3  
assign (resid   79 and name HB# ) (resid   83 and name HG# ) 4.5 5.2 4.0 !pk.599 # F.79.QB    Q.83.HG2  
assign (resid   79 and name HB# ) (resid   83 and name HG# ) 4.5 5.2 4.0 !pk.600 # F.79.QB    Q.83.HG3  
assign (resid  104 and name HB  ) (resid  111 and name HB# ) 4.5 3.7 2.5 !pk.601 # V.104.HB   H.111.HB2 
assign (resid  104 and name HB  ) (resid  111 and name HB# ) 4.5 3.7 2.5 !pk.602 # V.104.HB   H.111.HB3 
assign (resid   20 and name HB# ) (resid   20 and name HG# ) 3.5 4.2 3.3 !pk.603 # Q.20.HB2   Q.20.QG   
assign (resid  116 and name HB  ) (resid  117 and name HG# ) 4.5 4.2 3.0 !pk.604 # T.116.HB   E.117.HG3 
assign (resid  104 and name HB  ) (resid  110 and name HG2#) 4.5 4.2 3.0 !pk.609 # V.104.HB   I.110.QG2 
assign (resid  104 and name HB  ) (resid  113 and name HG1#) 4.5 3.7 2.5 !pk.609 # V.104.HB   I.113.HG13
assign (resid  104 and name HB  ) (resid  113 and name HD1#) 4.5 4.2 3.0 !pk.610 # V.104.HB   I.113.QD1 
assign (resid   63 and name HG# ) (resid   64 and name HE# ) 4.5 6.6 5.4 !pk.613 # Q.63.HG3   F.64.QE   
assign (resid   63 and name HN  ) (resid   63 and name HG# ) 3.5 3.2 2.3 !pk.615 # Q.63.H     Q.63.HG2  
assign (resid   63 and name HN  ) (resid   63 and name HG# ) 4.5 4.2 3.0 !pk.616 # Q.63.H     Q.63.HG3  
assign (resid   84 and name HA  ) (resid   85 and name HG# ) 4.5 4.2 3.0 !pk.619 # M.84.HA    Q.85.QG   
assign (resid   63 and name HA  ) (resid   63 and name HG# ) 4.5 4.2 3.0 !pk.621 # Q.63.HA    Q.63.HG2  
assign (resid   63 and name HA  ) (resid   63 and name HG# ) 3.5 3.2 2.3 !pk.622 # Q.63.HA    Q.63.HG3  
assign (resid   85 and name HG# ) (resid   87 and name HD# ) 4.5 5.2 4.0 !pk.623 # Q.85.QG    P.87.HD2  
assign (resid   85 and name HG# ) (resid   87 and name HD# ) 4.5 5.2 4.0 !pk.624 # Q.85.QG    P.87.HD3  
assign (resid   85 and name HG# ) (resid   88 and name HB# ) 4.5 5.2 4.0 !pk.625 # Q.85.QG    F.88.HB2  
assign (resid  104 and name HB  ) (resid  113 and name HG1#) 4.5 3.7 2.5 !pk.630 # V.104.HB   I.113.HG12
assign (resid   26 and name HB# ) (resid   66 and name HB# ) 4.5 4.7 3.5 !pk.637 # S.26.HB2   D.66.HB2  
assign (resid   26 and name HB# ) (resid   32 and name HD1#) 4.5 5.2 4.0 !pk.639 # S.26.HB2   I.32.QD1  
assign (resid    8 and name HB# ) (resid   80 and name HA  ) 4.5 3.7 2.5 !pk.652 # R.8.QB     S.80.HA   
assign (resid   54 and name HA  ) (resid   55 and name HB# ) 4.5 3.7 2.5 !pk.657 # E.54.HA    E.55.HB3  
assign (resid    8 and name HB# ) (resid    8 and name HD# ) 3.5 4.2 3.3 !pk.658 # R.8.QB     R.8.QD    
assign (resid   10 and name HB# ) (resid   10 and name HD# ) 4.5 5.2 4.0 !pk.659 # R.10.HB2   R.10.HD3  
assign (resid   55 and name HB# ) (resid   60 and name HG  ) 4.5 3.7 2.5 !pk.665 # E.55.HB2   L.60.HG   
assign (resid  106 and name HG2#) (resid  111 and name HB# ) 4.5 5.2 4.0 !pk.667 # T.106.QG2  H.111.HB3 
assign (resid    8 and name HB# ) (resid   78 and name HB# ) 4.5 5.2 4.0 !pk.669 # R.8.QB     A.78.QB   
assign (resid   55 and name HB# ) (resid   60 and name HD2#) 3.5 4.2 3.3 !pk.670 # E.55.HB2   L.60.QD2  
assign (resid   55 and name HB# ) (resid   60 and name HD1#) 3.5 4.2 3.3 !pk.671 # E.55.HB3   L.60.QD1  
assign (resid  111 and name HB# ) (resid  113 and name HD1#) 4.5 5.2 4.0 !pk.672 # H.111.HB3  I.113.QD1 
assign (resid   31 and name HN  ) (resid   31 and name HB# ) 3.5 2.7 1.8 !pk.673 # K.31.H     K.31.QB   
assign (resid   49 and name HN  ) (resid   49 and name HB# ) 4.5 3.7 2.5 !pk.673 # K.49.H     K.49.HB3  
assign (resid  116 and name HN  ) (resid  117 and name HB# ) 4.5 3.7 2.5 !pk.681 # T.116.H    E.117.HB3 
assign (resid   11 and name HB# ) (resid   79 and name HD# ) 4.5 6.1 4.9 !pk.691 # C.11.HB3   F.79.QD   
assign (resid   11 and name HB# ) (resid   79 and name HZ  ) 4.5 4.2 3.0 !pk.692 # C.11.HB2   F.79.HZ   
assign (resid   11 and name HB# ) (resid   88 and name HE# ) 4.5 6.1 4.9 !pk.695 # C.11.HB3   F.88.QE   
assign (resid   11 and name HB# ) (resid  115 and name HA  ) 4.5 3.7 2.5 !pk.700 # C.11.HB2   R.115.HA  
assign (resid   46 and name HA  ) (resid   49 and name HB# ) 4.5 3.7 2.5 !pk.701 # Y.46.HA    K.49.HB2  
assign (resid   48 and name HA  ) (resid   48 and name HG# ) 3.5 3.2 2.3 !pk.704 # Q.48.HA    Q.48.QG   
assign (resid   45 and name HA# ) (resid   48 and name HG# ) 4.5 5.2 4.0 !pk.705 # G.45.QA    Q.48.QG   
assign (resid   48 and name HB# ) (resid   48 and name HG# ) 2.5 3.2 3.4 !pk.713 # Q.48.HB2   Q.48.QG   
assign (resid   48 and name HG# ) (resid   51 and name HG# ) 4.5 5.7 4.5 !pk.716 # Q.48.QG    K.51.HG2  
assign (resid   18 and name HB# ) (resid   39 and name HB# ) 3.5 4.2 3.3 !pk.718 # H.18.HB2   A.39.QB   
assign (resid   49 and name HB# ) (resid   55 and name HB# ) 4.5 4.7 3.5 !pk.720 # K.49.HB2   E.55.HB3  
assign (resid   18 and name HB# ) (resid  110 and name HD1#) 4.5 5.2 4.0 !pk.722 # H.18.HB3   I.110.QD1 
assign (resid   11 and name HB# ) (resid  113 and name HG2#) 3.5 4.2 3.3 !pk.724 # C.11.HB3   I.113.QG2 
assign (resid   49 and name HB# ) (resid   50 and name HG1#) 4.5 4.7 3.5 !pk.725 # K.49.HB2   I.50.HG12 
assign (resid   49 and name HB# ) (resid   50 and name HG1#) 4.5 4.7 3.5 !pk.726 # K.49.HB3   I.50.HG12 
assign (resid   49 and name HB# ) (resid   60 and name HD1#) 4.5 5.2 4.0 !pk.726 # K.49.HB3   L.60.QD1  
assign (resid   11 and name HB# ) (resid   76 and name HD1#) 4.5 5.2 4.0 !pk.727 # C.11.HB3   L.76.QD1  
assign (resid   84 and name HB# ) (resid   89 and name HN  ) 4.5 3.7 2.5 !pk.729 # M.84.HB2   E.89.H    
assign (resid   84 and name HB# ) (resid   85 and name HN  ) 4.5 3.7 2.5 !pk.730 # M.84.HB2   Q.85.H    
assign (resid   84 and name HB# ) (resid   88 and name HB# ) 4.5 4.7 3.5 !pk.733 # M.84.HB2   F.88.HB2  
assign (resid   10 and name HD# ) (resid  117 and name HB# ) 4.5 5.2 4.0 !pk.734 # R.10.HD3   E.117.HB2 
assign (resid   15 and name HB# ) (resid  111 and name HE1 ) 4.5 4.2 3.0 !pk.737 # L.15.HB2   H.111.HE1 
assign (resid   79 and name HD# ) (resid   84 and name HG# ) 4.5 6.6 5.4 !pk.743 # F.79.QD    M.84.QG   
assign (resid   84 and name HB# ) (resid   88 and name HD# ) 4.5 6.1 4.9 !pk.744 # M.84.HB2   F.88.QD   
assign (resid   96 and name HA  ) (resid   97 and name HB  ) 4.5 2.7 1.5 !pk.745   R.96.HA    T.97.HB   
assign (resid   84 and name HG# ) (resid   89 and name HB# ) 4.5 5.2 4.0 !pk.747 # M.84.QG    E.89.QB   
assign (resid   83 and name HB# ) (resid   84 and name HB# ) 4.5 4.7 3.5 !pk.748 # Q.83.HB2   M.84.HB2  
assign (resid   16 and name HB  ) (resid   43 and name HD1#) 3.5 3.2 2.3 !pk.753 # V.16.HB    I.43.QD1  
assign (resid   84 and name HG# ) (resid   88 and name HD# ) 4.5 6.6 5.4 !pk.755 # M.84.QG    F.88.QD   
assign (resid   51 and name HN  ) (resid   51 and name HB# ) 3.5 2.7 1.8 !pk.758 # K.51.H     K.51.HB2  
assign (resid   47 and name HA  ) (resid   50 and name HN  ) 4.5 2.7 1.5 !pk.759   I.47.HA    I.50.H    
assign (resid   47 and name HA  ) (resid   47 and name HG1#) 4.5 3.7 2.5 !pk.764 # I.47.HA    I.47.HG12 
assign (resid   47 and name HA  ) (resid   50 and name HB  ) 3.5 1.7 0.8 !pk.765   I.47.HA    I.50.HB   
assign (resid   47 and name HA  ) (resid   47 and name HG2#) 3.5 3.2 2.3 !pk.766 # I.47.HA    I.47.QG2  
assign (resid   47 and name HA  ) (resid   47 and name HG1#) 3.5 2.7 1.8 !pk.766 # I.47.HA    I.47.HG13 
assign (resid   47 and name HG2#) (resid   51 and name HB# ) 4.5 5.2 4.0 !pk.767 # I.47.QG2   K.51.HB2  
assign (resid   47 and name HA  ) (resid   50 and name HD1#) 3.5 3.2 2.3 !pk.768 # I.47.HA    I.50.QD1  
assign (resid   95 and name HB# ) (resid   99 and name HB# ) 4.5 4.7 3.5 !pk.787 # L.95.HB3   E.99.HB2  
assign (resid   95 and name HD2#) (resid   99 and name HB# ) 4.5 5.2 4.0 !pk.788 # L.95.QD2   E.99.HB2  
assign (resid    6 and name HB# ) (resid    9 and name HG1#) 4.5 5.2 4.0 !pk.790 # P.6.HB2    V.9.QG1   
assign (resid    6 and name HB# ) (resid    9 and name HG1#) 4.5 5.2 4.0 !pk.791 # P.6.HB3    V.9.QG1   
assign (resid   80 and name HB# ) (resid   81 and name HN  ) 3.5 2.7 1.8 !pk.793 # S.80.HB2   R.81.H    
assign (resid   80 and name HN  ) (resid   80 and name HB# ) 4.5 3.7 2.5 !pk.800 # S.80.H     S.80.HB2  
assign (resid   97 and name HA  ) (resid   99 and name HN  ) 4.5 2.7 1.5 !pk.802   T.97.HA    E.99.H    
assign (resid    8 and name HE  ) (resid   80 and name HB# ) 4.5 3.7 2.5 !pk.803 # R.8.HE     S.80.HB2  
assign (resid    8 and name HE  ) (resid   80 and name HB# ) 4.5 3.7 2.5 !pk.804 # R.8.HE     S.80.HB3  
assign (resid   79 and name HA  ) (resid   80 and name HB# ) 4.5 3.7 2.5 !pk.807 # F.79.HA    S.80.HB3  
assign (resid   79 and name HA  ) (resid   80 and name HB# ) 4.5 3.7 2.5 !pk.808 # F.79.HA    S.80.HB2  
assign (resid   97 and name HA  ) (resid   98 and name HA# ) 4.5 3.7 2.5 !pk.809 # T.97.HA    G.98.HA2  
assign (resid   97 and name HA  ) (resid   98 and name HA# ) 4.5 3.7 2.5 !pk.810 # T.97.HA    G.98.HA3  
assign (resid   79 and name HB# ) (resid   80 and name HB# ) 4.5 4.7 3.5 !pk.813 # F.79.QB    S.80.HB3  
assign (resid   97 and name HA  ) (resid  115 and name HD# ) 4.5 4.2 3.0 !pk.815 # T.97.HA    R.115.HD2 
assign (resid   36 and name HB# ) (resid   36 and name HE# ) 4.5 5.2 4.0 !pk.816 # K.36.HB3   K.36.QE   
assign (resid   97 and name HA  ) (resid  115 and name HD# ) 4.5 4.2 3.0 !pk.817 # T.97.HA    R.115.HD3 
assign (resid   80 and name HB# ) (resid   83 and name HG# ) 4.5 5.2 4.0 !pk.818 # S.80.HB2   Q.83.HG3  
assign (resid   80 and name HB# ) (resid   83 and name HG# ) 4.5 5.2 4.0 !pk.819 # S.80.HB3   Q.83.HG2  
assign (resid   97 and name HA  ) (resid  115 and name HB# ) 4.5 3.7 2.5 !pk.820 # T.97.HA    R.115.HB2 
assign (resid   97 and name HA  ) (resid  115 and name HB# ) 4.5 3.7 2.5 !pk.821 # T.97.HA    R.115.HB3 
assign (resid   97 and name HA  ) (resid  115 and name HG# ) 4.5 4.2 3.0 !pk.822 # T.97.HA    R.115.HG2 
assign (resid    8 and name HG# ) (resid   80 and name HB# ) 4.5 5.2 4.0 !pk.823 # R.8.QG     S.80.HB2  
assign (resid    8 and name HG# ) (resid   80 and name HB# ) 4.5 5.2 4.0 !pk.824 # R.8.QG     S.80.HB3  
assign (resid   97 and name HA  ) (resid  115 and name HG# ) 4.5 4.2 3.0 !pk.826 # T.97.HA    R.115.HG3 
assign (resid  103 and name HB# ) (resid  104 and name HN  ) 4.5 3.7 2.5 !pk.830 # P.103.HB3  V.104.H   
assign (resid   96 and name HA  ) (resid   97 and name HA  ) 4.5 2.7 1.5 !pk.842   R.96.HA    T.97.HA   
assign (resid   97 and name HA  ) (resid  116 and name HA  ) 4.5 2.7 1.5 !pk.842   T.97.HA    T.116.HA  
assign (resid   23 and name HB# ) (resid   24 and name HD# ) 4.5 4.7 3.5 !pk.843 # R.23.HB2   P.24.HD3  
assign (resid   23 and name HB# ) (resid   23 and name HD# ) 3.5 4.2 3.3 !pk.844 # R.23.HB3   R.23.QD   
assign (resid   79 and name HB# ) (resid   83 and name HB# ) 4.5 4.7 3.5 !pk.846 # F.79.QB    Q.83.HB3  
assign (resid   36 and name HB# ) (resid   36 and name HE# ) 4.5 5.2 4.0 !pk.847 # K.36.HB2   K.36.QE   
assign (resid  100 and name HN  ) (resid  100 and name HG# ) 4.5 4.2 3.0 !pk.853 # M.100.H    M.100.HG2 
assign (resid   23 and name HB# ) (resid   23 and name HE  ) 4.5 3.7 2.5 !pk.854 # R.23.HB3   R.23.HE   
assign (resid   71 and name HB# ) (resid   72 and name HN  ) 4.5 3.7 2.5 !pk.854 # K.71.QB    A.72.H    
assign (resid   63 and name HB# ) (resid   64 and name HE# ) 4.5 6.1 4.9 !pk.855 # Q.63.HB2   F.64.QE   
assign (resid   12 and name HB# ) (resid   57 and name HE# ) 4.5 6.1 4.9 !pk.857 # S.12.HB3   F.57.QE   
assign (resid  100 and name HA  ) (resid  100 and name HG# ) 4.5 4.2 3.0 !pk.858 # M.100.HA   M.100.HG2 
assign (resid   43 and name HG1#) (resid  103 and name HB# ) 3.5 3.7 2.8 !pk.868 # I.43.HG13  P.103.HB3 
assign (resid   12 and name HB# ) (resid  116 and name HG2#) 4.5 5.2 4.0 !pk.871 # S.12.HB3   T.116.QG2 
assign (resid   50 and name HD1#) (resid  100 and name HG# ) 4.5 5.7 4.5 !pk.873 # I.50.QD1   M.100.HG2 
assign (resid   50 and name HD1#) (resid  100 and name HG# ) 4.5 5.7 4.5 !pk.874 # I.50.QD1   M.100.HG3 
assign (resid   12 and name HB# ) (resid  114 and name HB# ) 4.5 4.7 3.5 !pk.875 # S.12.HB3   L.114.HB2 
assign (resid   12 and name HB# ) (resid  114 and name HD2#) 4.5 5.2 4.0 !pk.878 # S.12.HB3   L.114.QD2 
assign (resid  100 and name HG# ) (resid  114 and name HB# ) 4.5 5.2 4.0 !pk.879 # M.100.HG3  L.114.HB3 
assign (resid   12 and name HB# ) (resid  114 and name HB# ) 4.5 4.7 3.5 !pk.880 # S.12.HB3   L.114.HB3 
assign (resid  100 and name HN  ) (resid  100 and name HG# ) 4.5 4.2 3.0 !pk.883 # M.100.H    M.100.HG3 
assign (resid   15 and name HN  ) (resid   65 and name HB# ) 4.5 3.7 2.5 !pk.884 # L.15.H     S.65.HB3  
assign (resid   65 and name HB# ) (resid   70 and name HN  ) 4.5 3.7 2.5 !pk.884 # S.65.HB3   A.70.H    
assign (resid   63 and name HB# ) (resid   64 and name HE# ) 4.5 6.1 4.9 !pk.890 # Q.63.HB3   F.64.QE   
assign (resid   12 and name HB# ) (resid   57 and name HE# ) 4.5 6.1 4.9 !pk.895 # S.12.HB2   F.57.QE   
assign (resid   57 and name HE# ) (resid  100 and name HG# ) 4.5 6.6 5.4 !pk.896 # F.57.QE    M.100.HG3 
assign (resid   60 and name HA  ) (resid   63 and name HB# ) 4.5 3.7 2.5 !pk.906 # L.60.HA    Q.63.HB2  
assign (resid   60 and name HA  ) (resid   63 and name HB# ) 4.5 3.7 2.5 !pk.907 # L.60.HA    Q.63.HB3  
assign (resid   87 and name HB# ) (resid   88 and name HA  ) 4.5 3.7 2.5 !pk.912 # P.87.HB3   F.88.HA   
assign (resid   65 and name HB# ) (resid   70 and name HB# ) 4.5 5.2 4.0 !pk.925 # S.65.HB2   A.70.QB   
assign (resid   65 and name HB# ) (resid   70 and name HB# ) 4.5 5.2 4.0 !pk.926 # S.65.HB3   A.70.QB   
assign (resid   87 and name HB# ) (resid  106 and name HG2#) 4.5 5.2 4.0 !pk.929 # P.87.HB2   T.106.QG2 
assign (resid   87 and name HB# ) (resid  106 and name HG2#) 3.5 4.2 3.3 !pk.930 # P.87.HB3   T.106.QG2 
assign (resid   61 and name HB# ) (resid   65 and name HB# ) 4.5 5.2 4.0 !pk.934 # A.61.QB    S.65.HB2  
assign (resid   12 and name HB# ) (resid   61 and name HB# ) 4.5 5.2 4.0 !pk.935 # S.12.HB2   A.61.QB   
assign (resid   61 and name HB# ) (resid   65 and name HB# ) 4.5 5.2 4.0 !pk.935 # A.61.QB    S.65.HB3  
assign (resid   12 and name HB# ) (resid  116 and name HG2#) 4.5 5.2 4.0 !pk.935 # S.12.HB2   T.116.QG2 
assign (resid   87 and name HB# ) (resid  104 and name HG1#) 4.5 5.2 4.0 !pk.936 # P.87.HB2   V.104.QG1 
assign (resid   87 and name HB# ) (resid  104 and name HG1#) 4.5 5.2 4.0 !pk.937 # P.87.HB3   V.104.QG1 
assign (resid   17 and name HD# ) (resid   32 and name HD1#) 4.5 5.7 4.5 !pk.938 # K.17.HD3   I.32.QD1  
assign (resid   14 and name HD2#) (resid   65 and name HB# ) 4.5 5.2 4.0 !pk.939 # L.14.QD2   S.65.HB3  
assign (resid   12 and name HB# ) (resid   76 and name HD1#) 4.5 5.2 4.0 !pk.940 # S.12.HB2   L.76.QD1  
assign (resid   14 and name HD1#) (resid   65 and name HB# ) 4.5 5.2 4.0 !pk.941 # L.14.QD1   S.65.HB3  
assign (resid   96 and name HN  ) (resid   96 and name HB# ) 4.5 3.7 2.5 !pk.942 # R.96.H     R.96.HB2  
assign (resid   54 and name HA  ) (resid   54 and name HB# ) 3.5 2.7 1.8 !pk.950 # E.54.HA    E.54.QB   
assign (resid   96 and name HB# ) (resid   96 and name HD# ) 3.5 4.2 3.3 !pk.951 # R.96.HB2   R.96.QD   
assign (resid   96 and name HB# ) (resid   96 and name HD# ) 4.5 5.2 4.0 !pk.952 # R.96.HB3   R.96.QD   
assign (resid  101 and name HN  ) (resid  101 and name HB# ) 4.5 3.7 2.5 !pk.955 # S.101.H    S.101.HB3 
assign (resid  101 and name HB# ) (resid  113 and name HN  ) 4.5 3.7 2.5 !pk.958 # S.101.HB2  I.113.H   
assign (resid    9 and name HN  ) (resid   79 and name HD# ) 4.5 5.1 3.9 !pk.961 # V.9.H      F.79.QD   
assign (resid  101 and name HB# ) (resid  102 and name HN  ) 4.5 3.7 2.5 !pk.963 # S.101.HB2  G.102.H   
assign (resid   89 and name HB# ) (resid   93 and name HD# ) 4.5 6.1 4.9 !pk.964 # E.89.QB    F.93.QD   
assign (resid   88 and name HN  ) (resid   89 and name HB# ) 4.5 3.7 2.5 !pk.965 # F.88.H     E.89.QB   
assign (resid   86 and name HA  ) (resid   89 and name HB# ) 3.5 2.7 1.8 !pk.970 # K.86.HA    E.89.QB   
assign (resid   88 and name HB# ) (resid   89 and name HB# ) 4.5 4.7 3.5 !pk.974 # F.88.HB2   E.89.QB   
assign (resid   34 and name HB# ) (resid   34 and name HD# ) 4.5 5.2 4.0 !pk.975 # R.34.HB2   R.34.HD2  
assign (resid   86 and name HG# ) (resid   89 and name HB# ) 4.5 5.2 4.0 !pk.977 # K.86.HG2   E.89.QB   
assign (resid   76 and name HB# ) (resid   79 and name HD# ) 4.5 6.1 4.9 !pk.978 # L.76.HB2   F.79.QD   
assign (resid  101 and name HB# ) (resid  113 and name HB  ) 4.5 3.7 2.5 !pk.980 # S.101.HB3  I.113.HB  
assign (resid  101 and name HB# ) (resid  104 and name HG2#) 4.5 5.2 4.0 !pk.981 # S.101.HB3  V.104.QG2 
assign (resid  101 and name HB# ) (resid  104 and name HG2#) 4.5 5.2 4.0 !pk.982 # S.101.HB2  V.104.QG2 
assign (resid   95 and name HD1#) (resid  101 and name HB# ) 4.5 5.2 4.0 !pk.984 # L.95.QD1   S.101.HB3 
assign (resid  101 and name HB# ) (resid  113 and name HD1#) 4.5 5.2 4.0 !pk.987 # S.101.HB3  I.113.QD1 
assign (resid   79 and name HA  ) (resid   79 and name HD# ) 4.5 5.1 3.9 !pk.991 # F.79.HA    F.79.QD   
assign (resid   14 and name HG  ) (resid   65 and name HB# ) 4.5 3.7 2.5 !pk.992 # L.14.HG    S.65.HB2  
assign (resid   79 and name HD# ) (resid   89 and name HA  ) 4.5 5.1 3.9 !pk.993 # F.79.QD    E.89.HA   
assign (resid   14 and name HG  ) (resid   65 and name HB# ) 4.5 3.7 2.5 !pk.994 # L.14.HG    S.65.HB3  
assign (resid   79 and name HD# ) (resid   83 and name HB# ) 4.5 6.1 4.9 !pk.997 # F.79.QD    Q.83.HB2  
assign (resid   79 and name HD# ) (resid   84 and name HB# ) 4.5 6.1 4.9 !pk.999 # F.79.QD    M.84.HB2  
assign (resid    8 and name HG# ) (resid   79 and name HD# ) 4.5 6.6 5.4 !pk.1001 # R.8.QG     F.79.QD   
assign (resid   81 and name HB# ) (resid   82 and name HN  ) 4.5 3.7 2.5 !pk.1008 # R.81.HB2   G.82.H    
assign (resid   35 and name HN  ) (resid   38 and name HB# ) 4.5 3.7 2.5 !pk.1011 # T.35.H     E.38.HB3  
assign (resid   38 and name HN  ) (resid   38 and name HB# ) 4.5 3.7 2.5 !pk.1016 # E.38.H     E.38.HB3  
assign (resid   86 and name HB# ) (resid   87 and name HD# ) 4.5 4.7 3.5 !pk.1026 # K.86.HB2   P.87.HD3  
assign (resid   81 and name HB# ) (resid   81 and name HD# ) 4.5 5.2 4.0 !pk.1028 # R.81.HB2   R.81.QD   
assign (resid   95 and name HB# ) (resid  115 and name HB# ) 4.5 4.7 3.5 !pk.1032 # L.95.HB3   R.115.HB3 
assign (resid   38 and name HB# ) (resid   39 and name HB# ) 4.5 5.2 4.0 !pk.1033 # E.38.HB2   A.39.QB   
assign (resid   95 and name HD1#) (resid  115 and name HB# ) 4.5 5.2 4.0 !pk.1035 # L.95.QD1   R.115.HB2 
assign (resid   30 and name HN  ) (resid   30 and name HB# ) 4.5 3.7 2.5 !pk.1040 # E.30.H     E.30.HB3  
assign (resid   49 and name HN  ) (resid   49 and name HD# ) 4.5 4.2 3.0 !pk.1041 # K.49.H     K.49.HD2  
assign (resid   49 and name HN  ) (resid   49 and name HD# ) 4.5 4.2 3.0 !pk.1042 # K.49.H     K.49.HD3  
assign (resid   30 and name HB# ) (resid   31 and name HN  ) 4.5 3.7 2.5 !pk.1043 # E.30.HB3   K.31.H    
assign (resid   57 and name HD# ) (resid   58 and name HB# ) 4.5 6.1 4.9 !pk.1046 # F.57.QD    E.58.HB3  
assign (resid    5 and name HB# ) (resid   93 and name HE# ) 4.5 6.1 4.9 !pk.1046 # E.5.QB     F.93.QE   
assign (resid   49 and name HA  ) (resid   49 and name HD# ) 4.5 4.2 3.0 !pk.1052 # K.49.HA    K.49.HD3  
assign (resid   85 and name HB# ) (resid   87 and name HD# ) 4.5 4.7 3.5 !pk.1055 # Q.85.HB3   P.87.HD3  
assign (resid   95 and name HD1#) (resid  115 and name HB# ) 4.5 5.2 4.0 !pk.1063 # L.95.QD1   R.115.HB3 
assign (resid   99 and name HN  ) (resid  115 and name HG# ) 4.5 4.2 3.0 !pk.1069 # E.99.H     R.115.HG3 
assign (resid   52 and name HN  ) (resid   52 and name HB# ) 3.5 2.7 1.8 !pk.1070 # S.52.H     S.52.HB2  
assign (resid   46 and name HD# ) (resid   49 and name HD# ) 4.5 6.6 5.4 !pk.1078 # Y.46.QD    K.49.HD2  
assign (resid   46 and name HA  ) (resid   49 and name HD# ) 4.5 4.2 3.0 !pk.1081 # Y.46.HA    K.49.HD2  
assign (resid   50 and name HG1#) (resid   57 and name HA  ) 4.5 3.7 2.5 !pk.1084 # I.50.HG12  F.57.HA   
assign (resid   36 and name HA  ) (resid   36 and name HD# ) 4.5 4.2 3.0 !pk.1085 # K.36.HA    K.36.QD   
assign (resid   85 and name HB# ) (resid   88 and name HB# ) 4.5 4.7 3.5 !pk.1086 # Q.85.HB2   F.88.HB2  
assign (resid   57 and name HB# ) (resid   58 and name HB# ) 4.5 4.7 3.5 !pk.1088 # F.57.HB2   E.58.HB2  
assign (resid   20 and name HG# ) (resid   36 and name HD# ) 4.5 5.7 4.5 !pk.1094 # Q.20.QG    K.36.QD   
assign (resid   52 and name HB# ) (resid   54 and name HG# ) 4.5 5.2 4.0 !pk.1096 # S.52.HB2   E.54.HG2  
assign (resid   58 and name HB# ) (resid   73 and name HG# ) 4.5 5.2 4.0 !pk.1101 # E.58.HB2   R.73.QG   
assign (resid   51 and name HN  ) (resid   51 and name HD# ) 4.5 4.2 3.0 !pk.1107 # K.51.H     K.51.QD   
assign (resid   62 and name HB# ) (resid   73 and name HN  ) 4.5 3.7 2.5 !pk.1110 # S.62.HB2   R.73.H    
assign (resid   51 and name HD# ) (resid   52 and name HN  ) 4.5 4.2 3.0 !pk.1111 # K.51.QD    S.52.H    
assign (resid   50 and name HA  ) (resid   53 and name HN  ) 4.5 2.7 1.5 !pk.1112   I.50.HA    G.53.H    
assign (resid   62 and name HN  ) (resid   62 and name HB# ) 3.5 2.7 1.8 !pk.1115 # S.62.H     S.62.HB3  
assign (resid   18 and name HE1 ) (resid   20 and name HB# ) 4.5 4.2 3.0 !pk.1116 # H.18.HE1   Q.20.HB2  
assign (resid   18 and name HE1 ) (resid   20 and name HB# ) 3.5 3.2 2.3 !pk.1117 # H.18.HE1   Q.20.HB3  
assign (resid   62 and name HB# ) (resid   63 and name HN  ) 4.5 3.7 2.5 !pk.1120 # S.62.HB2   Q.63.H    
assign (resid   47 and name HA  ) (resid   51 and name HD# ) 4.5 4.2 3.0 !pk.1128 # I.47.HA    K.51.QD   
assign (resid   51 and name HD# ) (resid  100 and name HE# ) 3.5 4.7 3.8 !pk.1132 # K.51.QD    M.100.QE  
assign (resid   62 and name HB# ) (resid   63 and name HG# ) 4.5 5.2 4.0 !pk.1133 # S.62.HB2   Q.63.HG2  
assign (resid   52 and name HB# ) (resid   54 and name HB# ) 4.5 4.7 3.5 !pk.1135 # S.52.HB3   E.54.QB   
assign (resid   50 and name HA  ) (resid   50 and name HG1#) 3.5 2.7 1.8 !pk.1136 # I.50.HA    I.50.HG13 
assign (resid   61 and name HB# ) (resid   62 and name HB# ) 4.5 5.2 4.0 !pk.1141 # A.61.QB    S.62.HB2  
assign (resid  103 and name HA  ) (resid  112 and name HG2#) 4.5 4.2 3.0 !pk.1142 # P.103.HA   I.112.QG2 
assign (resid   47 and name HG2#) (resid   51 and name HD# ) 3.5 4.7 3.8 !pk.1143 # I.47.QG2   K.51.QD   
assign (resid   43 and name HG2#) (resid  103 and name HA  ) 3.5 3.2 2.3 !pk.1144 # I.43.QG2   P.103.HA  
assign (resid   50 and name HA  ) (resid   50 and name HG1#) 3.5 2.7 1.8 !pk.1145 # I.50.HA    I.50.HG12 
assign (resid   62 and name HB# ) (resid   74 and name HN  ) 4.5 3.7 2.5 !pk.1150 # S.62.HB3   G.74.H    
assign (resid   92 and name HB# ) (resid   93 and name HN  ) 4.5 3.7 2.5 !pk.1150 # S.92.HB2   F.93.H    
assign (resid   62 and name HN  ) (resid   62 and name HB# ) 4.5 3.7 2.5 !pk.1154 # S.62.H     S.62.HB2  
assign (resid   92 and name HA  ) (resid   93 and name HD# ) 4.5 5.1 3.9 !pk.1155 # S.92.HA    F.93.QD   
assign (resid   79 and name HZ  ) (resid   92 and name HA  ) 4.5 3.2 2.0 !pk.1157 # F.79.HZ    S.92.HA   
assign (resid   91 and name HN  ) (resid   92 and name HA  ) 4.5 2.7 1.5 !pk.1157   A.91.H     S.92.HA   
assign (resid   62 and name HB# ) (resid   63 and name HN  ) 4.5 3.7 2.5 !pk.1159 # S.62.HB3   Q.63.H    
assign (resid   92 and name HA  ) (resid   92 and name HG  ) 3.5 1.7 0.8 !pk.1166   S.92.HA    S.92.HG   
assign (resid   62 and name HB# ) (resid   63 and name HG# ) 4.5 5.2 4.0 !pk.1170 # S.62.HB2   Q.63.HG3  
assign (resid   62 and name HB# ) (resid   73 and name HG# ) 4.5 5.2 4.0 !pk.1173 # S.62.HB2   R.73.QG   
assign (resid   62 and name HB# ) (resid   73 and name HG# ) 4.5 5.2 4.0 !pk.1174 # S.62.HB3   R.73.QG   
assign (resid   92 and name HB# ) (resid  113 and name HD1#) 4.5 5.2 4.0 !pk.1179 # S.92.HB3   I.113.QD1 
assign (resid   71 and name HN  ) (resid   71 and name HD# ) 4.5 4.2 3.0 !pk.1190 # K.71.H     K.71.QD   
assign (resid   81 and name HG# ) (resid   81 and name HH1#) 4.5 5.7 4.5 !pk.1191 # R.81.HG2   R.81.HH12 
assign (resid  104 and name HA  ) (resid  105 and name HD# ) 4.5 5.1 3.9 !pk.1192 # V.104.HA   F.105.QD  
assign (resid  105 and name HD# ) (resid  110 and name HG1#) 4.5 6.1 4.9 !pk.1200 # F.105.QD   I.110.HG12
assign (resid   36 and name HD# ) (resid  105 and name HD# ) 4.5 6.6 5.4 !pk.1201 # K.36.QD    F.105.QD  
assign (resid   71 and name HG# ) (resid   71 and name HD# ) 2.5 3.7 3.9 !pk.1202 # K.71.HG2   K.71.QD   
assign (resid   40 and name HD1#) (resid  105 and name HD# ) 4.5 6.6 5.4 !pk.1203 # L.40.QD1   F.105.QD  
assign (resid    9 and name HG2#) (resid   92 and name HB# ) 4.5 5.2 4.0 !pk.1206 # V.9.QG2    S.92.HB2  
assign (resid   57 and name HD# ) (resid   61 and name HN  ) 4.5 5.1 3.9 !pk.1208 # F.57.QD    A.61.H    
assign (resid   86 and name HA  ) (resid   86 and name HD# ) 4.5 4.2 3.0 !pk.1213 # K.86.HA    K.86.HD2  
assign (resid   86 and name HA  ) (resid   86 and name HD# ) 4.5 4.2 3.0 !pk.1214 # K.86.HA    K.86.HD3  
assign (resid   71 and name HA  ) (resid   71 and name HD# ) 4.5 4.2 3.0 !pk.1216 # K.71.HA    K.71.QD   
assign (resid   57 and name HD# ) (resid   58 and name HA  ) 3.5 4.1 3.2 !pk.1217 # F.57.QD    E.58.HA   
assign (resid   57 and name HA  ) (resid   57 and name HD# ) 3.5 4.1 3.2 !pk.1219 # F.57.HA    F.57.QD   
assign (resid   57 and name HD# ) (resid   58 and name HG# ) 3.5 5.6 4.7 !pk.1226 # F.57.QD    E.58.QG   
assign (resid   57 and name HD# ) (resid  100 and name HE# ) 4.5 6.6 5.4 !pk.1229 # F.57.QD    M.100.QE  
assign (resid   86 and name HB# ) (resid   86 and name HD# ) 4.5 5.2 4.0 !pk.1231 # K.86.HB3   K.86.HD2  
assign (resid   50 and name HG1#) (resid   57 and name HD# ) 4.5 6.1 4.9 !pk.1232 # I.50.HG13  F.57.QD   
assign (resid   57 and name HD# ) (resid   60 and name HB# ) 4.5 6.1 4.9 !pk.1234 # F.57.QD    L.60.HB2  
assign (resid   60 and name HB# ) (resid   64 and name HD# ) 4.5 6.1 4.9 !pk.1235 # L.60.HB2   F.64.QD   
assign (resid   63 and name HB# ) (resid   64 and name HD# ) 4.5 6.1 4.9 !pk.1236 # Q.63.HB2   F.64.QD   
assign (resid   57 and name HD# ) (resid   61 and name HB# ) 3.5 5.6 4.7 !pk.1237 # F.57.QD    A.61.QB   
assign (resid   50 and name HD1#) (resid   57 and name HD# ) 3.5 5.6 4.7 !pk.1238 # I.50.QD1   F.57.QD   
assign (resid   60 and name HD2#) (resid   64 and name HD# ) 3.5 5.6 4.7 !pk.1239 # L.60.QD2   F.64.QD   
assign (resid   57 and name HD# ) (resid  114 and name HD2#) 3.5 5.6 4.7 !pk.1241 # F.57.QD    L.114.QD2 
assign (resid   57 and name HD# ) (resid  114 and name HB# ) 4.5 6.1 4.9 !pk.1242 # F.57.QD    L.114.HB3 
assign (resid   47 and name HN  ) (resid   48 and name HB# ) 4.5 3.7 2.5 !pk.1244 # I.47.H     Q.48.HB2  
assign (resid   56 and name HN  ) (resid   59 and name HB# ) 4.5 3.7 2.5 !pk.1245 # D.56.H     S.59.HB2  
assign (resid   56 and name HN  ) (resid   59 and name HB# ) 4.5 3.7 2.5 !pk.1246 # D.56.H     S.59.HB3  
assign (resid   64 and name HN  ) (resid   64 and name HD# ) 4.5 5.1 3.9 !pk.1247 # F.64.H     F.64.QD   
assign (resid   59 and name HN  ) (resid   59 and name HB# ) 3.5 2.7 1.8 !pk.1248 # S.59.H     S.59.HB2  
assign (resid   59 and name HN  ) (resid   59 and name HB# ) 3.5 2.7 1.8 !pk.1249 # S.59.H     S.59.HB3  
assign (resid   59 and name HB# ) (resid   60 and name HN  ) 4.5 3.7 2.5 !pk.1250 # S.59.HB2   L.60.H    
assign (resid   44 and name HD2#) (resid  103 and name HG# ) 4.5 5.2 4.0 !pk.1251 # N.44.HD21  P.103.HG3 
assign (resid  103 and name HG# ) (resid  105 and name HE# ) 4.5 6.1 4.9 !pk.1251 # P.103.HG3  F.105.QE  
assign (resid  103 and name HG# ) (resid  105 and name HE# ) 4.5 6.1 4.9 !pk.1252 # P.103.HG2  F.105.QE  
assign (resid   44 and name HD2#) (resid  103 and name HG# ) 4.5 5.2 4.0 !pk.1254 # N.44.HD22  P.103.HG2 
assign (resid   44 and name HA  ) (resid  103 and name HG# ) 4.5 3.7 2.5 !pk.1255 # N.44.HA    P.103.HG3 
assign (resid  102 and name HA# ) (resid  103 and name HG# ) 4.5 4.7 3.5 !pk.1255 # G.102.HA2  P.103.HG3 
assign (resid  102 and name HA# ) (resid  103 and name HG# ) 4.5 4.7 3.5 !pk.1256 # G.102.HA2  P.103.HG2 
assign (resid   40 and name HA  ) (resid  103 and name HG# ) 4.5 3.7 2.5 !pk.1258 # L.40.HA    P.103.HG3 
assign (resid   56 and name HB# ) (resid   59 and name HB# ) 4.5 4.7 3.5 !pk.1262 # D.56.HB3   S.59.HB2  
assign (resid   69 and name HB# ) (resid   72 and name HB# ) 4.5 5.2 4.0 !pk.1267 # S.69.QB    A.72.QB   
assign (resid   40 and name HD1#) (resid  103 and name HG# ) 3.5 4.2 3.3 !pk.1268 # L.40.QD1   P.103.HG2 
assign (resid   40 and name HD1#) (resid  103 and name HG# ) 3.5 4.2 3.3 !pk.1269 # L.40.QD1   P.103.HG3 
assign (resid   43 and name HG2#) (resid  103 and name HG# ) 4.5 5.2 4.0 !pk.1270 # I.43.QG2   P.103.HG2 
assign (resid   43 and name HG2#) (resid  103 and name HG# ) 3.5 4.2 3.3 !pk.1271 # I.43.QG2   P.103.HG3 
assign (resid  103 and name HG# ) (resid  110 and name HG2#) 4.5 5.2 4.0 !pk.1273 # P.103.HG2  I.110.QG2 
assign (resid  103 and name HG# ) (resid  110 and name HG2#) 4.5 5.2 4.0 !pk.1274 # P.103.HG3  I.110.QG2 
assign (resid   14 and name HD1#) (resid   64 and name HD# ) 4.5 6.6 5.4 !pk.1275 # L.14.QD1   F.64.QD   
assign (resid  104 and name HN  ) (resid  112 and name HA  ) 4.5 2.7 1.5 !pk.1276   V.104.H    I.112.HA  
assign (resid   42 and name HN  ) (resid   43 and name HA  ) 4.5 2.7 1.5 !pk.1283   L.42.H     I.43.HA   
assign (resid   34 and name HN  ) (resid   34 and name HG# ) 4.5 4.2 3.0 !pk.1285 # R.34.H     R.34.HG3  
assign (resid   43 and name HA  ) (resid   46 and name HD# ) 3.5 4.1 3.2 !pk.1289 # I.43.HA    Y.46.QD   
assign (resid  101 and name HG  ) (resid  112 and name HA  ) 3.5 1.7 0.8 !pk.1291   S.101.HG   I.112.HA  
assign (resid   45 and name HA# ) (resid   48 and name HB# ) 3.5 3.7 2.8 !pk.1296 # G.45.QA    Q.48.HB2  
assign (resid    6 and name HD# ) (resid   93 and name HD# ) 4.5 6.1 4.9 !pk.1297 # P.6.QD     F.93.QD   
assign (resid   13 and name HB# ) (resid   88 and name HE# ) 4.5 6.1 4.9 !pk.1298 # H.13.HB2   F.88.QE   
assign (resid   21 and name HB# ) (resid   24 and name HA  ) 4.5 3.7 2.5 !pk.1299 # S.21.QB    P.24.HA   
assign (resid   13 and name HB# ) (resid   88 and name HE# ) 4.5 6.1 4.9 !pk.1300 # H.13.HB3   F.88.QE   
assign (resid   88 and name HE# ) (resid  111 and name HB# ) 4.5 6.1 4.9 !pk.1301 # F.88.QE    H.111.HB2 
assign (resid   88 and name HE# ) (resid  111 and name HB# ) 4.5 6.1 4.9 !pk.1303 # F.88.QE    H.111.HB3 
assign (resid   43 and name HA  ) (resid   46 and name HB# ) 4.5 3.7 2.5 !pk.1304 # I.43.HA    Y.46.HB3  
assign (resid    5 and name HG# ) (resid   93 and name HD# ) 4.5 6.6 5.4 !pk.1307 # E.5.QG     F.93.QD   
assign (resid   55 and name HG# ) (resid   59 and name HB# ) 4.5 5.2 4.0 !pk.1310 # E.55.QG    S.59.HB3  
assign (resid   58 and name HB# ) (resid   59 and name HB# ) 4.5 4.7 3.5 !pk.1310 # E.58.HB2   S.59.HB3  
assign (resid    6 and name HG# ) (resid   93 and name HD# ) 4.5 6.1 4.9 !pk.1312 # P.6.QG     F.93.QD   
assign (resid   17 and name HB# ) (resid   24 and name HA  ) 4.5 3.7 2.5 !pk.1314 # K.17.QB    P.24.HA   
assign (resid   88 and name HE# ) (resid  113 and name HG1#) 4.5 6.1 4.9 !pk.1315 # F.88.QE    I.113.HG12
assign (resid  112 and name HA  ) (resid  113 and name HG1#) 4.5 3.7 2.5 !pk.1316 # I.112.HA   I.113.HG12
assign (resid   24 and name HA  ) (resid   32 and name HB  ) 4.5 2.7 1.5 !pk.1317   P.24.HA    I.32.HB   
assign (resid  112 and name HA  ) (resid  112 and name HG2#) 3.5 3.2 2.3 !pk.1318 # I.112.HA   I.112.QG2 
assign (resid   43 and name HA  ) (resid  112 and name HD1#) 3.5 3.2 2.3 !pk.1319 # I.43.HA    I.112.QD1 
assign (resid   43 and name HD1#) (resid  112 and name HA  ) 4.5 4.2 3.0 !pk.1320 # I.43.QD1   I.112.HA  
assign (resid   43 and name HA  ) (resid   43 and name HD1#) 3.5 3.2 2.3 !pk.1321 # I.43.HA    I.43.QD1  
assign (resid  110 and name HG2#) (resid  112 and name HA  ) 4.5 4.2 3.0 !pk.1325 # I.110.QG2  I.112.HA  
assign (resid  112 and name HA  ) (resid  113 and name HG1#) 4.5 3.7 2.5 !pk.1325 # I.112.HA   I.113.HG13
assign (resid    9 and name HG1#) (resid   93 and name HD# ) 4.5 6.6 5.4 !pk.1327 # V.9.QG1    F.93.QD   
assign (resid    9 and name HG2#) (resid   93 and name HD# ) 4.5 6.6 5.4 !pk.1329 # V.9.QG2    F.93.QD   
assign (resid   96 and name HN  ) (resid   96 and name HG# ) 3.5 3.2 2.3 !pk.1330 # R.96.H     R.96.QG   
assign (resid   88 and name HE# ) (resid  113 and name HG1#) 4.5 6.1 4.9 !pk.1338 # F.88.QE    I.113.HG13
assign (resid   88 and name HZ  ) (resid  113 and name HG1#) 4.5 4.2 3.0 !pk.1339 # F.88.HZ    I.113.HG13
assign (resid  101 and name HG  ) (resid  113 and name HG1#) 4.5 3.7 2.5 !pk.1340 # S.101.HG   I.113.HG12
assign (resid   46 and name HA  ) (resid   46 and name HD# ) 3.5 4.1 3.2 !pk.1342 # Y.46.HA    Y.46.QD   
assign (resid   13 and name HB# ) (resid  113 and name HG1#) 4.5 4.7 3.5 !pk.1346 # H.13.HB2   I.113.HG13
assign (resid   13 and name HB# ) (resid  113 and name HG1#) 4.5 4.7 3.5 !pk.1347 # H.13.HB3   I.113.HG13
assign (resid   11 and name HB# ) (resid  113 and name HG1#) 4.5 4.7 3.5 !pk.1350 # C.11.HB2   I.113.HG13
assign (resid   92 and name HG  ) (resid  113 and name HG1#) 4.5 3.7 2.5 !pk.1350 # S.92.HG    I.113.HG13
assign (resid  111 and name HB# ) (resid  113 and name HG1#) 4.5 4.7 3.5 !pk.1350 # H.111.HB2  I.113.HG13
assign (resid  111 and name HB# ) (resid  113 and name HG1#) 4.5 4.7 3.5 !pk.1351 # H.111.HB3  I.113.HG12
assign (resid   11 and name HB# ) (resid  113 and name HG1#) 4.5 4.7 3.5 !pk.1352 # C.11.HB3   I.113.HG13
assign (resid  111 and name HB# ) (resid  113 and name HG1#) 4.5 4.7 3.5 !pk.1352 # H.111.HB3  I.113.HG13
assign (resid   46 and name HD# ) (resid   49 and name HB# ) 4.5 6.1 4.9 !pk.1354 # Y.46.QD    K.49.HB2  
assign (resid   96 and name HB# ) (resid   96 and name HG# ) 2.5 3.2 3.4 !pk.1355 # R.96.HB2   R.96.QG   
assign (resid   46 and name HD# ) (resid   49 and name HD# ) 4.5 6.6 5.4 !pk.1356 # Y.46.QD    K.49.HD3  
assign (resid   96 and name HB# ) (resid   96 and name HG# ) 3.5 4.2 3.3 !pk.1357 # R.96.HB3   R.96.QG   
assign (resid   46 and name HD# ) (resid  112 and name HD1#) 3.5 5.6 4.7 !pk.1359 # Y.46.QD    I.112.QD1 
assign (resid   15 and name HB# ) (resid   17 and name HG# ) 4.5 5.2 4.0 !pk.1360 # L.15.HB3   K.17.QG   
assign (resid   46 and name HD# ) (resid   60 and name HD1#) 3.5 5.6 4.7 !pk.1362 # Y.46.QD    L.60.QD1  
assign (resid    6 and name HG# ) (resid   93 and name HE# ) 4.5 6.1 4.9 !pk.1376 # P.6.QG     F.93.QE   
assign (resid   19 and name HA  ) (resid   24 and name HB# ) 4.5 3.7 2.5 !pk.1381 # S.19.HA    P.24.HB2  
assign (resid   36 and name HE# ) (resid  105 and name HE# ) 4.5 6.6 5.4 !pk.1388 # K.36.QE    F.105.QE  
assign (resid   89 and name HB# ) (resid   93 and name HE# ) 4.5 6.1 4.9 !pk.1390 # E.89.QB    F.93.QE   
assign (resid   58 and name HB# ) (resid   73 and name HG# ) 3.5 4.2 3.3 !pk.1394 # E.58.HB3   R.73.QG   
assign (resid   43 and name HG1#) (resid  112 and name HG1#) 4.5 4.7 3.5 !pk.1397 # I.43.HG13  I.112.HG12
assign (resid  103 and name HB# ) (resid  105 and name HE# ) 4.5 6.1 4.9 !pk.1399 # P.103.HB3  F.105.QE  
assign (resid  105 and name HE# ) (resid  110 and name HG1#) 4.5 6.1 4.9 !pk.1399 # F.105.QE   I.110.HG12
assign (resid   36 and name HD# ) (resid  105 and name HE# ) 4.5 6.6 5.4 !pk.1401 # K.36.QD    F.105.QE  
assign (resid   24 and name HB# ) (resid   32 and name HB  ) 4.5 3.7 2.5 !pk.1402 # P.24.HB2   I.32.HB   
assign (resid   40 and name HD1#) (resid  105 and name HE# ) 4.5 6.6 5.4 !pk.1404 # L.40.QD1   F.105.QE  
assign (resid  116 and name HA  ) (resid  116 and name HG2#) 3.5 3.2 2.3 !pk.1405 # T.116.HA   T.116.QG2 
assign (resid   15 and name HD2#) (resid   17 and name HG# ) 3.5 4.7 3.8 !pk.1408 # L.15.QD2   K.17.QG   
assign (resid   43 and name HG1#) (resid  110 and name HG2#) 4.5 5.2 4.0 !pk.1410 # I.43.HG12  I.110.QG2 
assign (resid    9 and name HG2#) (resid   93 and name HE# ) 4.5 6.6 5.4 !pk.1414 # V.9.QG2    F.93.QE   
assign (resid   15 and name HN  ) (resid   15 and name HD2#) 4.5 4.2 3.0 !pk.1418 # L.15.H     L.15.QD2  
assign (resid   27 and name HB# ) (resid   27 and name HE3 ) 4.5 4.2 3.0 !pk.1420 # W.27.HB3   W.27.HE3  
assign (resid   60 and name HA  ) (resid   64 and name HE# ) 4.5 5.1 3.9 !pk.1424 # L.60.HA    F.64.QE   
assign (resid  104 and name HA  ) (resid  105 and name HB# ) 4.5 3.7 2.5 !pk.1428 # V.104.HA   F.105.QB  
assign (resid   91 and name HB# ) (resid  104 and name HA  ) 4.5 4.2 3.0 !pk.1432 # A.91.QB    V.104.HA  
assign (resid   24 and name HB# ) (resid   32 and name HG1#) 4.5 4.7 3.5 !pk.1433 # P.24.HB3   I.32.HG12 
assign (resid   16 and name HG2#) (resid   43 and name HG1#) 3.5 4.2 3.3 !pk.1434 # V.16.QG2   I.43.HG12 
assign (resid   15 and name HB# ) (resid   15 and name HD2#) 3.5 4.2 3.3 !pk.1435 # L.15.HB3   L.15.QD2  
assign (resid  112 and name HN  ) (resid  112 and name HG1#) 4.5 3.7 2.5 !pk.1444 # I.112.H    I.112.HG12
assign (resid  114 and name HG  ) (resid  115 and name HN  ) 4.5 2.7 1.5 !pk.1446   L.114.HG   R.115.H   
assign (resid   32 and name HN  ) (resid   32 and name HG1#) 4.5 3.7 2.5 !pk.1450 # I.32.H     I.32.HG12 
assign (resid   32 and name HN  ) (resid   32 and name HG1#) 4.5 3.7 2.5 !pk.1451 # I.32.H     I.32.HG13 
assign (resid   15 and name HD2#) (resid  111 and name HE1 ) 4.5 4.7 3.5 !pk.1452 # L.15.QD2   H.111.HE1 
assign (resid   93 and name HA  ) (resid   93 and name HD# ) 3.5 4.1 3.2 !pk.1454 # F.93.HA    F.93.QD   
assign (resid  105 and name HD# ) (resid  110 and name HG1#) 4.5 6.1 4.9 !pk.1455 # F.105.QD   I.110.HG13
assign (resid   40 and name HG  ) (resid   44 and name HD2#) 4.5 4.2 3.0 !pk.1456 # L.40.HG    N.44.HD21 
assign (resid   88 and name HN  ) (resid   88 and name HD# ) 4.5 5.1 3.9 !pk.1458 # F.88.H     F.88.QD   
assign (resid   57 and name HE# ) (resid  112 and name HG1#) 4.5 6.1 4.9 !pk.1460 # F.57.QE    I.112.HG12
assign (resid   40 and name HG  ) (resid   44 and name HD2#) 4.5 4.2 3.0 !pk.1462 # L.40.HG    N.44.HD22 
assign (resid   24 and name HA  ) (resid   32 and name HG1#) 4.5 3.7 2.5 !pk.1466 # P.24.HA    I.32.HG12 
assign (resid   25 and name HA  ) (resid   32 and name HG1#) 4.5 3.7 2.5 !pk.1466 # S.25.HA    I.32.HG12 
assign (resid   24 and name HA  ) (resid   32 and name HG1#) 4.5 3.7 2.5 !pk.1467 # P.24.HA    I.32.HG13 
assign (resid   25 and name HA  ) (resid   32 and name HG1#) 4.5 3.7 2.5 !pk.1467 # S.25.HA    I.32.HG13 
assign (resid   10 and name HG# ) (resid   77 and name HA# ) 4.5 5.2 4.0 !pk.1468 # R.10.HG2   G.77.HA2  
assign (resid   88 and name HD# ) (resid   89 and name HA  ) 4.5 5.1 3.9 !pk.1471 # F.88.QD    E.89.HA   
assign (resid   32 and name HA  ) (resid   32 and name HG1#) 4.5 3.7 2.5 !pk.1474 # I.32.HA    I.32.HG12 
assign (resid   32 and name HA  ) (resid   32 and name HG1#) 4.5 3.7 2.5 !pk.1475 # I.32.HA    I.32.HG13 
assign (resid   10 and name HG# ) (resid   77 and name HA# ) 4.5 5.2 4.0 !pk.1476 # R.10.HG3   G.77.HA3  
assign (resid   73 and name HB# ) (resid   73 and name HD# ) 4.5 5.2 4.0 !pk.1479 # R.73.HB3   R.73.HD3  
assign (resid   88 and name HD# ) (resid   92 and name HG  ) 4.5 5.1 3.9 !pk.1481 # F.88.QD    S.92.HG   
assign (resid   88 and name HD# ) (resid  104 and name HB  ) 4.5 5.1 3.9 !pk.1489 # F.88.QD    V.104.HB  
assign (resid   14 and name HB# ) (resid  112 and name HG1#) 4.5 4.7 3.5 !pk.1493 # L.14.HB2   I.112.HG13
assign (resid   14 and name HD2#) (resid  112 and name HG1#) 4.5 5.2 4.0 !pk.1500 # L.14.QD2   I.112.HG12
assign (resid  110 and name HG2#) (resid  110 and name HG1#) 4.5 5.2 4.0 !pk.1501 # I.110.QG2  I.110.HG12
assign (resid   14 and name HD1#) (resid  112 and name HG1#) 4.5 5.2 4.0 !pk.1503 # L.14.QD1   I.112.HG13
assign (resid    9 and name HG1#) (resid   93 and name HA  ) 4.5 4.2 3.0 !pk.1504 # V.9.QG1    F.93.HA   
assign (resid    9 and name HG2#) (resid   93 and name HA  ) 4.5 4.2 3.0 !pk.1506 # V.9.QG2    F.93.HA   
assign (resid    8 and name HG# ) (resid   79 and name HN  ) 4.5 4.2 3.0 !pk.1507 # R.8.QG     F.79.H    
assign (resid   60 and name HD1#) (resid   61 and name HN  ) 4.5 4.2 3.0 !pk.1508 # L.60.QD1   A.61.H    
assign (resid  110 and name HN  ) (resid  110 and name HG1#) 4.5 3.7 2.5 !pk.1510 # I.110.H    I.110.HG12
assign (resid   10 and name HN  ) (resid   10 and name HG# ) 4.5 4.2 3.0 !pk.1511 # R.10.H     R.10.HG3  
assign (resid   10 and name HN  ) (resid   10 and name HG# ) 4.5 4.2 3.0 !pk.1512 # R.10.H     R.10.HG2  
assign (resid   14 and name HD1#) (resid   64 and name HN  ) 4.5 4.2 3.0 !pk.1514 # L.14.QD1   F.64.H    
assign (resid   50 and name HN  ) (resid   60 and name HD1#) 4.5 4.2 3.0 !pk.1516 # I.50.H     L.60.QD1  
assign (resid    8 and name HG# ) (resid    9 and name HN  ) 4.5 4.2 3.0 !pk.1518 # R.8.QG     V.9.H     
assign (resid    8 and name HN  ) (resid    8 and name HG# ) 4.5 4.2 3.0 !pk.1520 # R.8.H      R.8.QG    
assign (resid   14 and name HD1#) (resid   62 and name HN  ) 4.5 4.2 3.0 !pk.1521 # L.14.QD1   S.62.H    
assign (resid   13 and name HD2 ) (resid   76 and name HG  ) 4.5 3.2 2.0 !pk.1525 # H.13.HD2   L.76.HG   
assign (resid   10 and name HG# ) (resid   11 and name HN  ) 4.5 4.2 3.0 !pk.1526 # R.10.HG3   C.11.H    
assign (resid   60 and name HD1#) (resid   64 and name HD# ) 4.5 6.6 5.4 !pk.1527 # L.60.QD1   F.64.QD   
assign (resid   14 and name HD1#) (resid   57 and name HZ  ) 4.5 4.7 3.5 !pk.1528 # L.14.QD1   F.57.HZ   
assign (resid   14 and name HD1#) (resid   46 and name HD# ) 4.5 6.6 5.4 !pk.1530 # L.14.QD1   Y.46.QD   
assign (resid   18 and name HD2 ) (resid  110 and name HG1#) 4.5 4.2 3.0 !pk.1531 # H.18.HD2   I.110.HG13
assign (resid    8 and name HA  ) (resid    8 and name HG# ) 4.5 4.2 3.0 !pk.1534 # R.8.HA     R.8.QG    
assign (resid   14 and name HD1#) (resid   46 and name HA  ) 4.5 4.2 3.0 !pk.1536 # L.14.QD1   Y.46.HA   
assign (resid   14 and name HD1#) (resid   74 and name HA# ) 4.5 5.2 4.0 !pk.1536 # L.14.QD1   G.74.HA2  
assign (resid   46 and name HA  ) (resid   60 and name HD1#) 4.5 4.2 3.0 !pk.1537 # Y.46.HA    L.60.QD1  
assign (resid   32 and name HA  ) (resid   33 and name HA  ) 4.5 2.7 1.5 !pk.1538   I.32.HA    T.33.HA   
assign (resid   10 and name HG# ) (resid   77 and name HA# ) 4.5 5.2 4.0 !pk.1539 # R.10.HG3   G.77.HA2  
assign (resid   14 and name HA  ) (resid   14 and name HD1#) 4.5 4.2 3.0 !pk.1541 # L.14.HA    L.14.QD1  
assign (resid   14 and name HD1#) (resid   61 and name HA  ) 3.5 3.2 2.3 !pk.1543 # L.14.QD1   A.61.HA   
assign (resid   57 and name HA  ) (resid   60 and name HD1#) 4.5 4.2 3.0 !pk.1544 # F.57.HA    L.60.QD1  
assign (resid   46 and name HB# ) (resid   60 and name HD1#) 4.5 5.2 4.0 !pk.1546 # Y.46.HB2   L.60.QD1  
assign (resid   14 and name HD1#) (resid   46 and name HB# ) 4.5 5.2 4.0 !pk.1547 # L.14.QD1   Y.46.HB2  
assign (resid   57 and name HE# ) (resid  100 and name HG# ) 4.5 6.6 5.4 !pk.1548 # F.57.QE    M.100.HG2 
assign (resid   46 and name HB# ) (resid   60 and name HD1#) 3.5 4.2 3.3 !pk.1551 # Y.46.HB3   L.60.QD1  
assign (resid   14 and name HD1#) (resid   46 and name HB# ) 4.5 5.2 4.0 !pk.1552 # L.14.QD1   Y.46.HB3  
assign (resid   36 and name HE# ) (resid  110 and name HG1#) 4.5 5.2 4.0 !pk.1553 # K.36.QE    I.110.HG12
assign (resid   55 and name HG# ) (resid   60 and name HD1#) 4.5 5.7 4.5 !pk.1554 # E.55.QG    L.60.QD1  
assign (resid   14 and name HD1#) (resid   64 and name HB# ) 4.5 5.2 4.0 !pk.1555 # L.14.QD1   F.64.HB3  
assign (resid   49 and name HB# ) (resid   60 and name HD1#) 3.5 4.2 3.3 !pk.1556 # K.49.HB2   L.60.QD1  
assign (resid   50 and name HG1#) (resid   60 and name HD1#) 4.5 5.2 4.0 !pk.1558 # I.50.HG13  L.60.QD1  
assign (resid   14 and name HB# ) (resid   14 and name HD1#) 3.5 4.2 3.3 !pk.1562 # L.14.HB2   L.14.QD1  
assign (resid   14 and name HD1#) (resid   60 and name HB# ) 3.5 4.2 3.3 !pk.1562 # L.14.QD1   L.60.HB2  
assign (resid   88 and name HD# ) (resid  106 and name HG2#) 4.5 6.6 5.4 !pk.1564 # F.88.QD    T.106.QG2 
assign (resid   14 and name HB# ) (resid   14 and name HD1#) 3.5 4.2 3.3 !pk.1568 # L.14.HB3   L.14.QD1  
assign (resid   14 and name HD1#) (resid   60 and name HB# ) 3.5 4.2 3.3 !pk.1569 # L.14.QD1   L.60.HB3  
assign (resid   76 and name HN  ) (resid   76 and name HD1#) 4.5 4.2 3.0 !pk.1574 # L.76.H     L.76.QD1  
assign (resid   60 and name HN  ) (resid   60 and name HD1#) 3.5 3.2 2.3 !pk.1577 # L.60.H     L.60.QD1  
assign (resid   13 and name HD2 ) (resid   76 and name HD1#) 4.5 4.7 3.5 !pk.1579 # H.13.HD2   L.76.QD1  
assign (resid   76 and name HD1#) (resid   79 and name HD# ) 4.5 6.6 5.4 !pk.1579 # L.76.QD1   F.79.QD   
assign (resid   76 and name HD1#) (resid   88 and name HE# ) 4.5 6.6 5.4 !pk.1580 # L.76.QD1   F.88.QE   
assign (resid   13 and name HA  ) (resid   57 and name HE# ) 4.5 5.1 3.9 !pk.1582 # H.13.HA    F.57.QE   
assign (resid   76 and name HA  ) (resid   76 and name HD1#) 4.5 4.2 3.0 !pk.1584 # L.76.HA    L.76.QD1  
assign (resid   19 and name HA  ) (resid   33 and name HA  ) 4.5 2.7 1.5 !pk.1585   S.19.HA    T.33.HA   
assign (resid   22 and name HA  ) (resid   22 and name HG# ) 3.5 3.2 2.3 !pk.1586 # R.22.HA    R.22.QG   
assign (resid   60 and name HA  ) (resid   60 and name HD1#) 4.5 4.2 3.0 !pk.1587 # L.60.HA    L.60.QD1  
assign (resid   19 and name HB# ) (resid   33 and name HA  ) 4.5 3.7 2.5 !pk.1591 # S.19.HB3   T.33.HA   
assign (resid   76 and name HB# ) (resid   76 and name HD1#) 3.5 4.2 3.3 !pk.1599 # L.76.HB3   L.76.QD1  
assign (resid   55 and name HB# ) (resid   60 and name HD1#) 3.5 4.2 3.3 !pk.1600 # E.55.HB2   L.60.QD1  
assign (resid   88 and name HA  ) (resid  104 and name HB  ) 4.5 2.7 1.5 !pk.1602   F.88.HA    V.104.HB  
assign (resid   40 and name HG  ) (resid  105 and name HZ  ) 4.5 3.2 2.0 !pk.1604 # L.40.HG    F.105.HZ  
assign (resid   79 and name HE# ) (resid   84 and name HB# ) 4.5 6.1 4.9 !pk.1604 # F.79.QE    M.84.HB3  
assign (resid   31 and name HB# ) (resid   32 and name HA  ) 4.5 3.7 2.5 !pk.1605 # K.31.QB    I.32.HA   
assign (resid   32 and name HA  ) (resid   34 and name HG# ) 4.5 4.2 3.0 !pk.1605 # I.32.HA    R.34.HG2  
assign (resid   76 and name HB# ) (resid   76 and name HD1#) 3.5 4.2 3.3 !pk.1607 # L.76.HB2   L.76.QD1  
assign (resid   14 and name HB# ) (resid   57 and name HE# ) 4.5 6.1 4.9 !pk.1608 # L.14.HB2   F.57.QE   
assign (resid   95 and name HD1#) (resid  113 and name HB  ) 3.5 3.2 2.3 !pk.1609 # L.95.QD1   I.113.HB  
assign (resid   50 and name HD1#) (resid   57 and name HE# ) 4.5 6.6 5.4 !pk.1612 # I.50.QD1   F.57.QE   
assign (resid  105 and name HZ  ) (resid  110 and name HD1#) 4.5 4.7 3.5 !pk.1613 # F.105.HZ   I.110.QD1 
assign (resid   14 and name HD1#) (resid   60 and name HD1#) 4.5 5.7 4.5 !pk.1619 # L.14.QD1   L.60.QD1  
assign (resid   51 and name HN  ) (resid   51 and name HG# ) 3.5 3.2 2.3 !pk.1622 # K.51.H     K.51.HG2  
assign (resid   95 and name HD1#) (resid  114 and name HN  ) 4.5 4.2 3.0 !pk.1627 # L.95.QD1   L.114.H   
assign (resid    9 and name HN  ) (resid   93 and name HZ  ) 4.5 3.2 2.0 !pk.1630 # V.9.H      F.93.HZ   
assign (resid   37 and name HA  ) (resid   41 and name HN  ) 4.5 2.7 1.5 !pk.1631   E.37.HA    E.41.H    
assign (resid   58 and name HA  ) (resid   60 and name HN  ) 4.5 2.7 1.5 !pk.1631   E.58.HA    L.60.H    
assign (resid   58 and name HA  ) (resid   62 and name HN  ) 4.5 2.7 1.5 !pk.1631   E.58.HA    S.62.H    
assign (resid   95 and name HN  ) (resid   95 and name HD1#) 4.5 4.2 3.0 !pk.1635 # L.95.H     L.95.QD1  
assign (resid   79 and name HE# ) (resid   88 and name HE# ) 4.5 7.5 6.3 !pk.1636 # F.79.QE    F.88.QE   
assign (resid   79 and name HZ  ) (resid   88 and name HE# ) 4.5 5.6 4.4 !pk.1637 # F.79.HZ    F.88.QE   
assign (resid   46 and name HD# ) (resid   49 and name HG# ) 4.5 6.6 5.4 !pk.1638 # Y.46.QD    K.49.HG3  
assign (resid   88 and name HA  ) (resid   88 and name HD# ) 4.5 5.1 3.9 !pk.1639 # F.88.HA    F.88.QD   
assign (resid    8 and name HA  ) (resid   93 and name HZ  ) 4.5 3.2 2.0 !pk.1642 # R.8.HA     F.93.HZ   
assign (resid   95 and name HD1#) (resid  101 and name HB# ) 4.5 5.2 4.0 !pk.1643 # L.95.QD1   S.101.HB2 
assign (resid   51 and name HA  ) (resid   51 and name HG# ) 3.5 3.2 2.3 !pk.1645 # K.51.HA    K.51.HG3  
assign (resid   79 and name HE# ) (resid   89 and name HA  ) 4.5 5.1 3.9 !pk.1646 # F.79.QE    E.89.HA   
assign (resid   92 and name HB# ) (resid   95 and name HD1#) 4.5 5.2 4.0 !pk.1648 # S.92.HB2   L.95.QD1  
assign (resid   57 and name HA  ) (resid  114 and name HD2#) 4.5 4.2 3.0 !pk.1649 # F.57.HA    L.114.QD2 
assign (resid   79 and name HE# ) (resid   92 and name HB# ) 4.5 6.1 4.9 !pk.1650 # F.79.QE    S.92.HB3  
assign (resid   79 and name HZ  ) (resid   92 and name HB# ) 4.5 4.2 3.0 !pk.1651 # F.79.HZ    S.92.HB3  
assign (resid   79 and name HZ  ) (resid   92 and name HG  ) 4.5 3.2 2.0 !pk.1652 # F.79.HZ    S.92.HG   
assign (resid   79 and name HE# ) (resid   92 and name HG  ) 4.5 5.1 3.9 !pk.1653 # F.79.QE    S.92.HG   
assign (resid   11 and name HB# ) (resid   95 and name HD1#) 4.5 5.2 4.0 !pk.1654 # C.11.HB2   L.95.QD1  
assign (resid   51 and name HG# ) (resid   51 and name HE# ) 3.5 4.7 3.8 !pk.1655 # K.51.HG3   K.51.QE   
assign (resid   11 and name HB# ) (resid   79 and name HE# ) 4.5 6.1 4.9 !pk.1656 # C.11.HB3   F.79.QE   
assign (resid   11 and name HB# ) (resid   79 and name HZ  ) 4.5 4.2 3.0 !pk.1657 # C.11.HB3   F.79.HZ   
assign (resid   11 and name HB# ) (resid   95 and name HD1#) 4.5 5.2 4.0 !pk.1658 # C.11.HB3   L.95.QD1  
assign (resid   58 and name HA  ) (resid   58 and name HG# ) 3.5 3.2 2.3 !pk.1659 # E.58.HA    E.58.QG   
assign (resid   37 and name HA  ) (resid   37 and name HG# ) 3.5 3.2 2.3 !pk.1662 # E.37.HA    E.37.HG3  
assign (resid   76 and name HB# ) (resid   79 and name HZ  ) 4.5 4.2 3.0 !pk.1665 # L.76.HB3   F.79.HZ   
assign (resid   40 and name HB# ) (resid  105 and name HZ  ) 4.5 4.2 3.0 !pk.1669 # L.40.HB3   F.105.HZ  
assign (resid   37 and name HA  ) (resid   40 and name HB# ) 3.5 2.7 1.8 !pk.1670 # E.37.HA    L.40.HB3  
assign (resid   88 and name HA  ) (resid   91 and name HB# ) 3.5 3.2 2.3 !pk.1671 # F.88.HA    A.91.QB   
assign (resid   49 and name HG# ) (resid   55 and name HB# ) 4.5 5.2 4.0 !pk.1672 # K.49.HG3   E.55.HB3  
assign (resid   33 and name HA  ) (resid   33 and name HG2#) 3.5 3.2 2.3 !pk.1674 # T.33.HA    T.33.QG2  
assign (resid   58 and name HA  ) (resid   61 and name HB# ) 3.5 3.2 2.3 !pk.1675 # E.58.HA    A.61.QB   
assign (resid   37 and name HA  ) (resid  110 and name HD1#) 4.5 4.2 3.0 !pk.1677 # E.37.HA    I.110.QD1 
assign (resid   76 and name HD1#) (resid   79 and name HZ  ) 4.5 4.7 3.5 !pk.1678 # L.76.QD1   F.79.HZ   
assign (resid   95 and name HD1#) (resid  113 and name HD1#) 4.5 5.7 4.5 !pk.1679 # L.95.QD1   I.113.QD1 
assign (resid    9 and name HG2#) (resid   79 and name HE# ) 4.5 6.6 5.4 !pk.1680 # V.9.QG2    F.79.QE   
assign (resid   57 and name HN  ) (resid  114 and name HD2#) 4.5 4.2 3.0 !pk.1683 # F.57.H     L.114.QD2 
assign (resid   36 and name HA  ) (resid   40 and name HN  ) 4.5 2.7 1.5 !pk.1688   K.36.HA    L.40.H    
assign (resid   40 and name HN  ) (resid   40 and name HD2#) 4.5 4.2 3.0 !pk.1689 # L.40.H     L.40.QD2  
assign (resid   49 and name HN  ) (resid   49 and name HG# ) 4.5 4.2 3.0 !pk.1691 # K.49.H     K.49.HG3  
assign (resid   40 and name HD2#) (resid   41 and name HN  ) 4.5 4.2 3.0 !pk.1694 # L.40.QD2   E.41.H    
assign (resid   89 and name HA  ) (resid   93 and name HD# ) 4.5 5.1 3.9 !pk.1695 # E.89.HA    F.93.QD   
assign (resid   40 and name HD2#) (resid   44 and name HD2#) 4.5 5.7 4.5 !pk.1696 # L.40.QD2   N.44.HD21 
assign (resid   40 and name HD2#) (resid  105 and name HZ  ) 4.5 4.7 3.5 !pk.1696 # L.40.QD2   F.105.HZ  
assign (resid   89 and name HA  ) (resid   91 and name HN  ) 4.5 2.7 1.5 !pk.1697   E.89.HA    A.91.H    
assign (resid   40 and name HD2#) (resid   44 and name HD2#) 4.5 5.7 4.5 !pk.1700 # L.40.QD2   N.44.HD22 
assign (resid   46 and name HA  ) (resid   49 and name HG# ) 4.5 4.2 3.0 !pk.1704 # Y.46.HA    K.49.HG2  
assign (resid   46 and name HA  ) (resid   49 and name HG# ) 4.5 4.2 3.0 !pk.1705 # Y.46.HA    K.49.HG3  
assign (resid  114 and name HD2#) (resid  116 and name HB  ) 4.5 4.2 3.0 !pk.1706 # L.114.QD2  T.116.HB  
assign (resid   49 and name HA  ) (resid   49 and name HG# ) 3.5 3.2 2.3 !pk.1707 # K.49.HA    K.49.HG2  
assign (resid   49 and name HA  ) (resid   49 and name HG# ) 3.5 3.2 2.3 !pk.1708 # K.49.HA    K.49.HG3  
assign (resid   12 and name HB# ) (resid  114 and name HD2#) 4.5 5.2 4.0 !pk.1709 # S.12.HB2   L.114.QD2 
assign (resid   37 and name HA  ) (resid   40 and name HD2#) 4.5 4.2 3.0 !pk.1710 # E.37.HA    L.40.QD2  
assign (resid   40 and name HA  ) (resid   40 and name HD2#) 4.5 4.2 3.0 !pk.1710 # L.40.HA    L.40.QD2  
assign (resid   89 and name HA  ) (resid   92 and name HB# ) 4.5 3.7 2.5 !pk.1713 # E.89.HA    S.92.HB3  
assign (resid   18 and name HB# ) (resid   36 and name HA  ) 4.5 3.7 2.5 !pk.1715 # H.18.HB2   K.36.HA   
assign (resid   89 and name HA  ) (resid   92 and name HG  ) 4.5 2.7 1.5 !pk.1716   E.89.HA    S.92.HG   
assign (resid   57 and name HB# ) (resid  114 and name HD2#) 3.5 4.2 3.3 !pk.1717 # F.57.HB2   L.114.QD2 
assign (resid   49 and name HG# ) (resid   49 and name HE# ) 4.5 5.7 4.5 !pk.1718 # K.49.HG2   K.49.QE   
assign (resid   51 and name HG# ) (resid   51 and name HE# ) 4.5 5.7 4.5 !pk.1718 # K.51.HG2   K.51.QE   
assign (resid   18 and name HB# ) (resid   36 and name HA  ) 4.5 3.7 2.5 !pk.1720 # H.18.HB3   K.36.HA   
assign (resid   58 and name HG# ) (resid  114 and name HD2#) 4.5 5.7 4.5 !pk.1722 # E.58.QG    L.114.QD2 
assign (resid   40 and name HD2#) (resid  103 and name HG# ) 4.5 5.2 4.0 !pk.1725 # L.40.QD2   P.103.HG2 
assign (resid   51 and name HG# ) (resid  100 and name HE# ) 3.5 4.7 3.8 !pk.1726 # K.51.HG2   M.100.QE  
assign (resid   40 and name HB# ) (resid   40 and name HD2#) 3.5 4.2 3.3 !pk.1729 # L.40.HB2   L.40.QD2  
assign (resid   40 and name HB# ) (resid   40 and name HD2#) 3.5 4.2 3.3 !pk.1731 # L.40.HB3   L.40.QD2  
assign (resid   36 and name HA  ) (resid   39 and name HB# ) 3.5 3.2 2.3 !pk.1732 # K.36.HA    A.39.QB   
assign (resid   36 and name HA  ) (resid   36 and name HG# ) 3.5 3.2 2.3 !pk.1737 # K.36.HA    K.36.HG3  
assign (resid   40 and name HD2#) (resid  110 and name HD1#) 4.5 5.7 4.5 !pk.1738 # L.40.QD2   I.110.QD1 
assign (resid   42 and name HA  ) (resid   42 and name HD1#) 4.5 4.2 3.0 !pk.1748 # L.42.HA    L.42.QD1  
assign (resid   13 and name HB# ) (resid   88 and name HZ  ) 4.5 4.2 3.0 !pk.1749 # H.13.HB2   F.88.HZ   
assign (resid   13 and name HB# ) (resid   88 and name HZ  ) 4.5 4.2 3.0 !pk.1750 # H.13.HB3   F.88.HZ   
assign (resid   94 and name HB# ) (resid   95 and name HG  ) 4.5 4.2 3.0 !pk.1752 # A.94.QB    L.95.HG   
assign (resid   88 and name HZ  ) (resid  113 and name HG1#) 4.5 4.2 3.0 !pk.1753 # F.88.HZ    I.113.HG12
assign (resid   76 and name HD1#) (resid   88 and name HZ  ) 3.5 3.7 2.8 !pk.1758 # L.76.QD1   F.88.HZ   
assign (resid   88 and name HZ  ) (resid  113 and name HD1#) 4.5 4.7 3.5 !pk.1759 # F.88.HZ    I.113.QD1 
assign (resid   42 and name HN  ) (resid   42 and name HD1#) 4.5 4.2 3.0 !pk.1761 # L.42.H     L.42.QD1  
assign (resid   42 and name HD1#) (resid   46 and name HE# ) 4.5 6.6 5.4 !pk.1763 # L.42.QD1   Y.46.QE   
assign (resid   39 and name HA  ) (resid   42 and name HD1#) 3.5 3.2 2.3 !pk.1764 # A.39.HA    L.42.QD1  
assign (resid   34 and name HD# ) (resid   42 and name HD1#) 3.5 4.7 3.8 !pk.1766 # R.34.HD2   L.42.QD1  
assign (resid   87 and name HG# ) (resid  106 and name HA  ) 4.5 3.7 2.5 !pk.1767 # P.87.HG2   T.106.HA  
assign (resid   87 and name HG# ) (resid  106 and name HA  ) 4.5 3.7 2.5 !pk.1767 # P.87.HG3   T.106.HA  
assign (resid   42 and name HB# ) (resid   42 and name HD1#) 3.5 4.2 3.3 !pk.1768 # L.42.HB2   L.42.QD1  
assign (resid   16 and name HG1#) (resid   42 and name HD1#) 3.5 4.7 3.8 !pk.1771 # V.16.QG1   L.42.QD1  
assign (resid   47 and name HG2#) (resid   51 and name HA  ) 4.5 4.2 3.0 !pk.1773 # I.47.QG2   K.51.HA   
assign (resid   49 and name HA  ) (resid   50 and name HG1#) 4.5 3.7 2.5 !pk.1774 # K.49.HA    I.50.HG12 
assign (resid   49 and name HA  ) (resid   60 and name HD1#) 4.5 4.2 3.0 !pk.1774 # K.49.HA    L.60.QD1  
assign (resid   41 and name HA  ) (resid   44 and name HN  ) 4.5 2.7 1.5 !pk.1776   E.41.HA    N.44.H    
assign (resid   41 and name HA  ) (resid   44 and name HD2#) 4.5 4.2 3.0 !pk.1778 # E.41.HA    N.44.HD21 
assign (resid   41 and name HA  ) (resid   44 and name HB# ) 3.5 2.7 1.8 !pk.1780 # E.41.HA    N.44.HB2  
assign (resid   41 and name HA  ) (resid   44 and name HB# ) 4.5 3.7 2.5 !pk.1781 # E.41.HA    N.44.HB3  
assign (resid   51 and name HA  ) (resid   51 and name HD# ) 3.5 3.2 2.3 !pk.1782 # K.51.HA    K.51.QD   
assign (resid   31 and name HN  ) (resid   31 and name HG# ) 4.5 4.2 3.0 !pk.1784 # K.31.H     K.31.HG2  
assign (resid   31 and name HG# ) (resid   32 and name HN  ) 4.5 4.2 3.0 !pk.1785 # K.31.HG2   I.32.H    
assign (resid   31 and name HG# ) (resid   32 and name HN  ) 4.5 4.2 3.0 !pk.1786 # K.31.HG3   I.32.H    
assign (resid   86 and name HA  ) (resid   86 and name HG# ) 4.5 4.2 3.0 !pk.1790 # K.86.HA    K.86.HG2  
assign (resid   86 and name HA  ) (resid   86 and name HG# ) 4.5 4.2 3.0 !pk.1791 # K.86.HA    K.86.HG3  
assign (resid   86 and name HG# ) (resid   87 and name HD# ) 4.5 5.2 4.0 !pk.1792 # K.86.HG2   P.87.HD2  
assign (resid   86 and name HG# ) (resid   87 and name HG# ) 4.5 5.2 4.0 !pk.1798 # K.86.HG2   P.87.HG2  
assign (resid   86 and name HG# ) (resid   87 and name HG# ) 4.5 5.2 4.0 !pk.1798 # K.86.HG2   P.87.HG3  
assign (resid   30 and name HG# ) (resid   31 and name HG# ) 4.5 5.7 4.5 !pk.1799 # E.30.QG    K.31.HG2  
assign (resid   30 and name HG# ) (resid   31 and name HG# ) 4.5 5.7 4.5 !pk.1800 # E.30.QG    K.31.HG3  
assign (resid   30 and name HA  ) (resid   30 and name HB# ) 2.5 1.7 1.9 !pk.1801 # E.30.HA    E.30.HB2  
assign (resid   30 and name HB# ) (resid   31 and name HG# ) 4.5 5.2 4.0 !pk.1802 # E.30.HB2   K.31.HG2  
assign (resid   30 and name HB# ) (resid   31 and name HG# ) 4.5 5.2 4.0 !pk.1802 # E.30.HB3   K.31.HG2  
assign (resid   48 and name HA  ) (resid   51 and name HN  ) 4.5 2.7 1.5 !pk.1806   Q.48.HA    K.51.H    
assign (resid   36 and name HN  ) (resid   36 and name HG# ) 4.5 4.2 3.0 !pk.1807 # K.36.H     K.36.HG2  
assign (resid   38 and name HA  ) (resid   41 and name HN  ) 3.5 1.7 0.8 !pk.1810   E.38.HA    E.41.H    
assign (resid   36 and name HG# ) (resid  105 and name HE# ) 4.5 6.6 5.4 !pk.1814 # K.36.HG2   F.105.QE  
assign (resid   71 and name HA  ) (resid   71 and name HG# ) 4.5 4.2 3.0 !pk.1818 # K.71.HA    K.71.HG2  
assign (resid   36 and name HA  ) (resid   36 and name HG# ) 4.5 4.2 3.0 !pk.1820 # K.36.HA    K.36.HG2  
assign (resid   38 and name HA  ) (resid   38 and name HG# ) 3.5 3.2 2.3 !pk.1827 # E.38.HA    E.38.HG2  
assign (resid   38 and name HA  ) (resid   38 and name HG# ) 3.5 3.2 2.3 !pk.1828 # E.38.HA    E.38.HG3  
assign (resid   30 and name HA  ) (resid   30 and name HG# ) 3.5 3.2 2.3 !pk.1829 # E.30.HA    E.30.QG   
assign (resid   38 and name HA  ) (resid   41 and name HB# ) 4.5 3.7 2.5 !pk.1830 # E.38.HA    E.41.QB   
assign (resid   30 and name HB# ) (resid   31 and name HG# ) 4.5 5.2 4.0 !pk.1831 # E.30.HB2   K.31.HG3  
assign (resid   30 and name HB# ) (resid   31 and name HG# ) 4.5 5.2 4.0 !pk.1831 # E.30.HB3   K.31.HG3  
assign (resid   69 and name HA  ) (resid   72 and name HB# ) 4.5 4.2 3.0 !pk.1833 # S.69.HA    A.72.QB   
assign (resid   46 and name HA  ) (resid  112 and name HD1#) 4.5 4.2 3.0 !pk.1837 # Y.46.HA    I.112.QD1 
assign (resid   46 and name HA  ) (resid   50 and name HD1#) 4.5 4.2 3.0 !pk.1839 # Y.46.HA    I.50.QD1  
assign (resid   14 and name HN  ) (resid   14 and name HD2#) 4.5 4.2 3.0 !pk.1842 # L.14.H     L.14.QD2  
assign (resid   14 and name HD2#) (resid   15 and name HN  ) 4.5 4.2 3.0 !pk.1845 # L.14.QD2   L.15.H    
assign (resid   71 and name HN  ) (resid   71 and name HG# ) 4.5 4.2 3.0 !pk.1848 # K.71.H     K.71.HG3  
assign (resid   14 and name HD2#) (resid   57 and name HZ  ) 4.5 4.7 3.5 !pk.1849 # L.14.QD2   F.57.HZ   
assign (resid   14 and name HD2#) (resid   46 and name HD# ) 3.5 5.6 4.7 !pk.1851 # L.14.QD2   Y.46.QD   
assign (resid   46 and name HA  ) (resid   46 and name HE# ) 4.5 5.1 3.9 !pk.1852 # Y.46.HA    Y.46.QE   
assign (resid   14 and name HD2#) (resid   46 and name HE# ) 3.5 5.6 4.7 !pk.1853 # L.14.QD2   Y.46.QE   
assign (resid   71 and name HA  ) (resid   71 and name HG# ) 4.5 4.2 3.0 !pk.1854 # K.71.HA    K.71.HG3  
assign (resid   14 and name HA  ) (resid   14 and name HD2#) 3.5 3.2 2.3 !pk.1855 # L.14.HA    L.14.QD2  
assign (resid   14 and name HD2#) (resid   43 and name HA  ) 4.5 4.2 3.0 !pk.1856 # L.14.QD2   I.43.HA   
assign (resid   14 and name HD2#) (resid   64 and name HB# ) 4.5 5.2 4.0 !pk.1857 # L.14.QD2   F.64.HB2  
assign (resid   14 and name HD2#) (resid   46 and name HB# ) 4.5 5.2 4.0 !pk.1858 # L.14.QD2   Y.46.HB2  
assign (resid   14 and name HD2#) (resid   46 and name HB# ) 4.5 5.2 4.0 !pk.1860 # L.14.QD2   Y.46.HB3  
assign (resid   81 and name HA  ) (resid   81 and name HD# ) 4.5 4.2 3.0 !pk.1861 # R.81.HA    R.81.QD   
assign (resid   14 and name HD2#) (resid   64 and name HB# ) 4.5 5.2 4.0 !pk.1862 # L.14.QD2   F.64.HB3  
assign (resid    6 and name HG# ) (resid    9 and name HA  ) 4.5 3.7 2.5 !pk.1863 # P.6.QG     V.9.HA    
assign (resid   46 and name HA  ) (resid   49 and name HD# ) 4.5 4.2 3.0 !pk.1864 # Y.46.HA    K.49.HD3  
assign (resid   14 and name HB# ) (resid   14 and name HD2#) 3.5 4.2 3.3 !pk.1866 # L.14.HB2   L.14.QD2  
assign (resid   71 and name HG# ) (resid   71 and name HD# ) 3.5 4.7 3.8 !pk.1867 # K.71.HG3   K.71.QD   
assign (resid   14 and name HD2#) (resid   16 and name HG2#) 3.5 4.7 3.8 !pk.1871 # L.14.QD2   V.16.QG2  
assign (resid   14 and name HD2#) (resid  112 and name HD1#) 3.5 4.7 3.8 !pk.1871 # L.14.QD2   I.112.QD1 
assign (resid   14 and name HD2#) (resid   43 and name HD1#) 3.5 4.7 3.8 !pk.1872 # L.14.QD2   I.43.QD1  
assign (resid   81 and name HA  ) (resid   81 and name HG# ) 4.5 4.2 3.0 !pk.1873 # R.81.HA    R.81.HG3  
assign (resid   13 and name HD2 ) (resid   76 and name HD2#) 4.5 4.7 3.5 !pk.1880 # H.13.HD2   L.76.QD2  
assign (resid   76 and name HD2#) (resid   88 and name HE# ) 4.5 6.6 5.4 !pk.1882 # L.76.QD2   F.88.QE   
assign (resid   76 and name HA  ) (resid   76 and name HD2#) 3.5 3.2 2.3 !pk.1883 # L.76.HA    L.76.QD2  
assign (resid   69 and name HB# ) (resid   76 and name HD2#) 4.5 5.2 4.0 !pk.1884 # S.69.QB    L.76.QD2  
assign (resid   11 and name HB# ) (resid   76 and name HD2#) 4.5 5.2 4.0 !pk.1887 # C.11.HB3   L.76.QD2  
assign (resid   75 and name HB# ) (resid   76 and name HD2#) 4.5 5.2 4.0 !pk.1887 # D.75.QB    L.76.QD2  
assign (resid  117 and name HA  ) (resid  117 and name HG# ) 4.5 4.2 3.0 !pk.1888 # E.117.HA   E.117.HG2 
assign (resid  117 and name HA  ) (resid  117 and name HG# ) 4.5 4.2 3.0 !pk.1889 # E.117.HA   E.117.HG3 
assign (resid   76 and name HB# ) (resid   76 and name HD2#) 3.5 4.2 3.3 !pk.1890 # L.76.HB3   L.76.QD2  
assign (resid   97 and name HG2#) (resid  117 and name HA  ) 3.5 3.2 2.3 !pk.1893 # T.97.QG2   E.117.HA  
assign (resid   27 and name HA  ) (resid   27 and name HE3 ) 4.5 3.2 2.0 !pk.1895 # W.27.HA    W.27.HE3  
assign (resid   60 and name HD2#) (resid   64 and name HE# ) 3.5 5.6 4.7 !pk.1901 # L.60.QD2   F.64.QE   
assign (resid   60 and name HD2#) (resid   63 and name HE2#) 4.5 5.7 4.5 !pk.1903 # L.60.QD2   Q.63.HE21 
assign (resid   46 and name HD# ) (resid   60 and name HD2#) 4.5 6.6 5.4 !pk.1905 # Y.46.QD    L.60.QD2  
assign (resid   46 and name HE# ) (resid   60 and name HD2#) 4.5 6.6 5.4 !pk.1906 # Y.46.QE    L.60.QD2  
assign (resid   62 and name HA  ) (resid   73 and name HA  ) 4.5 2.7 1.5 !pk.1907   S.62.HA    R.73.HA   
assign (resid   46 and name HA  ) (resid   60 and name HD2#) 4.5 4.2 3.0 !pk.1908 # Y.46.HA    L.60.QD2  
assign (resid   60 and name HA  ) (resid   60 and name HD2#) 3.5 3.2 2.3 !pk.1909 # L.60.HA    L.60.QD2  
assign (resid   62 and name HB# ) (resid   73 and name HA  ) 4.5 3.7 2.5 !pk.1910 # S.62.HB3   R.73.HA   
assign (resid   42 and name HA  ) (resid   45 and name HA# ) 4.5 3.7 2.5 !pk.1911 # L.42.HA    G.45.QA   
assign (resid   73 and name HA  ) (resid   73 and name HD# ) 4.5 4.2 3.0 !pk.1912 # R.73.HA    R.73.HD3  
assign (resid   46 and name HB# ) (resid   60 and name HD2#) 4.5 5.2 4.0 !pk.1913 # Y.46.HB3   L.60.QD2  
assign (resid   55 and name HG# ) (resid   60 and name HD2#) 3.5 4.7 3.8 !pk.1914 # E.55.QG    L.60.QD2  
assign (resid   71 and name HA  ) (resid   71 and name HB# ) 2.5 1.7 1.9 !pk.1916 # K.71.HA    K.71.QB   
assign (resid   73 and name HA  ) (resid   73 and name HG# ) 3.5 3.2 2.3 !pk.1918 # R.73.HA    R.73.QG   
assign (resid   42 and name HA  ) (resid   42 and name HG  ) 3.5 1.7 0.8 !pk.1919   L.42.HA    L.42.HG   
assign (resid   55 and name HB# ) (resid   60 and name HD2#) 4.5 5.2 4.0 !pk.1921 # E.55.HB3   L.60.QD2  
assign (resid   60 and name HD2#) (resid   63 and name HB# ) 4.5 5.2 4.0 !pk.1922 # L.60.QD2   Q.63.HB2  
assign (resid   14 and name HD1#) (resid   60 and name HD2#) 4.5 5.7 4.5 !pk.1926 # L.14.QD1   L.60.QD2  
assign (resid   97 and name HG2#) (resid   98 and name HN  ) 3.5 3.2 2.3 !pk.1929 # T.97.QG2   G.98.H    
assign (resid   40 and name HA  ) (resid   44 and name HN  ) 4.5 2.7 1.5 !pk.1932   L.40.HA    N.44.H    
assign (resid   40 and name HN  ) (resid   40 and name HD1#) 4.5 4.2 3.0 !pk.1935 # L.40.H     L.40.QD1  
assign (resid   42 and name HD2#) (resid   43 and name HN  ) 4.5 4.2 3.0 !pk.1936 # L.42.QD2   I.43.H    
assign (resid   97 and name HG2#) (resid  117 and name HN  ) 4.5 4.2 3.0 !pk.1937 # T.97.QG2   E.117.H   
assign (resid   42 and name HN  ) (resid   42 and name HD2#) 3.5 3.2 2.3 !pk.1938 # L.42.H     L.42.QD2  
assign (resid   97 and name HG2#) (resid  115 and name HE  ) 4.5 4.2 3.0 !pk.1939 # T.97.QG2   R.115.HE  
assign (resid   40 and name HD1#) (resid   44 and name HD2#) 3.5 4.7 3.8 !pk.1942 # L.40.QD1   N.44.HD21 
assign (resid   27 and name HH2 ) (resid   63 and name HA  ) 4.5 3.2 2.0 !pk.1943 # W.27.HH2   Q.63.HA   
assign (resid   60 and name HA  ) (resid   64 and name HD# ) 3.5 4.1 3.2 !pk.1945 # L.60.HA    F.64.QD   
assign (resid   97 and name HG2#) (resid  115 and name HH1#) 4.5 5.7 4.5 !pk.1946 # T.97.QG2   R.115.QH1 
assign (resid   40 and name HD1#) (resid   44 and name HD2#) 3.5 4.7 3.8 !pk.1948 # L.40.QD1   N.44.HD22 
assign (resid   42 and name HD2#) (resid   46 and name HE# ) 4.5 6.6 5.4 !pk.1949 # L.42.QD2   Y.46.QE   
assign (resid   40 and name HA  ) (resid   40 and name HD1#) 3.5 3.2 2.3 !pk.1952 # L.40.HA    L.40.QD1  
assign (resid   97 and name HG2#) (resid   98 and name HA# ) 4.5 5.2 4.0 !pk.1953 # T.97.QG2   G.98.HA3  
assign (resid   42 and name HA  ) (resid   42 and name HD2#) 3.5 3.2 2.3 !pk.1954 # L.42.HA    L.42.QD2  
assign (resid   97 and name HA  ) (resid   97 and name HG2#) 3.5 3.2 2.3 !pk.1956 # T.97.HA    T.97.QG2  
assign (resid   40 and name HD1#) (resid   44 and name HB# ) 4.5 5.2 4.0 !pk.1957 # L.40.QD1   N.44.HB2  
assign (resid   40 and name HA  ) (resid   43 and name HB  ) 3.5 1.7 0.8 !pk.1959   L.40.HA    I.43.HB   
assign (resid   40 and name HD1#) (resid   43 and name HB  ) 3.5 3.2 2.3 !pk.1960 # L.40.QD1   I.43.HB   
assign (resid   40 and name HB# ) (resid   40 and name HD1#) 3.5 4.2 3.3 !pk.1962 # L.40.HB2   L.40.QD1  
assign (resid   42 and name HB# ) (resid   42 and name HD2#) 3.5 4.2 3.3 !pk.1963 # L.42.HB2   L.42.QD2  
assign (resid   27 and name HD1 ) (resid   70 and name HB# ) 4.5 4.7 3.5 !pk.1964 # W.27.HD1   A.70.QB   
assign (resid   40 and name HA  ) (resid   40 and name HG  ) 3.5 1.7 0.8 !pk.1965   L.40.HA    L.40.HG   
assign (resid   40 and name HB# ) (resid   40 and name HD1#) 3.5 4.2 3.3 !pk.1970 # L.40.HB3   L.40.QD1  
assign (resid   16 and name HG1#) (resid   42 and name HD2#) 4.5 5.7 4.5 !pk.1971 # V.16.QG1   L.42.QD2  
assign (resid   42 and name HB# ) (resid   42 and name HD2#) 3.5 4.2 3.3 !pk.1974 # L.42.HB3   L.42.QD2  
assign (resid   40 and name HA  ) (resid  110 and name HD1#) 3.5 3.2 2.3 !pk.1975 # L.40.HA    I.110.QD1 
assign (resid   14 and name HD1#) (resid   60 and name HA  ) 4.5 4.2 3.0 !pk.1978 # L.14.QD1   L.60.HA   
assign (resid  101 and name HN  ) (resid  114 and name HD1#) 4.5 4.2 3.0 !pk.1979 # S.101.H    L.114.QD1 
assign (resid   16 and name HG1#) (resid   34 and name HE  ) 4.5 4.2 3.0 !pk.1987 # V.16.QG1   R.34.HE   
assign (resid   16 and name HG1#) (resid   34 and name HH1#) 4.5 5.7 4.5 !pk.1988 # V.16.QG1   R.34.HH12 
assign (resid   57 and name HD# ) (resid  114 and name HD1#) 4.5 6.6 5.4 !pk.1989 # F.57.QD    L.114.QD1 
assign (resid   16 and name HG1#) (resid   34 and name HH1#) 4.5 5.7 4.5 !pk.1990 # V.16.QG1   R.34.HH11 
assign (resid  100 and name HA  ) (resid  114 and name HD1#) 3.5 3.2 2.3 !pk.1992 # M.100.HA   L.114.QD1 
assign (resid   16 and name HA  ) (resid   16 and name HG1#) 4.5 4.2 3.0 !pk.1993 # V.16.HA    V.16.QG1  
assign (resid   98 and name HA# ) (resid  114 and name HD1#) 4.5 5.2 4.0 !pk.1994 # G.98.HA2   L.114.QD1 
assign (resid   16 and name HG1#) (resid   34 and name HD# ) 3.5 4.7 3.8 !pk.1996 # V.16.QG1   R.34.HD3  
assign (resid   98 and name HA# ) (resid  114 and name HD1#) 4.5 5.2 4.0 !pk.1997 # G.98.HA3   L.114.QD1 
assign (resid  100 and name HG# ) (resid  114 and name HD1#) 4.5 5.7 4.5 !pk.1999 # M.100.HG2  L.114.QD1 
assign (resid   85 and name HA  ) (resid   85 and name HG# ) 3.5 3.2 2.3 !pk.2000 # Q.85.HA    Q.85.QG   
assign (resid   16 and name HG1#) (resid   34 and name HD# ) 4.5 5.7 4.5 !pk.2001 # V.16.QG1   R.34.HD2  
assign (resid  100 and name HG# ) (resid  114 and name HD1#) 4.5 5.7 4.5 !pk.2002 # M.100.HG3  L.114.QD1 
assign (resid   16 and name HG1#) (resid   43 and name HB  ) 4.5 4.2 3.0 !pk.2003 # V.16.QG1   I.43.HB   
assign (resid  100 and name HB# ) (resid  114 and name HD1#) 4.5 5.2 4.0 !pk.2005 # M.100.HB2  L.114.QD1 
assign (resid  100 and name HB# ) (resid  114 and name HD1#) 3.5 4.2 3.3 !pk.2008 # M.100.HB3  L.114.QD1 
assign (resid   16 and name HG1#) (resid   39 and name HB# ) 3.5 4.7 3.8 !pk.2009 # V.16.QG1   A.39.QB   
assign (resid  114 and name HD1#) (resid  116 and name HG2#) 3.5 4.7 3.8 !pk.2010 # L.114.QD1  T.116.QG2 
assign (resid  114 and name HB# ) (resid  114 and name HD1#) 3.5 4.2 3.3 !pk.2014 # L.114.HB3  L.114.QD1 
assign (resid   27 and name HE3 ) (resid   28 and name HA  ) 4.5 3.2 2.0 !pk.2015 # W.27.HE3   R.28.HA   
assign (resid  106 and name HG2#) (resid  111 and name HD2 ) 3.5 3.7 2.8 !pk.2016 # T.106.QG2  H.111.HD2 
assign (resid   88 and name HA  ) (resid  106 and name HG2#) 4.5 4.2 3.0 !pk.2019 # F.88.HA    T.106.QG2 
assign (resid  104 and name HB  ) (resid  106 and name HG2#) 4.5 4.2 3.0 !pk.2020 # V.104.HB   T.106.QG2 
assign (resid  104 and name HG1#) (resid  106 and name HG2#) 3.5 4.7 3.8 !pk.2022 # V.104.QG1  T.106.QG2 
assign (resid   28 and name HA  ) (resid   28 and name HG# ) 4.5 4.2 3.0 !pk.2024 # R.28.HA    R.28.HG2  
assign (resid   28 and name HA  ) (resid   28 and name HG# ) 4.5 4.2 3.0 !pk.2025 # R.28.HA    R.28.HG3  
assign (resid   35 and name HG2#) (resid   36 and name HN  ) 4.5 4.2 3.0 !pk.2030 # T.35.QG2   K.36.H    
assign (resid   95 and name HD2#) (resid   96 and name HN  ) 3.5 3.2 2.3 !pk.2031 # L.95.QD2   R.96.H    
assign (resid  106 and name HN  ) (resid  106 and name HG2#) 4.5 4.2 3.0 !pk.2032 # T.106.H    T.106.QG2 
assign (resid   35 and name HG2#) (resid   37 and name HN  ) 4.5 4.2 3.0 !pk.2033 # T.35.QG2   E.37.H    
assign (resid   70 and name HA  ) (resid   74 and name HN  ) 4.5 2.7 1.5 !pk.2035   A.70.HA    G.74.H    
assign (resid   95 and name HD2#) (resid  100 and name HN  ) 4.5 4.2 3.0 !pk.2036 # L.95.QD2   M.100.H   
assign (resid    9 and name HN  ) (resid   80 and name HA  ) 4.5 2.7 1.5 !pk.2040   V.9.H      S.80.HA   
assign (resid   70 and name HA  ) (resid   72 and name HN  ) 4.5 2.7 1.5 !pk.2042   A.70.HA    A.72.H    
assign (resid   80 and name HA  ) (resid   93 and name HZ  ) 3.5 2.2 1.3 !pk.2044 # S.80.HA    F.93.HZ   
assign (resid   95 and name HN  ) (resid   95 and name HD2#) 4.5 4.2 3.0 !pk.2045 # L.95.H     L.95.QD2  
assign (resid   95 and name HD2#) (resid  101 and name HG  ) 4.5 4.2 3.0 !pk.2046 # L.95.QD2   S.101.HG  
assign (resid   95 and name HD2#) (resid  100 and name HA  ) 4.5 4.2 3.0 !pk.2049 # L.95.QD2   M.100.HA  
assign (resid  106 and name HA  ) (resid  106 and name HG2#) 4.5 4.2 3.0 !pk.2050 # T.106.HA   T.106.QG2 
assign (resid    8 and name HA  ) (resid   80 and name HA  ) 4.5 2.7 1.5 !pk.2051   R.8.HA     S.80.HA   
assign (resid  105 and name HA  ) (resid  106 and name HG2#) 4.5 4.2 3.0 !pk.2052 # F.105.HA   T.106.QG2 
assign (resid   35 and name HA  ) (resid   35 and name HG2#) 3.5 3.2 2.3 !pk.2053 # T.35.HA    T.35.QG2  
assign (resid   62 and name HA  ) (resid   70 and name HA  ) 4.5 2.7 1.5 !pk.2054   S.62.HA    A.70.HA   
assign (resid   95 and name HD2#) (resid  101 and name HA  ) 3.5 3.2 2.3 !pk.2055 # L.95.QD2   S.101.HA  
assign (resid   95 and name HD2#) (resid  101 and name HB# ) 3.5 4.2 3.3 !pk.2055 # L.95.QD2   S.101.HB2 
assign (resid   95 and name HA  ) (resid   95 and name HD2#) 3.5 3.2 2.3 !pk.2056 # L.95.HA    L.95.QD2  
assign (resid   87 and name HD# ) (resid  106 and name HG2#) 4.5 5.2 4.0 !pk.2058 # P.87.HD2   T.106.QG2 
assign (resid   95 and name HD2#) (resid  101 and name HB# ) 3.5 4.2 3.3 !pk.2059 # L.95.QD2   S.101.HB3 
assign (resid   88 and name HB# ) (resid  106 and name HG2#) 4.5 5.2 4.0 !pk.2060 # F.88.HB2   T.106.QG2 
assign (resid  105 and name HB# ) (resid  106 and name HG2#) 4.5 5.2 4.0 !pk.2061 # F.105.QB   T.106.QG2 
assign (resid  106 and name HG2#) (resid  111 and name HB# ) 4.5 5.2 4.0 !pk.2061 # T.106.QG2  H.111.HB2 
assign (resid   85 and name HG# ) (resid  106 and name HG2#) 4.5 5.7 4.5 !pk.2062 # Q.85.QG    T.106.QG2 
assign (resid   88 and name HB# ) (resid  106 and name HG2#) 3.5 4.2 3.3 !pk.2063 # F.88.HB3   T.106.QG2 
assign (resid   35 and name HG2#) (resid   38 and name HB# ) 4.5 5.2 4.0 !pk.2064 # T.35.QG2   E.38.HB2  
assign (resid   87 and name HG# ) (resid  106 and name HG2#) 3.5 4.2 3.3 !pk.2065 # P.87.HG2   T.106.QG2 
assign (resid   95 and name HD2#) (resid   99 and name HG# ) 3.5 4.7 3.8 !pk.2066 # L.95.QD2   E.99.HG3  
assign (resid   85 and name HB# ) (resid  106 and name HG2#) 4.5 5.2 4.0 !pk.2069 # Q.85.HB3   T.106.QG2 
assign (resid   95 and name HD2#) (resid   99 and name HB# ) 3.5 4.2 3.3 !pk.2071 # L.95.QD2   E.99.HB3  
assign (resid   35 and name HG2#) (resid   37 and name HB# ) 4.5 5.2 4.0 !pk.2072 # T.35.QG2   E.37.HB3  
assign (resid   35 and name HG2#) (resid   38 and name HB# ) 4.5 5.2 4.0 !pk.2072 # T.35.QG2   E.38.HB3  
assign (resid   95 and name HB# ) (resid   95 and name HD2#) 3.5 4.2 3.3 !pk.2073 # L.95.HB2   L.95.QD2  
assign (resid   95 and name HB# ) (resid   95 and name HD2#) 3.5 4.2 3.3 !pk.2076 # L.95.HB3   L.95.QD2  
assign (resid    8 and name HG# ) (resid   80 and name HA  ) 4.5 4.2 3.0 !pk.2077 # R.8.QG     S.80.HA   
assign (resid   91 and name HB# ) (resid   95 and name HD2#) 4.5 5.7 4.5 !pk.2078 # A.91.QB    L.95.QD2  
assign (resid   12 and name HA  ) (resid   13 and name HD2 ) 4.5 3.2 2.0 !pk.2087 # S.12.HA    H.13.HD2  
assign (resid  115 and name HA  ) (resid  116 and name HG2#) 4.5 4.2 3.0 !pk.2089 # R.115.HA   T.116.QG2 
assign (resid   14 and name HA  ) (resid   16 and name HG2#) 4.5 4.2 3.0 !pk.2091 # L.14.HA    V.16.QG2  
assign (resid   16 and name HG2#) (resid   39 and name HA  ) 4.5 4.2 3.0 !pk.2091 # V.16.QG2   A.39.HA   
assign (resid   11 and name HB# ) (resid   12 and name HA  ) 4.5 3.7 2.5 !pk.2095 # C.11.HB3   S.12.HA   
assign (resid   12 and name HA  ) (resid   75 and name HB# ) 4.5 3.7 2.5 !pk.2095 # S.12.HA    D.75.QB   
assign (resid   12 and name HA  ) (resid   76 and name HG  ) 4.5 2.7 1.5 !pk.2096   S.12.HA    L.76.HG   
assign (resid   12 and name HA  ) (resid   76 and name HD1#) 4.5 4.2 3.0 !pk.2098 # S.12.HA    L.76.QD1  
assign (resid  114 and name HD2#) (resid  116 and name HG2#) 3.5 4.7 3.8 !pk.2099 # L.114.QD2  T.116.QG2 
assign (resid   67 and name HB# ) (resid  111 and name HE1 ) 4.5 4.7 3.5 !pk.2107 # A.67.QB    H.111.HE1 
assign (resid   65 and name HG  ) (resid   67 and name HB# ) 4.5 4.2 3.0 !pk.2108 # S.65.HG    A.67.QB   
assign (resid   16 and name HG2#) (resid   46 and name HD# ) 4.5 6.6 5.4 !pk.2111 # V.16.QG2   Y.46.QD   
assign (resid   16 and name HA  ) (resid   16 and name HG2#) 4.5 4.2 3.0 !pk.2113 # V.16.HA    V.16.QG2  
assign (resid   14 and name HA  ) (resid   67 and name HB# ) 4.5 4.2 3.0 !pk.2115 # L.14.HA    A.67.QB   
assign (resid   16 and name HG2#) (resid   43 and name HA  ) 4.5 4.2 3.0 !pk.2116 # V.16.QG2   I.43.HA   
assign (resid   16 and name HG2#) (resid   43 and name HB  ) 4.5 4.2 3.0 !pk.2120 # V.16.QG2   I.43.HB   
assign (resid   27 and name HH2 ) (resid   70 and name HB# ) 4.5 4.7 3.5 !pk.2123 # W.27.HH2   A.70.QB   
assign (resid   16 and name HG2#) (resid  110 and name HB  ) 4.5 4.2 3.0 !pk.2124 # V.16.QG2   I.110.HB  
assign (resid   15 and name HB# ) (resid   67 and name HB# ) 4.5 5.2 4.0 !pk.2127 # L.15.HB3   A.67.QB   
assign (resid   15 and name HD2#) (resid   67 and name HB# ) 3.5 4.7 3.8 !pk.2130 # L.15.QD2   A.67.QB   
assign (resid   14 and name HD1#) (resid   16 and name HG2#) 4.5 5.7 4.5 !pk.2132 # L.14.QD1   V.16.QG2  
assign (resid   15 and name HD1#) (resid   67 and name HB# ) 4.5 5.7 4.5 !pk.2133 # L.15.QD1   A.67.QB   
assign (resid   11 and name HA  ) (resid  117 and name HN  ) 4.5 2.7 1.5 !pk.2140   C.11.HA    E.117.H   
assign (resid    9 and name HG1#) (resid  115 and name HE  ) 4.5 4.2 3.0 !pk.2141 # V.9.QG1    R.115.HE  
assign (resid   14 and name HA  ) (resid   65 and name HG  ) 4.5 2.7 1.5 !pk.2144   L.14.HA    S.65.HG   
assign (resid    9 and name HG1#) (resid   93 and name HE# ) 4.5 6.6 5.4 !pk.2146 # V.9.QG1    F.93.QE   
assign (resid    9 and name HG1#) (resid  115 and name HH1#) 4.5 5.7 4.5 !pk.2147 # V.9.QG1    R.115.QH1 
assign (resid   11 and name HA  ) (resid  115 and name HA  ) 3.5 1.7 0.8 !pk.2148   C.11.HA    R.115.HA  
assign (resid   14 and name HA  ) (resid   65 and name HB# ) 4.5 3.7 2.5 !pk.2149 # L.14.HA    S.65.HB2  
assign (resid    9 and name HA  ) (resid    9 and name HG1#) 3.5 3.2 2.3 !pk.2151 # V.9.HA     V.9.QG1   
assign (resid   32 and name HA  ) (resid   33 and name HG2#) 4.5 4.2 3.0 !pk.2152 # I.32.HA    T.33.QG2  
assign (resid    6 and name HD# ) (resid    9 and name HG1#) 4.5 5.2 4.0 !pk.2153 # P.6.QD     V.9.QG1   
assign (resid   14 and name HA  ) (resid   61 and name HA  ) 4.5 2.7 1.5 !pk.2154   L.14.HA    A.61.HA   
assign (resid   31 and name HE# ) (resid   33 and name HG2#) 4.5 5.7 4.5 !pk.2156 # K.31.QE    T.33.QG2  
assign (resid    9 and name HG1#) (resid  115 and name HD# ) 4.5 5.7 4.5 !pk.2158 # V.9.QG1    R.115.HD2 
assign (resid   29 and name HA  ) (resid   29 and name HG# ) 3.5 3.2 2.3 !pk.2160 # Q.29.HA    Q.29.QG   
assign (resid    6 and name HG# ) (resid    9 and name HG1#) 3.5 4.2 3.3 !pk.2161 # P.6.QG     V.9.QG1   
assign (resid   31 and name HB# ) (resid   33 and name HG2#) 4.5 5.2 4.0 !pk.2163 # K.31.QB    T.33.QG2  
assign (resid   31 and name HD# ) (resid   33 and name HG2#) 4.5 5.7 4.5 !pk.2163 # K.31.QD    T.33.QG2  
assign (resid   31 and name HG# ) (resid   33 and name HG2#) 4.5 5.7 4.5 !pk.2166 # K.31.HG2   T.33.QG2  
assign (resid   11 and name HA  ) (resid  116 and name HG2#) 4.5 4.2 3.0 !pk.2167 # C.11.HA    T.116.QG2 
assign (resid   11 and name HA  ) (resid  113 and name HG2#) 4.5 4.2 3.0 !pk.2169 # C.11.HA    I.113.QG2 
assign (resid   61 and name HA  ) (resid   65 and name HB# ) 4.5 3.7 2.5 !pk.2177 # A.61.HA    S.65.HB2  
assign (resid   14 and name HG  ) (resid   61 and name HA  ) 3.5 1.7 0.8 !pk.2180   L.14.HG    A.61.HA   
assign (resid   14 and name HD2#) (resid   61 and name HA  ) 4.5 4.2 3.0 !pk.2182 # L.14.QD2   A.61.HA   
assign (resid   99 and name HA  ) (resid  114 and name HD1#) 4.5 4.2 3.0 !pk.2183 # E.99.HA    L.114.QD1 
assign (resid  104 and name HN  ) (resid  104 and name HG2#) 3.5 3.2 2.3 !pk.2185 # V.104.H    V.104.QG2 
assign (resid  104 and name HG2#) (resid  113 and name HN  ) 4.5 4.2 3.0 !pk.2187 # V.104.QG2  I.113.H   
assign (resid  102 and name HN  ) (resid  104 and name HG2#) 4.5 4.2 3.0 !pk.2188 # G.102.H    V.104.QG2 
assign (resid   91 and name HN  ) (resid  104 and name HG2#) 4.5 4.2 3.0 !pk.2189 # A.91.H     V.104.QG2 
assign (resid  101 and name HG  ) (resid  104 and name HG2#) 3.5 3.2 2.3 !pk.2190 # S.101.HG   V.104.QG2 
assign (resid  104 and name HA  ) (resid  104 and name HG2#) 3.5 3.2 2.3 !pk.2191 # V.104.HA   V.104.QG2 
assign (resid  104 and name HG2#) (resid  112 and name HA  ) 4.5 4.2 3.0 !pk.2192 # V.104.QG2  I.112.HA  
assign (resid   88 and name HA  ) (resid  104 and name HG2#) 4.5 4.2 3.0 !pk.2193 # F.88.HA    V.104.QG2 
assign (resid   96 and name HA  ) (resid   96 and name HD# ) 4.5 4.2 3.0 !pk.2194 # R.96.HA    R.96.QD   
assign (resid  104 and name HG2#) (resid  111 and name HB# ) 4.5 5.2 4.0 !pk.2195 # V.104.QG2  H.111.HB2 
assign (resid  104 and name HG2#) (resid  111 and name HB# ) 4.5 5.2 4.0 !pk.2196 # V.104.QG2  H.111.HB3 
assign (resid  104 and name HG2#) (resid  113 and name HG1#) 3.5 4.2 3.3 !pk.2199 # V.104.QG2  I.113.HG12
assign (resid  104 and name HG2#) (resid  113 and name HG1#) 4.5 5.2 4.0 !pk.2200 # V.104.QG2  I.113.HG13
assign (resid  104 and name HG1#) (resid  111 and name HN  ) 4.5 4.2 3.0 !pk.2202 # V.104.QG1  H.111.H   
assign (resid  104 and name HN  ) (resid  104 and name HG1#) 4.5 4.2 3.0 !pk.2203 # V.104.H    V.104.QG1 
assign (resid  104 and name HG1#) (resid  111 and name HD2 ) 4.5 4.7 3.5 !pk.2210 # V.104.QG1  H.111.HD2 
assign (resid   88 and name HD# ) (resid  104 and name HG1#) 4.5 6.6 5.4 !pk.2211 # F.88.QD    V.104.QG1 
assign (resid  104 and name HA  ) (resid  104 and name HG1#) 3.5 3.2 2.3 !pk.2212 # V.104.HA   V.104.QG1 
assign (resid   34 and name HD# ) (resid   39 and name HA  ) 4.5 4.2 3.0 !pk.2213 # R.34.HD3   A.39.HA   
assign (resid   88 and name HA  ) (resid  104 and name HG1#) 3.5 3.2 2.3 !pk.2214 # F.88.HA    V.104.QG1 
assign (resid   88 and name HB# ) (resid  104 and name HG1#) 4.5 5.2 4.0 !pk.2215 # F.88.HB2   V.104.QG1 
assign (resid  104 and name HG1#) (resid  105 and name HB# ) 4.5 5.2 4.0 !pk.2216 # V.104.QG1  F.105.QB  
assign (resid  104 and name HG1#) (resid  111 and name HB# ) 4.5 5.2 4.0 !pk.2217 # V.104.QG1  H.111.HB3 
assign (resid   34 and name HD# ) (resid   39 and name HA  ) 4.5 4.2 3.0 !pk.2219 # R.34.HD2   A.39.HA   
assign (resid   88 and name HB# ) (resid  104 and name HG1#) 4.5 5.2 4.0 !pk.2220 # F.88.HB3   V.104.QG1 
assign (resid   87 and name HG# ) (resid  104 and name HG1#) 4.5 5.2 4.0 !pk.2221 # P.87.HG2   V.104.QG1 
assign (resid   39 and name HA  ) (resid   42 and name HB# ) 3.5 2.7 1.8 !pk.2223 # A.39.HA    L.42.HB2  
assign (resid   96 and name HA  ) (resid   96 and name HG# ) 3.5 3.2 2.3 !pk.2225 # R.96.HA    R.96.QG   
assign (resid   16 and name HG1#) (resid   39 and name HA  ) 3.5 3.2 2.3 !pk.2229 # V.16.QG1   A.39.HA   
assign (resid  104 and name HG1#) (resid  113 and name HD1#) 3.5 4.7 3.8 !pk.2232 # V.104.QG1  I.113.QD1 
assign (resid   77 and name HA# ) (resid   78 and name HB# ) 4.5 5.2 4.0 !pk.2240 # G.77.HA3   A.78.QB   
assign (resid   90 and name HB# ) (resid   91 and name HB# ) 4.5 5.2 4.0 !pk.2242 # D.90.HB3   A.91.QB   
assign (resid   95 and name HA  ) (resid   95 and name HG  ) 4.5 2.7 1.5 !pk.2243   L.95.HA    L.95.HG   
assign (resid   91 and name HB# ) (resid   95 and name HG  ) 4.5 4.2 3.0 !pk.2244 # A.91.QB    L.95.HG   
assign (resid   95 and name HA  ) (resid   99 and name HB# ) 4.5 3.7 2.5 !pk.2245 # L.95.HA    E.99.HB3  
assign (resid    8 and name HG# ) (resid   78 and name HB# ) 4.5 5.7 4.5 !pk.2248 # R.8.QG     A.78.QB   
assign (resid   10 and name HG# ) (resid   78 and name HB# ) 4.5 5.7 4.5 !pk.2248 # R.10.HG3   A.78.QB   
assign (resid   91 and name HB# ) (resid  104 and name HG2#) 3.5 4.7 3.8 !pk.2249 # A.91.QB    V.104.QG2 
assign (resid   95 and name HA  ) (resid   95 and name HD1#) 4.5 4.2 3.0 !pk.2250 # L.95.HA    L.95.QD1  
assign (resid   15 and name HD1#) (resid  110 and name HN  ) 3.5 3.2 2.3 !pk.2256 # L.15.QD1   I.110.H   
assign (resid   27 and name HZ2 ) (resid   70 and name HB# ) 3.5 3.7 2.8 !pk.2263 # W.27.HZ2   A.70.QB   
assign (resid   15 and name HD1#) (resid  111 and name HD2 ) 4.5 4.7 3.5 !pk.2265 # L.15.QD1   H.111.HD2 
assign (resid   13 and name HA  ) (resid   57 and name HZ  ) 3.5 2.2 1.3 !pk.2270 # H.13.HA    F.57.HZ   
assign (resid   15 and name HD1#) (resid  111 and name HA  ) 4.5 4.2 3.0 !pk.2271 # L.15.QD1   H.111.HA  
assign (resid   62 and name HA  ) (resid   70 and name HB# ) 3.5 3.2 2.3 !pk.2273 # S.62.HA    A.70.QB   
assign (resid   91 and name HB# ) (resid  101 and name HB# ) 4.5 5.2 4.0 !pk.2274 # A.91.QB    S.101.HB2 
assign (resid   15 and name HD1#) (resid  109 and name HA# ) 3.5 4.2 3.3 !pk.2276 # L.15.QD1   G.109.HA2 
assign (resid   91 and name HB# ) (resid   92 and name HB# ) 4.5 5.2 4.0 !pk.2277 # A.91.QB    S.92.HB2  
assign (resid   15 and name HD1#) (resid  109 and name HA# ) 4.5 5.2 4.0 !pk.2281 # L.15.QD1   G.109.HA3 
assign (resid   91 and name HB# ) (resid   92 and name HG  ) 4.5 4.2 3.0 !pk.2283 # A.91.QB    S.92.HG   
assign (resid   87 and name HB# ) (resid   91 and name HB# ) 4.5 5.2 4.0 !pk.2284 # P.87.HB3   A.91.QB   
assign (resid   91 and name HB# ) (resid  104 and name HB  ) 4.5 4.2 3.0 !pk.2284 # A.91.QB    V.104.HB  
assign (resid   15 and name HB# ) (resid   15 and name HD1#) 3.5 4.2 3.3 !pk.2286 # L.15.HB2   L.15.QD1  
assign (resid   91 and name HA  ) (resid   94 and name HB# ) 3.5 3.2 2.3 !pk.2289 # A.91.HA    A.94.QB   
assign (resid   14 and name HG  ) (resid   70 and name HB# ) 4.5 4.2 3.0 !pk.2291 # L.14.HG    A.70.QB   
assign (resid   13 and name HA  ) (resid   14 and name HB# ) 4.5 3.7 2.5 !pk.2292 # H.13.HA    L.14.HB3  
assign (resid   13 and name HA  ) (resid  112 and name HG2#) 4.5 4.2 3.0 !pk.2292 # H.13.HA    I.112.QG2 
assign (resid   91 and name HA  ) (resid  104 and name HG2#) 4.5 4.2 3.0 !pk.2294 # A.91.HA    V.104.QG2 
assign (resid   13 and name HA  ) (resid  114 and name HB# ) 4.5 3.7 2.5 !pk.2295 # H.13.HA    L.114.HB2 
assign (resid   91 and name HB# ) (resid  104 and name HG1#) 3.5 4.7 3.8 !pk.2296 # A.91.QB    V.104.QG1 
assign (resid   91 and name HA  ) (resid  113 and name HD1#) 4.5 4.2 3.0 !pk.2298 # A.91.HA    I.113.QD1 
assign (resid   14 and name HN  ) (resid  111 and name HA  ) 4.5 2.7 1.5 !pk.2302   L.14.H     H.111.HA  
assign (resid   94 and name HN  ) (resid   94 and name HB# ) 2.5 2.2 2.4 !pk.2304 # A.94.H     A.94.QB   
assign (resid   15 and name HD1#) (resid   17 and name HE# ) 4.5 5.7 4.5 !pk.2307 # L.15.QD1   K.17.HE3  
assign (resid   15 and name HD1#) (resid  111 and name HB# ) 4.5 5.2 4.0 !pk.2307 # L.15.QD1   H.111.HB2 
assign (resid  111 and name HA  ) (resid  112 and name HG1#) 4.5 3.7 2.5 !pk.2309 # H.111.HA   I.112.HG12
assign (resid  111 and name HA  ) (resid  112 and name HG1#) 4.5 3.7 2.5 !pk.2310 # H.111.HA   I.112.HG13
assign (resid   43 and name HD1#) (resid  111 and name HA  ) 4.5 4.2 3.0 !pk.2311 # I.43.QD1   H.111.HA  
assign (resid  110 and name HG2#) (resid  111 and name HA  ) 4.5 4.2 3.0 !pk.2312 # I.110.QG2  H.111.HA  
assign (resid  104 and name HN  ) (resid  112 and name HG2#) 4.5 4.2 3.0 !pk.2315 # V.104.H    I.112.QG2 
assign (resid  112 and name HG2#) (resid  113 and name HN  ) 3.5 3.2 2.3 !pk.2316 # I.112.QG2  I.113.H   
assign (resid    7 and name HA  ) (resid   93 and name HE# ) 4.5 5.1 3.9 !pk.2318 # A.7.HA     F.93.QE   
assign (resid   57 and name HD# ) (resid  112 and name HG2#) 4.5 6.6 5.4 !pk.2319 # F.57.QD    I.112.QG2 
assign (resid   57 and name HE# ) (resid  112 and name HG2#) 3.5 5.6 4.7 !pk.2320 # F.57.QE    I.112.QG2 
assign (resid  101 and name HG  ) (resid  112 and name HG2#) 4.5 4.2 3.0 !pk.2321 # S.101.HG   I.112.QG2 
assign (resid  102 and name HA# ) (resid  112 and name HG2#) 4.5 5.2 4.0 !pk.2322 # G.102.HA2  I.112.QG2 
assign (resid  102 and name HA# ) (resid  112 and name HG2#) 4.5 5.2 4.0 !pk.2325 # G.102.HA3  I.112.QG2 
assign (resid   43 and name HA  ) (resid  112 and name HG2#) 4.5 4.2 3.0 !pk.2326 # I.43.HA    I.112.QG2 
assign (resid  103 and name HD# ) (resid  112 and name HG2#) 4.5 5.2 4.0 !pk.2326 # P.103.HD2  I.112.QG2 
assign (resid   47 and name HA  ) (resid  112 and name HG2#) 4.5 4.2 3.0 !pk.2327 # I.47.HA    I.112.QG2 
assign (resid  100 and name HG# ) (resid  112 and name HG2#) 3.5 4.7 3.8 !pk.2328 # M.100.HG2  I.112.QG2 
assign (resid  100 and name HG# ) (resid  112 and name HG2#) 3.5 4.7 3.8 !pk.2329 # M.100.HG3  I.112.QG2 
assign (resid  100 and name HE# ) (resid  112 and name HG2#) 4.5 5.7 4.5 !pk.2330 # M.100.QE   I.112.QG2 
assign (resid   47 and name HG1#) (resid  112 and name HG2#) 3.5 4.2 3.3 !pk.2331 # I.47.HG12  I.112.QG2 
assign (resid  112 and name HG2#) (resid  113 and name HG1#) 4.5 5.2 4.0 !pk.2333 # I.112.QG2  I.113.HG12
assign (resid   43 and name HG2#) (resid  112 and name HG2#) 3.5 4.7 3.8 !pk.2334 # I.43.QG2   I.112.QG2 
assign (resid   38 and name HN  ) (resid   39 and name HB# ) 4.5 4.2 3.0 !pk.2338 # E.38.H     A.39.QB   
assign (resid   18 and name HB# ) (resid   39 and name HB# ) 3.5 4.2 3.3 !pk.2344 # H.18.HB3   A.39.QB   
assign (resid   16 and name HB  ) (resid   39 and name HB# ) 4.5 4.2 3.0 !pk.2346 # V.16.HB    A.39.QB   
assign (resid   16 and name HG2#) (resid   39 and name HB# ) 4.5 5.7 4.5 !pk.2348 # V.16.QG2   A.39.QB   
assign (resid   39 and name HB# ) (resid  110 and name HG2#) 4.5 5.7 4.5 !pk.2350 # A.39.QB    I.110.QG2 
assign (resid  100 and name HA  ) (resid  114 and name HN  ) 4.5 2.7 1.5 !pk.2352   M.100.HA   L.114.H   
assign (resid  100 and name HA  ) (resid  101 and name HB# ) 4.5 3.7 2.5 !pk.2356 # M.100.HA   S.101.HB2 
assign (resid  100 and name HA  ) (resid  101 and name HB# ) 4.5 3.7 2.5 !pk.2357 # M.100.HA   S.101.HB3 
assign (resid  100 and name HA  ) (resid  100 and name HG# ) 3.5 3.2 2.3 !pk.2359 # M.100.HA   M.100.HG3 
assign (resid   71 and name HB# ) (resid   72 and name HB# ) 4.5 5.2 4.0 !pk.2362 # K.71.QB    A.72.QB   
assign (resid   95 and name HD1#) (resid  100 and name HA  ) 4.5 4.2 3.0 !pk.2363 # L.95.QD1   M.100.HA  
assign (resid  110 and name HG2#) (resid  111 and name HN  ) 3.5 3.2 2.3 !pk.2365 # I.110.QG2  H.111.H   
assign (resid   50 and name HG2#) (resid   51 and name HN  ) 3.5 3.2 2.3 !pk.2367 # I.50.QG2   K.51.H    
assign (resid   50 and name HN  ) (resid   50 and name HG2#) 4.5 4.2 3.0 !pk.2368 # I.50.H     I.50.QG2  
assign (resid  105 and name HD# ) (resid  110 and name HG2#) 4.5 6.6 5.4 !pk.2370 # F.105.QD   I.110.QG2 
assign (resid  105 and name HE# ) (resid  110 and name HG2#) 4.5 6.6 5.4 !pk.2371 # F.105.QE   I.110.QG2 
assign (resid   50 and name HG2#) (resid   57 and name HD# ) 4.5 6.6 5.4 !pk.2373 # I.50.QG2   F.57.QD   
assign (resid  110 and name HA  ) (resid  110 and name HG2#) 3.5 3.2 2.3 !pk.2374 # I.110.HA   I.110.QG2 
assign (resid  103 and name HA  ) (resid  110 and name HG2#) 3.5 3.2 2.3 !pk.2375 # P.103.HA   I.110.QG2 
assign (resid   50 and name HA  ) (resid   50 and name HG2#) 3.5 3.2 2.3 !pk.2376 # I.50.HA    I.50.QG2  
assign (resid   50 and name HG2#) (resid   51 and name HA  ) 4.5 4.2 3.0 !pk.2377 # I.50.QG2   K.51.HA   
assign (resid   40 and name HA  ) (resid  110 and name HG2#) 4.5 4.2 3.0 !pk.2378 # L.40.HA    I.110.QG2 
assign (resid  103 and name HD# ) (resid  110 and name HG2#) 4.5 5.2 4.0 !pk.2379 # P.103.HD2  I.110.QG2 
assign (resid   50 and name HG2#) (resid   57 and name HA  ) 4.5 4.2 3.0 !pk.2380 # I.50.QG2   F.57.HA   
assign (resid   50 and name HG2#) (resid   57 and name HB# ) 4.5 5.2 4.0 !pk.2381 # I.50.QG2   F.57.HB3  
assign (resid   72 and name HB# ) (resid   75 and name HB# ) 3.5 4.2 3.3 !pk.2382 # A.72.QB    D.75.QB   
assign (resid   43 and name HB  ) (resid  110 and name HG2#) 4.5 4.2 3.0 !pk.2383 # I.43.HB    I.110.QG2 
assign (resid   50 and name HG2#) (resid   50 and name HG1#) 3.5 4.2 3.3 !pk.2385 # I.50.QG2   I.50.HG13 
assign (resid  103 and name HB# ) (resid  110 and name HG2#) 3.5 4.2 3.3 !pk.2386 # P.103.HB3  I.110.QG2 
assign (resid   50 and name HG2#) (resid   51 and name HG# ) 4.5 5.7 4.5 !pk.2388 # I.50.QG2   K.51.HG3  
assign (resid   43 and name HG1#) (resid  110 and name HG2#) 3.5 4.2 3.3 !pk.2389 # I.43.HG13  I.110.QG2 
assign (resid   40 and name HD1#) (resid  110 and name HG2#) 3.5 4.7 3.8 !pk.2390 # L.40.QD1   I.110.QG2 
assign (resid  110 and name HG2#) (resid  110 and name HD1#) 2.5 3.7 3.9 !pk.2392 # I.110.QG2  I.110.QD1 
assign (resid   50 and name HG2#) (resid   50 and name HG1#) 3.5 4.2 3.3 !pk.2393 # I.50.QG2   I.50.HG12 
assign (resid   12 and name HN  ) (resid  113 and name HG2#) 4.5 4.2 3.0 !pk.2394 # S.12.H     I.113.QG2 
assign (resid   79 and name HZ  ) (resid  113 and name HG2#) 4.5 4.7 3.5 !pk.2396 # F.79.HZ    I.113.QG2 
assign (resid   88 and name HE# ) (resid  113 and name HG2#) 4.5 6.6 5.4 !pk.2397 # F.88.QE    I.113.QG2 
assign (resid   88 and name HZ  ) (resid  113 and name HG2#) 4.5 4.7 3.5 !pk.2398 # F.88.HZ    I.113.QG2 
assign (resid   13 and name HA  ) (resid  113 and name HG2#) 4.5 4.2 3.0 !pk.2399 # H.13.HA    I.113.QG2 
assign (resid  101 and name HB# ) (resid  113 and name HG2#) 4.5 5.2 4.0 !pk.2401 # S.101.HB2  I.113.QG2 
assign (resid   92 and name HA  ) (resid  113 and name HG2#) 4.5 4.2 3.0 !pk.2402 # S.92.HA    I.113.QG2 
assign (resid   92 and name HB# ) (resid  113 and name HG2#) 4.5 5.2 4.0 !pk.2403 # S.92.HB2   I.113.QG2 
assign (resid  101 and name HB# ) (resid  113 and name HG2#) 4.5 5.2 4.0 !pk.2404 # S.101.HB3  I.113.QG2 
assign (resid   92 and name HB# ) (resid  113 and name HG2#) 4.5 5.2 4.0 !pk.2405 # S.92.HB3   I.113.QG2 
assign (resid   13 and name HB# ) (resid  113 and name HG2#) 4.5 5.2 4.0 !pk.2406 # H.13.HB3   I.113.QG2 
assign (resid   11 and name HB# ) (resid  113 and name HG2#) 3.5 4.2 3.3 !pk.2407 # C.11.HB2   I.113.QG2 
assign (resid   95 and name HG  ) (resid  113 and name HG2#) 4.5 4.2 3.0 !pk.2409 # L.95.HG    I.113.QG2 
assign (resid   95 and name HB# ) (resid  113 and name HG2#) 4.5 5.2 4.0 !pk.2410 # L.95.HB2   I.113.QG2 
assign (resid  113 and name HG2#) (resid  113 and name HG1#) 3.5 4.2 3.3 !pk.2413 # I.113.QG2  I.113.HG13
assign (resid   84 and name HE# ) (resid   85 and name HN  ) 4.5 4.2 3.0 !pk.2416 # M.84.QE    Q.85.H    
assign (resid    9 and name HG2#) (resid   79 and name HD# ) 4.5 6.6 5.4 !pk.2419 # V.9.QG2    F.79.QD   
assign (resid   79 and name HD# ) (resid   84 and name HE# ) 3.5 5.6 4.7 !pk.2420 # F.79.QD    M.84.QE   
assign (resid   79 and name HZ  ) (resid   84 and name HE# ) 4.5 4.7 3.5 !pk.2421 # F.79.HZ    M.84.QE   
assign (resid    9 and name HG2#) (resid   79 and name HZ  ) 3.5 3.7 2.8 !pk.2422 # V.9.QG2    F.79.HZ   
assign (resid   84 and name HE# ) (resid   88 and name HE# ) 4.5 6.6 5.4 !pk.2423 # M.84.QE    F.88.QE   
assign (resid   84 and name HE# ) (resid   88 and name HD# ) 4.5 6.6 5.4 !pk.2424 # M.84.QE    F.88.QD   
assign (resid    8 and name HA  ) (resid    9 and name HG2#) 4.5 4.2 3.0 !pk.2425 # R.8.HA     V.9.QG2   
assign (resid   84 and name HA  ) (resid   84 and name HE# ) 4.5 4.2 3.0 !pk.2426 # M.84.HA    M.84.QE   
assign (resid   76 and name HA  ) (resid   84 and name HE# ) 4.5 4.2 3.0 !pk.2427 # L.76.HA    M.84.QE   
assign (resid    9 and name HA  ) (resid    9 and name HG2#) 4.5 4.2 3.0 !pk.2428 # V.9.HA     V.9.QG2   
assign (resid   84 and name HE# ) (resid   89 and name HA  ) 4.5 4.2 3.0 !pk.2429 # M.84.QE    E.89.HA   
assign (resid    9 and name HG2#) (resid   92 and name HA  ) 4.5 4.2 3.0 !pk.2430 # V.9.QG2    S.92.HA   
assign (resid    9 and name HG2#) (resid   92 and name HB# ) 3.5 4.2 3.3 !pk.2432 # V.9.QG2    S.92.HB3  
assign (resid   79 and name HB# ) (resid   84 and name HE# ) 3.5 4.2 3.3 !pk.2433 # F.79.QB    M.84.QE   
assign (resid    9 and name HG2#) (resid   11 and name HB# ) 4.5 5.2 4.0 !pk.2434 # V.9.QG2    C.11.HB2  
assign (resid    9 and name HG2#) (resid   92 and name HG  ) 4.5 4.2 3.0 !pk.2434 # V.9.QG2    S.92.HG   
assign (resid    9 and name HG2#) (resid   11 and name HB# ) 4.5 5.2 4.0 !pk.2435 # V.9.QG2    C.11.HB3  
assign (resid    9 and name HG2#) (resid  115 and name HD# ) 4.5 5.7 4.5 !pk.2435 # V.9.QG2    R.115.HD2 
assign (resid   83 and name HB# ) (resid   84 and name HE# ) 4.5 5.2 4.0 !pk.2436 # Q.83.HB2   M.84.QE   
assign (resid    6 and name HG# ) (resid    9 and name HG2#) 4.5 5.2 4.0 !pk.2438 # P.6.QG     V.9.QG2   
assign (resid   84 and name HB# ) (resid   84 and name HE# ) 3.5 4.2 3.3 !pk.2439 # M.84.HB2   M.84.QE   
assign (resid   76 and name HD2#) (resid   84 and name HE# ) 3.5 4.7 3.8 !pk.2441 # L.76.QD2   M.84.QE   
assign (resid   76 and name HD1#) (resid   84 and name HE# ) 3.5 4.7 3.8 !pk.2442 # L.76.QD1   M.84.QE   
assign (resid   47 and name HG2#) (resid   51 and name HN  ) 4.5 4.2 3.0 !pk.2446 # I.47.QG2   K.51.H    
assign (resid   47 and name HN  ) (resid   47 and name HG2#) 4.5 4.2 3.0 !pk.2447 # I.47.H     I.47.QG2  
assign (resid   47 and name HG2#) (resid   52 and name HN  ) 4.5 4.2 3.0 !pk.2448 # I.47.QG2   S.52.H    
assign (resid   44 and name HA  ) (resid   47 and name HG2#) 4.5 4.2 3.0 !pk.2450 # N.44.HA    I.47.QG2  
assign (resid   47 and name HG2#) (resid   48 and name HA  ) 3.5 3.2 2.3 !pk.2451 # I.47.QG2   Q.48.HA   
assign (resid   47 and name HG2#) (resid   48 and name HG# ) 4.5 5.7 4.5 !pk.2454 # I.47.QG2   Q.48.QG   
assign (resid   47 and name HG2#) (resid   47 and name HG1#) 3.5 4.2 3.3 !pk.2456 # I.47.QG2   I.47.HG12 
assign (resid   47 and name HG2#) (resid   51 and name HG# ) 3.5 4.7 3.8 !pk.2457 # I.47.QG2   K.51.HG2  
assign (resid   47 and name HG2#) (resid   51 and name HG# ) 4.5 5.7 4.5 !pk.2458 # I.47.QG2   K.51.HG3  
assign (resid   51 and name HN  ) (resid  100 and name HE# ) 4.5 4.2 3.0 !pk.2459 # K.51.H     M.100.QE  
assign (resid   47 and name HN  ) (resid  100 and name HE# ) 4.5 4.2 3.0 !pk.2461 # I.47.H     M.100.QE  
assign (resid   15 and name HN  ) (resid   61 and name HB# ) 4.5 4.2 3.0 !pk.2462 # L.15.H     A.61.QB   
assign (resid   61 and name HB# ) (resid   64 and name HN  ) 4.5 4.2 3.0 !pk.2462 # A.61.QB    F.64.H    
assign (resid   50 and name HN  ) (resid  100 and name HE# ) 4.5 4.2 3.0 !pk.2463 # I.50.H     M.100.QE  
assign (resid   57 and name HE# ) (resid   61 and name HB# ) 4.5 6.6 5.4 !pk.2468 # F.57.QE    A.61.QB   
assign (resid  100 and name HA  ) (resid  100 and name HE# ) 4.5 4.2 3.0 !pk.2469 # M.100.HA   M.100.QE  
assign (resid   61 and name HB# ) (resid   74 and name HA# ) 4.5 5.2 4.0 !pk.2470 # A.61.QB    G.74.HA2  
assign (resid   50 and name HA  ) (resid  100 and name HE# ) 4.5 4.2 3.0 !pk.2471 # I.50.HA    M.100.QE  
assign (resid   51 and name HA  ) (resid  100 and name HE# ) 4.5 4.2 3.0 !pk.2472 # K.51.HA    M.100.QE  
assign (resid   27 and name HB# ) (resid   27 and name HE3 ) 3.5 3.2 2.3 !pk.2475 # W.27.HB2   W.27.HE3  
assign (resid   47 and name HA  ) (resid  100 and name HE# ) 3.5 3.2 2.3 !pk.2476 # I.47.HA    M.100.QE  
assign (resid  100 and name HG# ) (resid  100 and name HE# ) 3.5 4.7 3.8 !pk.2478 # M.100.HG2  M.100.QE  
assign (resid   50 and name HB  ) (resid  100 and name HE# ) 3.5 3.2 2.3 !pk.2479 # I.50.HB    M.100.QE  
assign (resid  100 and name HB# ) (resid  100 and name HE# ) 3.5 4.2 3.3 !pk.2479 # M.100.HB3  M.100.QE  
assign (resid   61 and name HB# ) (resid   70 and name HB# ) 4.5 5.7 4.5 !pk.2480 # A.61.QB    A.70.QB   
assign (resid   51 and name HG# ) (resid  100 and name HE# ) 3.5 4.7 3.8 !pk.2481 # K.51.HG3   M.100.QE  
assign (resid   60 and name HB# ) (resid   61 and name HB# ) 4.5 5.2 4.0 !pk.2482 # L.60.HB2   A.61.QB   
assign (resid   61 and name HB# ) (resid   73 and name HG# ) 4.5 5.7 4.5 !pk.2482 # A.61.QB    R.73.QG   
assign (resid   14 and name HG  ) (resid   61 and name HB# ) 4.5 4.2 3.0 !pk.2483 # L.14.HG    A.61.QB   
assign (resid   50 and name HG2#) (resid  100 and name HE# ) 3.5 4.7 3.8 !pk.2484 # I.50.QG2   M.100.QE  
assign (resid   47 and name HG2#) (resid  100 and name HE# ) 2.5 3.7 3.9 !pk.2485 # I.47.QG2   M.100.QE  
assign (resid   50 and name HD1#) (resid  100 and name HE# ) 3.5 4.7 3.8 !pk.2486 # I.50.QD1   M.100.QE  
assign (resid  100 and name HE# ) (resid  114 and name HD1#) 4.5 5.7 4.5 !pk.2487 # M.100.QE   L.114.QD1 
assign (resid   14 and name HD1#) (resid   61 and name HB# ) 4.5 5.7 4.5 !pk.2488 # L.14.QD1   A.61.QB   
assign (resid   43 and name HG2#) (resid  104 and name HN  ) 4.5 4.2 3.0 !pk.2489 # I.43.QG2   V.104.H   
assign (resid   43 and name HG2#) (resid   46 and name HD# ) 4.5 6.6 5.4 !pk.2492 # I.43.QG2   Y.46.QD   
assign (resid   43 and name HG2#) (resid   44 and name HA  ) 4.5 4.2 3.0 !pk.2493 # I.43.QG2   N.44.HA   
assign (resid   43 and name HG2#) (resid  102 and name HA# ) 4.5 5.2 4.0 !pk.2495 # I.43.QG2   G.102.HA3 
assign (resid   43 and name HA  ) (resid   43 and name HG2#) 3.5 3.2 2.3 !pk.2496 # I.43.HA    I.43.QG2  
assign (resid   43 and name HG2#) (resid   46 and name HB# ) 4.5 5.2 4.0 !pk.2497 # I.43.QG2   Y.46.HB2  
assign (resid   43 and name HG2#) (resid   44 and name HB# ) 4.5 5.2 4.0 !pk.2498 # I.43.QG2   N.44.HB2  
assign (resid   43 and name HG2#) (resid   47 and name HG1#) 4.5 5.2 4.0 !pk.2500 # I.43.QG2   I.47.HG12 
assign (resid   43 and name HG2#) (resid  103 and name HB# ) 3.5 4.2 3.3 !pk.2501 # I.43.QG2   P.103.HB3 
assign (resid   43 and name HG2#) (resid   43 and name HG1#) 3.5 4.2 3.3 !pk.2502 # I.43.QG2   I.43.HG12 
assign (resid   43 and name HG2#) (resid   43 and name HG1#) 3.5 4.2 3.3 !pk.2503 # I.43.QG2   I.43.HG13 
assign (resid   43 and name HG2#) (resid   47 and name HD1#) 3.5 4.7 3.8 !pk.2504 # I.43.QG2   I.47.QD1  
assign (resid   43 and name HG2#) (resid  110 and name HG2#) 3.5 4.7 3.8 !pk.2505 # I.43.QG2   I.110.QG2 
assign (resid   18 and name HN  ) (resid   32 and name HG2#) 4.5 4.2 3.0 !pk.2507 # H.18.H     I.32.QG2  
assign (resid   32 and name HG2#) (resid   34 and name HH1#) 4.5 5.7 4.5 !pk.2510 # I.32.QG2   R.34.HH12 
assign (resid   24 and name HA  ) (resid   32 and name HG2#) 4.5 4.2 3.0 !pk.2511 # P.24.HA    I.32.QG2  
assign (resid   19 and name HA  ) (resid   32 and name HG2#) 4.5 4.2 3.0 !pk.2512 # S.19.HA    I.32.QG2  
assign (resid   32 and name HA  ) (resid   32 and name HG2#) 3.5 3.2 2.3 !pk.2513 # I.32.HA    I.32.QG2  
assign (resid   19 and name HB# ) (resid   32 and name HG2#) 4.5 5.2 4.0 !pk.2514 # S.19.HB3   I.32.QG2  
assign (resid   32 and name HG2#) (resid   34 and name HD# ) 4.5 5.7 4.5 !pk.2514 # I.32.QG2   R.34.HD3  
assign (resid   18 and name HB# ) (resid   32 and name HG2#) 4.5 5.2 4.0 !pk.2516 # H.18.HB2   I.32.QG2  
assign (resid   18 and name HB# ) (resid   32 and name HG2#) 4.5 5.2 4.0 !pk.2517 # H.18.HB3   I.32.QG2  
assign (resid   24 and name HB# ) (resid   32 and name HG2#) 4.5 5.2 4.0 !pk.2518 # P.24.HB2   I.32.QG2  
assign (resid   32 and name HG2#) (resid   34 and name HD# ) 4.5 5.7 4.5 !pk.2518 # I.32.QG2   R.34.HD2  
assign (resid   32 and name HG2#) (resid   34 and name HB# ) 4.5 5.2 4.0 !pk.2519 # I.32.QG2   R.34.HB2  
assign (resid   32 and name HG2#) (resid   34 and name HG# ) 3.5 4.7 3.8 !pk.2520 # I.32.QG2   R.34.HG2  
assign (resid   32 and name HG2#) (resid   34 and name HG# ) 4.5 5.7 4.5 !pk.2521 # I.32.QG2   R.34.HG3  
assign (resid   11 and name HN  ) (resid   78 and name HA  ) 4.5 2.7 1.5 !pk.2526   C.11.H     A.78.HA   
assign (resid    5 and name HA  ) (resid    6 and name HD# ) 3.5 2.7 1.8 !pk.2527 # E.5.HA     P.6.QD    
assign (resid    5 and name HG# ) (resid    6 and name HD# ) 3.5 4.2 3.3 !pk.2528 # E.5.QG     P.6.QD    
assign (resid   78 and name HA  ) (resid   79 and name HD# ) 4.5 5.1 3.9 !pk.2532 # A.78.HA    F.79.QD   
assign (resid  105 and name HD# ) (resid  110 and name HD1#) 4.5 6.6 5.4 !pk.2534 # F.105.QD   I.110.QD1 
assign (resid  105 and name HE# ) (resid  110 and name HD1#) 3.5 5.6 4.7 !pk.2535 # F.105.QE   I.110.QD1 
assign (resid  110 and name HA  ) (resid  110 and name HD1#) 4.5 4.2 3.0 !pk.2537 # I.110.HA   I.110.QD1 
assign (resid   39 and name HB# ) (resid  110 and name HD1#) 2.5 3.7 3.9 !pk.2541 # A.39.QB    I.110.QD1 
assign (resid   40 and name HN  ) (resid  110 and name HD1#) 3.5 3.2 2.3 !pk.2543 # L.40.H     I.110.QD1 
assign (resid   41 and name HN  ) (resid  110 and name HD1#) 4.5 4.2 3.0 !pk.2544 # E.41.H     I.110.QD1 
assign (resid   85 and name HA  ) (resid   87 and name HD# ) 4.5 3.7 2.5 !pk.2548 # Q.85.HA    P.87.HD3  
assign (resid   86 and name HB# ) (resid   87 and name HD# ) 3.5 3.7 2.8 !pk.2556 # K.86.HB2   P.87.HD2  
assign (resid   40 and name HB# ) (resid  110 and name HD1#) 3.5 4.2 3.3 !pk.2558 # L.40.HB2   I.110.QD1 
assign (resid   86 and name HG# ) (resid   87 and name HD# ) 4.5 5.2 4.0 !pk.2559 # K.86.HG3   P.87.HD2  
assign (resid   87 and name HD# ) (resid  106 and name HG2#) 4.5 5.2 4.0 !pk.2560 # P.87.HD3   T.106.QG2 
assign (resid   50 and name HD1#) (resid   57 and name HN  ) 4.5 4.2 3.0 !pk.2561 # I.50.QD1   F.57.H    
assign (resid   91 and name HN  ) (resid  113 and name HD1#) 4.5 4.2 3.0 !pk.2564 # A.91.H     I.113.QD1 
assign (resid   88 and name HE# ) (resid  113 and name HD1#) 4.5 6.6 5.4 !pk.2566 # F.88.QE    I.113.QD1 
assign (resid  101 and name HG  ) (resid  113 and name HD1#) 4.5 4.2 3.0 !pk.2567 # S.101.HG   I.113.QD1 
assign (resid   88 and name HD# ) (resid  113 and name HD1#) 4.5 6.6 5.4 !pk.2568 # F.88.QD    I.113.QD1 
assign (resid  101 and name HB# ) (resid  113 and name HD1#) 4.5 5.2 4.0 !pk.2569 # S.101.HB2  I.113.QD1 
assign (resid   50 and name HA  ) (resid   50 and name HD1#) 4.5 4.2 3.0 !pk.2570 # I.50.HA    I.50.QD1  
assign (resid   92 and name HA  ) (resid  113 and name HD1#) 4.5 4.2 3.0 !pk.2571 # S.92.HA    I.113.QD1 
assign (resid   92 and name HB# ) (resid  113 and name HD1#) 4.5 5.2 4.0 !pk.2572 # S.92.HB2   I.113.QD1 
assign (resid   88 and name HA  ) (resid  113 and name HD1#) 3.5 3.2 2.3 !pk.2573 # F.88.HA    I.113.QD1 
assign (resid   50 and name HD1#) (resid   57 and name HA  ) 3.5 3.2 2.3 !pk.2574 # I.50.QD1   F.57.HA   
assign (resid   88 and name HB# ) (resid  113 and name HD1#) 4.5 5.2 4.0 !pk.2575 # F.88.HB2   I.113.QD1 
assign (resid   92 and name HG  ) (resid  113 and name HD1#) 3.5 3.2 2.3 !pk.2576 # S.92.HG    I.113.QD1 
assign (resid   50 and name HD1#) (resid   57 and name HB# ) 4.5 5.2 4.0 !pk.2577 # I.50.QD1   F.57.HB3  
assign (resid   11 and name HB# ) (resid  113 and name HD1#) 4.5 5.2 4.0 !pk.2578 # C.11.HB3   I.113.QD1 
assign (resid   46 and name HB# ) (resid   50 and name HD1#) 4.5 5.2 4.0 !pk.2579 # Y.46.HB3   I.50.QD1  
assign (resid   50 and name HB  ) (resid   50 and name HD1#) 3.5 3.2 2.3 !pk.2582 # I.50.HB    I.50.QD1  
assign (resid   91 and name HB# ) (resid  113 and name HD1#) 2.5 3.7 3.9 !pk.2583 # A.91.QB    I.113.QD1 
assign (resid   50 and name HG2#) (resid   50 and name HD1#) 2.5 3.7 3.9 !pk.2584 # I.50.QG2   I.50.QD1  
assign (resid  104 and name HG2#) (resid  113 and name HD1#) 3.5 4.7 3.8 !pk.2585 # V.104.QG2  I.113.QD1 
assign (resid  113 and name HG2#) (resid  113 and name HD1#) 2.5 3.7 3.9 !pk.2586 # I.113.QG2  I.113.QD1 
assign (resid   14 and name HD1#) (resid   50 and name HD1#) 4.5 5.7 4.5 !pk.2588 # L.14.QD1   I.50.QD1  
assign (resid   43 and name HN  ) (resid  112 and name HD1#) 4.5 4.2 3.0 !pk.2589 # I.43.H     I.112.QD1 
assign (resid   46 and name HN  ) (resid  112 and name HD1#) 4.5 4.2 3.0 !pk.2589 # Y.46.H     I.112.QD1 
assign (resid   57 and name HD# ) (resid  112 and name HD1#) 4.5 6.6 5.4 !pk.2590 # F.57.QD    I.112.QD1 
assign (resid   57 and name HE# ) (resid  112 and name HD1#) 4.5 6.6 5.4 !pk.2591 # F.57.QE    I.112.QD1 
assign (resid  102 and name HA# ) (resid  103 and name HD# ) 3.5 3.7 2.8 !pk.2593 # G.102.HA2  P.103.HD3 
assign (resid  112 and name HA  ) (resid  112 and name HD1#) 4.5 4.2 3.0 !pk.2594 # I.112.HA   I.112.QD1 
assign (resid  102 and name HA# ) (resid  103 and name HD# ) 3.5 3.7 2.8 !pk.2595 # G.102.HA3  P.103.HD2 
assign (resid  102 and name HA# ) (resid  103 and name HD# ) 3.5 3.7 2.8 !pk.2596 # G.102.HA3  P.103.HD3 
assign (resid   46 and name HB# ) (resid  112 and name HD1#) 3.5 4.2 3.3 !pk.2597 # Y.46.HB2   I.112.QD1 
assign (resid   14 and name HB# ) (resid  112 and name HD1#) 3.5 4.2 3.3 !pk.2604 # L.14.HB2   I.112.QD1 
assign (resid   14 and name HG  ) (resid  112 and name HD1#) 4.5 4.2 3.0 !pk.2605 # L.14.HG    I.112.QD1 
assign (resid   43 and name HG1#) (resid  112 and name HD1#) 4.5 5.2 4.0 !pk.2605 # I.43.HG13  I.112.QD1 
assign (resid   47 and name HD1#) (resid  103 and name HD# ) 4.5 5.2 4.0 !pk.2606 # I.47.QD1   P.103.HD3 
assign (resid   43 and name HG2#) (resid  103 and name HD# ) 4.5 5.2 4.0 !pk.2607 # I.43.QG2   P.103.HD3 
assign (resid   43 and name HG2#) (resid  112 and name HD1#) 2.5 3.7 3.9 !pk.2608 # I.43.QG2   I.112.QD1 
assign (resid   14 and name HD1#) (resid  112 and name HD1#) 3.5 4.7 3.8 !pk.2610 # L.14.QD1   I.112.QD1 
assign (resid   47 and name HN  ) (resid   47 and name HD1#) 3.5 3.2 2.3 !pk.2611 # I.47.H     I.47.QD1  
assign (resid   47 and name HD1#) (resid   48 and name HN  ) 4.5 4.2 3.0 !pk.2612 # I.47.QD1   Q.48.H    
assign (resid   47 and name HD1#) (resid  102 and name HN  ) 4.5 4.2 3.0 !pk.2612 # I.47.QD1   G.102.H   
assign (resid   47 and name HA  ) (resid   47 and name HD1#) 4.5 4.2 3.0 !pk.2614 # I.47.HA    I.47.QD1  
assign (resid   47 and name HD1#) (resid  100 and name HE# ) 4.5 5.7 4.5 !pk.2615 # I.47.QD1   M.100.QE  
assign (resid   47 and name HB  ) (resid   47 and name HD1#) 3.5 3.2 2.3 !pk.2616 # I.47.HB    I.47.QD1  
assign (resid   44 and name HA  ) (resid   47 and name HD1#) 3.5 3.2 2.3 !pk.2617 # N.44.HA    I.47.QD1  
assign (resid   43 and name HN  ) (resid   46 and name HE# ) 4.5 5.1 3.9 !pk.2618 # I.43.H     Y.46.QE   
assign (resid   46 and name HE# ) (resid   64 and name HE# ) 4.5 7.5 6.3 !pk.2619 # Y.46.QE    F.64.QE   
assign (resid   46 and name HE# ) (resid   64 and name HD# ) 4.5 7.5 6.3 !pk.2620 # Y.46.QE    F.64.QD   
assign (resid   42 and name HA  ) (resid   46 and name HE# ) 4.5 5.1 3.9 !pk.2623 # L.42.HA    Y.46.QE   
assign (resid   43 and name HA  ) (resid   46 and name HE# ) 4.5 5.1 3.9 !pk.2623 # I.43.HA    Y.46.QE   
assign (resid   46 and name HE# ) (resid   64 and name HB# ) 4.5 6.1 4.9 !pk.2624 # Y.46.QE    F.64.HB2  
assign (resid   46 and name HE# ) (resid   64 and name HB# ) 4.5 6.1 4.9 !pk.2627 # Y.46.QE    F.64.HB3  
assign (resid   42 and name HB# ) (resid   46 and name HE# ) 4.5 6.1 4.9 !pk.2628 # L.42.HB2   Y.46.QE   
assign (resid   42 and name HG  ) (resid   46 and name HE# ) 4.5 5.1 3.9 !pk.2629 # L.42.HG    Y.46.QE   
assign (resid   43 and name HG1#) (resid   46 and name HE# ) 4.5 6.1 4.9 !pk.2629 # I.43.HG12  Y.46.QE   
assign (resid   46 and name HE# ) (resid   49 and name HD# ) 4.5 6.6 5.4 !pk.2629 # Y.46.QE    K.49.HD3  
assign (resid   16 and name HG1#) (resid   46 and name HE# ) 4.5 6.6 5.4 !pk.2630 # V.16.QG1   Y.46.QE   
assign (resid   16 and name HG2#) (resid   46 and name HE# ) 3.5 5.6 4.7 !pk.2631 # V.16.QG2   Y.46.QE   
assign (resid   46 and name HE# ) (resid   60 and name HD1#) 3.5 5.6 4.7 !pk.2632 # Y.46.QE    L.60.QD1  
assign (resid   14 and name HD1#) (resid   46 and name HE# ) 4.5 6.6 5.4 !pk.2633 # L.14.QD1   Y.46.QE   
assign (resid   57 and name HE# ) (resid  114 and name HB# ) 4.5 6.1 4.9 !pk.2636 # F.57.QE    L.114.HB2 
assign (resid   18 and name HD2 ) (resid  109 and name HA# ) 4.5 4.2 3.0 !pk.2638 # H.18.HD2   G.109.HA3 
assign (resid   73 and name HB# ) (resid   73 and name HD# ) 3.5 4.2 3.3 !pk.2644 # R.73.HB2   R.73.HD3  
assign (resid   95 and name HD1#) (resid  115 and name HG# ) 4.5 5.7 4.5 !pk.2646 # L.95.QD1   R.115.HG2 
assign (resid   15 and name HB# ) (resid   15 and name HD1#) 4.5 5.2 4.0 !pk.2648 # L.15.HB3   L.15.QD1  
assign (resid   85 and name HB# ) (resid   88 and name HB# ) 4.5 4.7 3.5 !pk.2650 # Q.85.HB3   F.88.HB2  
assign (resid   13 and name HE1 ) (resid   15 and name HD1#) 4.5 4.7 3.5 !pk.2660 # H.13.HE1   L.15.QD1  
assign (resid   13 and name HE1 ) (resid   15 and name HD2#) 4.5 4.7 3.5 !pk.2661 # H.13.HE1   L.15.QD2  
assign (resid   47 and name HD1#) (resid  103 and name HD# ) 3.5 4.2 3.3 !pk.2663 # I.47.QD1   P.103.HD2 
assign (resid  102 and name HA# ) (resid  103 and name HD# ) 3.5 3.7 2.8 !pk.2664 # G.102.HA2  P.103.HD2 
assign (resid  113 and name HN  ) (resid  100 and name HG# ) 4.5 4.2 3.0 !pk.157 # I.113.H    M.100.HG2 
assign (resid   72 and name HN  ) (resid   71 and name HB# ) 4.5 3.7 2.5 !pk.234 # A.72.H     K.71.QB   
assign (resid   39 and name HN  ) (resid   36 and name HG# ) 4.5 4.2 3.0 !pk.380 # A.39.H     K.36.HG2  
assign (resid   25 and name HN  ) (resid   17 and name HE# ) 4.5 4.2 3.0 !pk.478 # S.25.H     K.17.HE3  
assign (resid   78 and name HN  ) (resid   10 and name HD# ) 4.5 4.2 3.0 !pk.564 # A.78.H     R.10.HD2  
assign (resid   41 and name HN  ) (resid   41 and name HA  ) 4.5 2.7 1.5 !pk.572   E.41.H     E.41.HA   
assign (resid   26 and name HN  ) (resid   30 and name HA  ) 4.5 2.7 1.5 !pk.597   S.26.H     E.30.HA   
assign (resid   26 and name HN  ) (resid   30 and name HB# ) 4.5 3.7 2.5 !pk.663 # S.26.H     E.30.HB2  
assign (resid   56 and name HN  ) (resid   59 and name HB# ) 4.5 3.7 2.5 !pk.682 # D.56.H     S.59.HB2  
assign (resid   11 and name HN  ) (resid   78 and name HA  ) 4.5 2.7 1.5 !pk.765   C.11.H     A.78.HA   
assign (resid   59 and name HN  ) (resid   59 and name HB# ) 4.5 3.7 2.5 !pk.851 # S.59.H     S.59.HB3  
assign (resid   62 and name HN  ) (resid   62 and name HB# ) 4.5 3.7 2.5 !pk.1183 # S.62.H     S.62.HB3  
assign (resid   32 and name HD1#) (resid   29 and name HG# ) 4.5 5.7 4.5 !pk.22  # I.32.QD1   Q.29.QG   
assign (resid   14 and name HB# ) (resid  112 and name HB  ) 4.5 3.7 2.5 !pk.54  # L.14.HB2   I.112.HB  
assign (resid   14 and name HB# ) (resid  112 and name HB  ) 4.5 3.7 2.5 !pk.55  # L.14.HB3   I.112.HB  
assign (resid  102 and name HA# ) (resid  103 and name HD# ) 4.5 4.7 3.5 !pk.130 # G.102.HA2  P.103.HD2 
assign (resid  102 and name HA# ) (resid  103 and name HD# ) 4.5 4.7 3.5 !pk.131 # G.102.HA3  P.103.HD3 
assign (resid   56 and name HB# ) (resid   57 and name HB# ) 4.5 4.7 3.5 !pk.221 # D.56.HB3   F.57.HB2  
assign (resid  113 and name HB  ) (resid  112 and name HB  ) 4.5 2.7 1.5 !pk.293   I.113.HB   I.112.HB  
assign (resid  107 and name HB# ) (resid   22 and name HD# ) 4.5 5.2 4.0 !pk.405 # D.107.QB   R.22.HD3  
assign (resid  107 and name HB# ) (resid   22 and name HB# ) 4.5 4.7 3.5 !pk.408 # D.107.QB   R.22.QB   
assign (resid  107 and name HB# ) (resid   22 and name HG# ) 4.5 5.2 4.0 !pk.409 # D.107.QB   R.22.QG   
assign (resid   99 and name HG# ) (resid   96 and name HB# ) 4.5 5.2 4.0 !pk.524 # E.99.HG2   R.96.HB3  
assign (resid   25 and name HB# ) (resid   30 and name HA  ) 4.5 3.7 2.5 !pk.905 # S.25.HB2   E.30.HA   
assign (resid   81 and name HG# ) (resid   81 and name HH2#) 4.5 5.7 4.5 !pk.1158 # R.81.HG3   R.81.HH22 
assign (resid   92 and name HB# ) (resid   95 and name HG  ) 4.5 3.7 2.5 !pk.1169 # S.92.HB2   L.95.HG   
assign (resid   34 and name HG# ) (resid   18 and name HA  ) 4.5 4.2 3.0 !pk.1293 # R.34.HG3   H.18.HA   
assign (resid   15 and name HD2#) (resid  108 and name HB# ) 4.5 5.2 4.0 !pk.1472 # L.15.QD2   S.108.QB  
assign (resid   21 and name HA  ) (resid   21 and name HN  ) 4.5 2.7 1.5 !pk.1517   S.21.HA    S.21.H    
assign (resid   14 and name HD1#) (resid  112 and name HB  ) 4.5 4.2 3.0 !pk.1557 # L.14.QD1   I.112.HB  
assign (resid   60 and name HD1#) (resid   50 and name HG2#) 4.5 5.7 4.5 !pk.1566 # L.60.QD1   I.50.QG2  
assign (resid  105 and name HZ  ) (resid   40 and name HD1#) 4.5 4.7 3.5 !pk.1611 # F.105.HZ   L.40.QD1  
assign (resid   79 and name HZ  ) (resid   92 and name HA  ) 4.5 3.2 2.0 !pk.1647 # F.79.HZ    S.92.HA   
assign (resid   79 and name HZ  ) (resid   76 and name HB# ) 4.5 4.2 3.0 !pk.1668 # F.79.HZ    L.76.HB2  
assign (resid   95 and name HG  ) (resid   92 and name HB# ) 4.5 3.7 2.5 !pk.1747 # L.95.HG    S.92.HB2  
assign (resid  115 and name HA  ) (resid   95 and name HD1#) 4.5 4.2 3.0 !pk.2080 # R.115.HA   L.95.QD1  
assign (resid   33 and name HG2#) (resid   33 and name HB  ) 4.5 4.2 3.0 !pk.2150 # T.33.QG2   T.33.HB   
assign (resid   78 and name HB# ) (resid   10 and name HB# ) 4.5 5.2 4.0 !pk.2247 # A.78.QB    R.10.HB2  
assign (resid   15 and name HD1#) (resid  111 and name HE1 ) 4.5 4.7 3.5 !pk.2261 # L.15.QD1   H.111.HE1 
assign (resid  113 and name HG2#) (resid   95 and name HB# ) 4.5 5.2 4.0 !pk.2411 # I.113.QG2  L.95.HB3  
assign (resid   84 and name HE# ) (resid   76 and name HB# ) 4.5 5.2 4.0 !pk.2437 # M.84.QE    L.76.HB3  
assign (resid   34 and name HN  ) (resid   34 and name HA  ) 4.5 2.7 1.5 !pk.228   R.34.H     R.34.HA   
assign (resid   46 and name HN  ) (resid  112 and name HD1#) 4.5 4.2 3.0 !pk.266 # Y.46.H     I.112.QD1 
assign (resid   99 and name HN  ) (resid   97 and name HB  ) 4.5 2.7 1.5 !pk.362   E.99.H     T.97.HB   
assign (resid   37 and name HN  ) (resid   35 and name HA  ) 4.5 2.7 1.5 !pk.690   E.37.H     T.35.HA   
assign (resid   33 and name HN  ) (resid   32 and name HB  ) 4.5 2.7 1.5 !pk.824   T.33.H     I.32.HB   
assign (resid  112 and name HN  ) (resid  104 and name HB  ) 4.5 2.7 1.5 !pk.924   I.112.H    V.104.HB  
assign (resid   70 and name HN  ) (resid   62 and name HN  ) 4.5 2.7 1.5 !pk.1170   A.70.H     S.62.H    
assign (resid   26 and name HN  ) (resid   32 and name HG1#) 4.5 3.7 2.5 !pk.1203 # S.26.H     I.32.HG12 
assign (resid   10 and name HD# ) (resid   10 and name HB# ) 4.5 5.2 4.0 !pk.154 # R.10.HD3   R.10.HB3  
assign (resid  100 and name HB# ) (resid  112 and name HG2#) 4.5 5.2 4.0 !pk.508 # M.100.HB3  I.112.QG2 
assign (resid   89 and name HG# ) (resid   81 and name HG# ) 4.5 5.7 4.5 !pk.509 # E.89.HG2   R.81.HG3  
assign (resid   51 and name HD# ) (resid   48 and name HN  ) 4.5 4.2 3.0 !pk.1113 # K.51.QD    Q.48.H    
assign (resid   11 and name HB# ) (resid   95 and name HB# ) 4.5 4.7 3.5 !pk.717 # C.11.QB    L.95.HB3  
assign (resid   92 and name HA  ) (resid  113 and name HG2#) 4.5 4.2 3.0 !pk.1176 # S.92.HA    I.113.QG2 
assign (resid    6 and name HG# ) (resid  115 and name HH1#) 4.5 5.2 4.0 !pk.1377 # P.6.QG     R.115.QH1 
assign (resid   22 and name HG# ) (resid   22 and name HD# ) 4.5 5.7 4.5 !pk.1594 # R.22.QG    R.22.QD   
assign (resid   79 and name HZ  ) (resid   89 and name HG# ) 4.5 4.7 3.5 !pk.1660 # F.79.HZ    E.89.HG3  
assign (resid   51 and name HA  ) (resid   52 and name HN  ) 4.5 2.7 1.5 !pk.1777   K.51.HA    S.52.H    
assign (resid   27 and name HD1 ) (resid   63 and name HA  ) 4.5 3.2 2.0 !pk.1950 # W.27.HD1   Q.63.HA   
assign (resid   11 and name HA  ) (resid   76 and name HB# ) 4.5 3.7 2.5 !pk.2164 # C.11.HA    L.76.HB2  
assign (resid   17 and name HD# ) (resid   25 and name HN  ) 4.5 4.2 3.0 !pk.2665 # K.17.HD2   S.25.H    
assign (resid   17 and name HD# ) (resid   32 and name HD1#) 4.5 5.7 4.5 !pk.2666 # K.17.HD2   I.32.QD1  

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           1HT      GLY   1  13.121  28.468  -4.299
    2    H2   GLY   1           2HT      GLY   1  13.190  29.395  -5.710
    3    H3   GLY   1           3HT      GLY   1  14.212  28.058  -5.530
    4    HA2  GLY   1           1HA      GLY   1  12.418  27.527  -7.013
    5    HA3  GLY   1           2HA      GLY   1  12.309  26.579  -5.536
    6    H    SER   2           HN       SER   2  10.100  26.867  -7.085
    7    HA   SER   2           HA       SER   2   8.530  29.094  -6.130
    8    HB2  SER   2           2HB      SER   2   8.362  28.181  -8.471
    9    HB3  SER   2           1HB      SER   2   7.627  26.732  -7.791
   10    HG   SER   2           HG       SER   2   5.890  27.944  -7.104
   11    H    HIS   3           HN       HIS   3   8.537  25.553  -5.761
   12    HA   HIS   3           HA       HIS   3   6.707  25.904  -3.484
   13    HB2  HIS   3           2HB      HIS   3   6.056  23.548  -3.738
   14    HB3  HIS   3           1HB      HIS   3   5.778  24.433  -5.229
   15    HD1  HIS   3           1HD      HIS   3   6.855  23.515  -7.309
   16    HD2  HIS   3           2HD      HIS   3   8.335  21.746  -3.849
   17    HE1  HIS   3           1HE      HIS   3   8.306  21.628  -8.086
   18    HE2  HIS   3           2HE      HIS   3   9.282  20.641  -5.988
   19    H    MET   4           HN       MET   4   7.112  24.767  -1.549
   20    HA   MET   4           HA       MET   4   9.969  24.282  -1.101
   21    HB2  MET   4           2HB      MET   4   7.699  24.635   0.869
   22    HB3  MET   4           1HB      MET   4   9.390  24.430   1.300
   23    HG2  MET   4           2HG      MET   4   9.929  26.525   0.153
   24    HG3  MET   4           1HG      MET   4   8.227  26.730  -0.254
   25    HE1  MET   4           3HE      MET   4   6.606  27.211   3.290
   26    HE2  MET   4           1HE      MET   4   6.837  25.665   2.474
   27    HE3  MET   4           2HE      MET   4   6.314  27.075   1.557
   28    H    GLU   5           HN       GLU   5  10.060  22.561   0.947
   29    HA   GLU   5           HA       GLU   5   9.508  20.066  -0.245
   30    HB2  GLU   5           2HB      GLU   5  11.308  20.553   1.461
   31    HB3  GLU   5           1HB      GLU   5  10.047  20.583   2.684
   32    HG2  GLU   5           2HG      GLU   5   9.481  18.261   2.140
   33    HG3  GLU   5           1HG      GLU   5  10.776  18.237   0.944
   34    HA   PRO   6           HA       PRO   6   5.141  19.685   0.518
   35    HB2  PRO   6           2HB      PRO   6   5.888  16.807   0.760
   36    HB3  PRO   6           1HB      PRO   6   4.613  17.560  -0.204
   37    HG2  PRO   6           2HG      PRO   6   6.858  16.725  -1.350
   38    HG3  PRO   6           1HG      PRO   6   6.076  18.229  -1.864
   39    HD2  PRO   6           2HD      PRO   6   8.529  17.834  -0.223
   40    HD3  PRO   6           1HD      PRO   6   8.134  19.122  -1.379
   41    H    ALA   7           HN       ALA   7   4.371  20.253   2.448
   42    HA   ALA   7           HA       ALA   7   5.368  19.078   4.896
   43    HB1  ALA   7           1HB      ALA   7   3.812  20.600   6.008
   44    HB2  ALA   7           2HB      ALA   7   3.095  21.022   4.453
   45    HB3  ALA   7           3HB      ALA   7   4.766  21.464   4.803
   46    H    ARG   8           HN       ARG   8   2.780  18.698   2.687
   47    HA   ARG   8           HA       ARG   8   1.781  16.399   4.193
   48    HB2  ARG   8           2HB      ARG   8   0.120  18.619   3.018
   49    HB3  ARG   8           1HB      ARG   8  -0.537  17.023   3.337
   50    HG2  ARG   8           2HG      ARG   8   0.162  17.343   5.727
   51    HG3  ARG   8           1HG      ARG   8   0.504  19.025   5.306
   52    HD2  ARG   8           2HD      ARG   8  -1.777  19.363   4.618
   53    HD3  ARG   8           1HD      ARG   8  -2.140  17.657   4.869
   54    HE   ARG   8           HE       ARG   8  -1.274  19.326   7.119
   55   HH11  ARG   8          1HH1      ARG   8  -3.691  17.279   5.596
   56   HH12  ARG   8          2HH1      ARG   8  -4.723  17.252   6.978
   57   HH21  ARG   8          1HH2      ARG   8  -2.621  19.267   8.955
   58   HH22  ARG   8          2HH2      ARG   8  -4.116  18.398   8.903
   59    H    VAL   9           HN       VAL   9   1.076  14.721   2.906
   60    HA   VAL   9           HA       VAL   9   1.082  15.151   0.011
   61    HB   VAL   9           HB       VAL   9   2.220  12.948  -0.331
   62   HG11  VAL   9          1HG1      VAL   9   3.861  15.025   1.106
   63   HG12  VAL   9          2HG1      VAL   9   3.448  15.029  -0.609
   64   HG13  VAL   9          3HG1      VAL   9   4.489  13.765   0.044
   65   HG21  VAL   9          3HG2      VAL   9   3.562  12.008   1.501
   66   HG22  VAL   9          1HG2      VAL   9   1.837  11.969   1.866
   67   HG23  VAL   9          2HG2      VAL   9   2.867  13.192   2.608
   68    H    ARG  10           HN       ARG  10  -0.368  13.929  -1.109
   69    HA   ARG  10           HA       ARG  10  -2.243  12.399   0.528
   70    HB2  ARG  10           2HB      ARG  10  -3.270  14.104  -0.876
   71    HB3  ARG  10           1HB      ARG  10  -2.482  13.437  -2.301
   72    HG2  ARG  10           2HG      ARG  10  -3.742  11.347  -1.994
   73    HG3  ARG  10           1HG      ARG  10  -4.573  12.079  -0.623
   74    HD2  ARG  10           2HD      ARG  10  -5.590  13.715  -2.032
   75    HD3  ARG  10           1HD      ARG  10  -4.612  13.208  -3.410
   76    HE   ARG  10           HE       ARG  10  -6.117  11.037  -2.381
   77   HH11  ARG  10          1HH1      ARG  10  -6.457  13.954  -4.338
   78   HH12  ARG  10          2HH1      ARG  10  -7.793  13.323  -5.247
   79   HH21  ARG  10          1HH2      ARG  10  -7.871  10.226  -3.585
   80   HH22  ARG  10          2HH2      ARG  10  -8.595  11.188  -4.821
   81    H    CYS  11           HN       CYS  11  -1.829  10.317   0.657
   82    HA   CYS  11           HA       CYS  11  -0.955   8.956  -1.779
   83    HB2  CYS  11           2HB      CYS  11   0.245   8.555   0.962
   84    HB3  CYS  11           1HB      CYS  11   0.619   7.595  -0.466
   85    HG   CYS  11           HG       CYS  11   1.044  10.760  -1.180
   86    H    SER  12           HN       SER  12  -1.660   6.927  -2.065
   87    HA   SER  12           HA       SER  12  -3.722   5.967  -0.221
   88    HB2  SER  12           2HB      SER  12  -3.113   5.059  -3.047
   89    HB3  SER  12           1HB      SER  12  -4.543   4.668  -2.092
   90    HG   SER  12           HG       SER  12  -4.031   7.364  -2.401
   91    H    HIS  13           HN       HIS  13  -3.682   3.653   0.330
   92    HA   HIS  13           HA       HIS  13  -1.044   2.443  -0.027
   93    HB2  HIS  13           2HB      HIS  13  -0.793   1.881   2.321
   94    HB3  HIS  13           1HB      HIS  13  -0.960   3.618   2.135
   95    HD1  HIS  13           1HD      HIS  13  -1.480   2.252   4.845
   96    HD2  HIS  13           2HD      HIS  13  -4.464   3.081   2.076
   97    HE1  HIS  13           1HE      HIS  13  -3.610   2.349   6.159
   98    HE2  HIS  13           2HE      HIS  13  -5.412   2.610   4.423
   99    H    LEU  14           HN       LEU  14  -0.967   0.326  -0.229
  100    HA   LEU  14           HA       LEU  14  -3.502  -1.171  -0.101
  101    HB2  LEU  14           2HB      LEU  14  -2.240  -1.038  -2.286
  102    HB3  LEU  14           1HB      LEU  14  -0.935  -1.917  -1.515
  103    HG   LEU  14           HG       LEU  14  -2.623  -3.775  -1.090
  104   HD11  LEU  14          1HD1      LEU  14  -4.193  -2.188  -3.096
  105   HD12  LEU  14          2HD1      LEU  14  -4.639  -2.497  -1.419
  106   HD13  LEU  14          3HD1      LEU  14  -4.555  -3.831  -2.570
  107   HD21  LEU  14          3HD2      LEU  14  -2.409  -4.656  -3.370
  108   HD22  LEU  14          1HD2      LEU  14  -0.901  -3.953  -2.787
  109   HD23  LEU  14          2HD2      LEU  14  -1.906  -3.059  -3.928
  110    H    LEU  15           HN       LEU  15  -3.397  -3.347   0.798
  111    HA   LEU  15           HA       LEU  15  -1.017  -3.955   2.371
  112    HB2  LEU  15           2HB      LEU  15  -2.491  -2.692   3.871
  113    HB3  LEU  15           1HB      LEU  15  -3.796  -3.809   3.551
  114    HG   LEU  15           HG       LEU  15  -2.587  -4.026   5.789
  115   HD11  LEU  15          1HD1      LEU  15  -2.817  -6.437   4.006
  116   HD12  LEU  15          2HD1      LEU  15  -4.058  -5.773   5.070
  117   HD13  LEU  15          3HD1      LEU  15  -2.601  -6.494   5.752
  118   HD21  LEU  15          3HD2      LEU  15  -0.308  -3.781   4.957
  119   HD22  LEU  15          1HD2      LEU  15  -0.470  -5.287   4.054
  120   HD23  LEU  15          2HD2      LEU  15  -0.518  -5.306   5.816
  121    H    VAL  16           HN       VAL  16  -0.484  -5.996   2.227
  122    HA   VAL  16           HA       VAL  16  -2.574  -7.977   1.680
  123    HB   VAL  16           HB       VAL  16  -1.301  -7.541  -0.400
  124   HG11  VAL  16          1HG1      VAL  16   1.093  -8.454   1.175
  125   HG12  VAL  16          2HG1      VAL  16   0.805  -6.838   0.529
  126   HG13  VAL  16          3HG1      VAL  16   1.056  -8.198  -0.569
  127   HG21  VAL  16          3HG2      VAL  16  -0.680  -9.859  -0.911
  128   HG22  VAL  16          1HG2      VAL  16  -2.216  -9.758  -0.049
  129   HG23  VAL  16          2HG2      VAL  16  -0.754 -10.247   0.807
  130    H    LYS  17           HN       LYS  17  -2.550  -9.682   3.016
  131    HA   LYS  17           HA       LYS  17  -0.552  -9.742   5.135
  132    HB2  LYS  17           2HB      LYS  17  -3.078 -11.355   4.706
  133    HB3  LYS  17           1HB      LYS  17  -2.026 -11.525   6.099
  134    HG2  LYS  17           2HG      LYS  17  -3.398  -8.949   5.366
  135    HG3  LYS  17           1HG      LYS  17  -4.096 -10.152   6.449
  136    HD2  LYS  17           2HD      LYS  17  -2.128  -9.920   7.922
  137    HD3  LYS  17           1HD      LYS  17  -1.492  -8.673   6.846
  138    HE2  LYS  17           2HE      LYS  17  -2.604  -7.649   8.751
  139    HE3  LYS  17           1HE      LYS  17  -3.495  -7.304   7.273
  140    HZ1  LYS  17           3HZ      LYS  17  -4.991  -7.892   9.050
  141    HZ2  LYS  17           1HZ      LYS  17  -4.197  -9.367   9.293
  142    HZ3  LYS  17           2HZ      LYS  17  -5.052  -9.085   7.857
  143    H    HIS  18           HN       HIS  18   0.186 -11.976   5.855
  144    HA   HIS  18           HA       HIS  18   0.387 -13.996   3.854
  145    HB2  HIS  18           2HB      HIS  18   2.912 -14.047   3.824
  146    HB3  HIS  18           1HB      HIS  18   2.194 -12.693   2.970
  147    HD1  HIS  18           1HD      HIS  18   4.934 -13.387   5.070
  148    HD2  HIS  18           2HD      HIS  18   2.148 -10.310   4.906
  149    HE1  HIS  18           1HE      HIS  18   6.003 -11.445   6.236
  150    HE2  HIS  18           2HE      HIS  18   4.178  -9.722   6.381
  151    H    SER  19           HN       SER  19   1.991 -15.771   4.715
  152    HA   SER  19           HA       SER  19   0.855 -16.857   6.964
  153    HB2  SER  19           2HB      SER  19   2.325 -18.007   5.231
  154    HB3  SER  19           1HB      SER  19   3.708 -17.432   6.160
  155    HG   SER  19           HG       SER  19   3.308 -19.389   7.000
  156    H    GLN  20           HN       GLN  20   4.008 -15.148   6.874
  157    HA   GLN  20           HA       GLN  20   4.114 -15.129   9.747
  158    HB2  GLN  20           2HB      GLN  20   5.877 -13.942   7.620
  159    HB3  GLN  20           1HB      GLN  20   6.110 -13.571   9.322
  160    HG2  GLN  20           2HG      GLN  20   6.119 -16.360   8.196
  161    HG3  GLN  20           1HG      GLN  20   7.568 -15.385   8.439
  162   HE21  GLN  20          1HE2      GLN  20   8.414 -16.851   9.910
  163   HE22  GLN  20          2HE2      GLN  20   7.792 -17.016  11.516
  164    H    SER  21           HN       SER  21   2.248 -14.082  10.318
  165    HA   SER  21           HA       SER  21   2.494 -11.224  10.419
  166    HB2  SER  21           2HB      SER  21   0.109 -12.530   9.077
  167    HB3  SER  21           1HB      SER  21   0.149 -10.846   9.599
  168    HG   SER  21           HG       SER  21   2.327 -11.469   8.128
  169    H    ARG  22           HN       ARG  22   0.905 -10.279  11.922
  170    HA   ARG  22           HA       ARG  22   0.670 -11.874  14.257
  171    HB2  ARG  22           2HB      ARG  22  -0.617  -9.209  13.655
  172    HB3  ARG  22           1HB      ARG  22  -0.396  -9.921  15.247
  173    HG2  ARG  22           2HG      ARG  22   2.045  -9.809  14.928
  174    HG3  ARG  22           1HG      ARG  22   1.780  -9.019  13.374
  175    HD2  ARG  22           2HD      ARG  22   2.241  -7.323  14.980
  176    HD3  ARG  22           1HD      ARG  22   0.524  -7.236  14.592
  177    HE   ARG  22           HE       ARG  22   0.131  -8.466  16.692
  178   HH11  ARG  22          1HH1      ARG  22   3.128  -6.671  16.285
  179   HH12  ARG  22          2HH1      ARG  22   3.404  -6.513  17.981
  180   HH21  ARG  22          1HH2      ARG  22   0.501  -8.248  18.940
  181   HH22  ARG  22          2HH2      ARG  22   1.903  -7.404  19.499
  182    H    ARG  23           HN       ARG  23  -1.570 -10.763  11.810
  183    HA   ARG  23           HA       ARG  23  -3.356 -12.933  12.494
  184    HB2  ARG  23           2HB      ARG  23  -4.121 -10.982  13.859
  185    HB3  ARG  23           1HB      ARG  23  -4.364 -10.080  12.372
  186    HG2  ARG  23           2HG      ARG  23  -6.450 -11.003  13.291
  187    HG3  ARG  23           1HG      ARG  23  -6.093 -11.609  11.673
  188    HD2  ARG  23           2HD      ARG  23  -6.903 -13.356  13.249
  189    HD3  ARG  23           1HD      ARG  23  -5.318 -13.697  12.558
  190    HE   ARG  23           HE       ARG  23  -5.406 -12.405  15.173
  191   HH11  ARG  23          1HH1      ARG  23  -4.965 -15.349  13.332
  192   HH12  ARG  23          2HH1      ARG  23  -4.103 -16.167  14.583
  193   HH21  ARG  23          1HH2      ARG  23  -4.254 -13.489  16.850
  194   HH22  ARG  23          2HH2      ARG  23  -3.694 -15.105  16.595
  195    HA   PRO  24           HA       PRO  24  -2.886 -12.466   7.963
  196    HB2  PRO  24           2HB      PRO  24  -3.350 -15.364   8.008
  197    HB3  PRO  24           1HB      PRO  24  -1.966 -14.468   7.378
  198    HG2  PRO  24           2HG      PRO  24  -1.795 -15.973   9.605
  199    HG3  PRO  24           1HG      PRO  24  -0.869 -14.474   9.407
  200    HD2  PRO  24           2HD      PRO  24  -3.402 -14.947  10.935
  201    HD3  PRO  24           1HD      PRO  24  -1.964 -14.016  11.400
  202    H    SER  25           HN       SER  25  -5.158 -11.543   8.802
  203    HA   SER  25           HA       SER  25  -7.212 -13.131   7.432
  204    HB2  SER  25           2HB      SER  25  -8.840 -11.993   8.969
  205    HB3  SER  25           1HB      SER  25  -7.729 -13.093   9.786
  206    HG   SER  25           HG       SER  25  -7.972 -10.352   9.983
  207    H    SER  26           HN       SER  26  -8.717 -11.932   6.192
  208    HA   SER  26           HA       SER  26  -7.713  -9.332   5.326
  209    HB2  SER  26           2HB      SER  26  -9.166  -9.697   3.362
  210    HB3  SER  26           1HB      SER  26  -8.037 -11.035   3.590
  211    H    TRP  27           HN       TRP  27  -9.746  -7.993   4.424
  212    HA   TRP  27           HA       TRP  27 -11.196  -7.144   6.696
  213    HB2  TRP  27           2HB      TRP  27 -12.363  -5.638   5.114
  214    HB3  TRP  27           1HB      TRP  27 -10.614  -5.586   4.916
  215    HD1  TRP  27           1HD      TRP  27  -9.617  -6.848   2.693
  216    HE1  TRP  27           1HE      TRP  27 -10.686  -7.254   0.397
  217    HE3  TRP  27           3HE      TRP  27 -14.511  -6.079   3.939
  218    HZ2  TRP  27           2HZ      TRP  27 -13.267  -7.243  -0.745
  219    HZ3  TRP  27           3HZ      TRP  27 -16.218  -6.292   2.184
  220    HH2  TRP  27           2HH      TRP  27 -15.608  -6.860  -0.107
  221    H    ARG  28           HN       ARG  28 -11.829  -9.461   4.211
  222    HA   ARG  28           HA       ARG  28 -14.622  -9.717   5.091
  223    HB2  ARG  28           2HB      ARG  28 -14.912 -11.091   3.020
  224    HB3  ARG  28           1HB      ARG  28 -14.486  -9.412   2.723
  225    HG2  ARG  28           2HG      ARG  28 -12.247  -9.994   2.175
  226    HG3  ARG  28           1HG      ARG  28 -12.485 -11.655   2.724
  227    HD2  ARG  28           2HD      ARG  28 -13.928 -10.363   0.416
  228    HD3  ARG  28           1HD      ARG  28 -12.542 -11.439   0.267
  229    HE   ARG  28           HE       ARG  28 -15.246 -12.182   1.128
  230   HH11  ARG  28          1HH1      ARG  28 -11.994 -13.122   0.207
  231   HH12  ARG  28          2HH1      ARG  28 -12.354 -14.812   0.116
  232   HH21  ARG  28          1HH2      ARG  28 -15.756 -14.414   0.972
  233   HH22  ARG  28          2HH2      ARG  28 -14.527 -15.543   0.527
  234    H    GLN  29           HN       GLN  29 -11.795 -10.851   5.946
  235    HA   GLN  29           HA       GLN  29 -10.992 -12.629   7.040
  236    HB2  GLN  29           2HB      GLN  29 -13.090 -12.321   8.350
  237    HB3  GLN  29           1HB      GLN  29 -13.862 -13.520   7.323
  238    HG2  GLN  29           2HG      GLN  29 -12.237 -15.194   8.070
  239    HG3  GLN  29           1HG      GLN  29 -11.492 -13.988   9.117
  240   HE21  GLN  29          1HE2      GLN  29 -12.560 -13.324  10.958
  241   HE22  GLN  29          2HE2      GLN  29 -13.912 -14.183  11.611
  242    H    GLU  30           HN       GLU  30 -10.302 -13.060   4.736
  243    HA   GLU  30           HA       GLU  30 -11.261 -15.638   3.755
  244    HB2  GLU  30           2HB      GLU  30 -10.883 -13.841   2.109
  245    HB3  GLU  30           1HB      GLU  30  -9.227 -13.664   2.656
  246    HG2  GLU  30           2HG      GLU  30  -9.369 -14.849   0.528
  247    HG3  GLU  30           1HG      GLU  30  -8.678 -15.866   1.789
  248    H    LYS  31           HN       LYS  31  -9.436 -17.206   3.144
  249    HA   LYS  31           HA       LYS  31  -7.772 -17.582   5.477
  250    HB2  LYS  31           2HB      LYS  31  -7.241 -19.758   4.514
  251    HB3  LYS  31           1HB      LYS  31  -8.976 -19.488   4.473
  252    HG2  LYS  31           2HG      LYS  31  -8.703 -18.795   2.067
  253    HG3  LYS  31           1HG      LYS  31  -7.035 -19.355   2.175
  254    HD2  LYS  31           2HD      LYS  31  -8.219 -21.164   1.262
  255    HD3  LYS  31           1HD      LYS  31  -8.020 -21.577   2.966
  256    HE2  LYS  31           2HE      LYS  31 -10.286 -22.061   2.225
  257    HE3  LYS  31           1HE      LYS  31 -10.290 -20.764   3.420
  258    HZ1  LYS  31           3HZ      LYS  31 -11.752 -20.350   1.495
  259    HZ2  LYS  31           1HZ      LYS  31 -10.401 -20.332   0.484
  260    HZ3  LYS  31           2HZ      LYS  31 -10.577 -19.147   1.683
  261    H    ILE  32           HN       ILE  32  -5.829 -16.632   5.627
  262    HA   ILE  32           HA       ILE  32  -4.315 -16.256   3.143
  263    HB   ILE  32           HB       ILE  32  -4.167 -14.646   5.710
  264   HG12  ILE  32          2HG1      ILE  32  -4.473 -12.745   3.988
  265   HG13  ILE  32          1HG1      ILE  32  -4.959 -14.007   2.869
  266   HG21  ILE  32          1HG2      ILE  32  -2.337 -14.495   3.317
  267   HG22  ILE  32          2HG2      ILE  32  -1.903 -15.073   4.926
  268   HG23  ILE  32          3HG2      ILE  32  -2.337 -13.381   4.684
  269   HD11  ILE  32          3HD1      ILE  32  -6.782 -14.616   4.380
  270   HD12  ILE  32          1HD1      ILE  32  -6.876 -12.934   3.858
  271   HD13  ILE  32          2HD1      ILE  32  -6.290 -13.323   5.473
  272    H    THR  33           HN       THR  33  -3.264 -18.133   3.013
  273    HA   THR  33           HA       THR  33  -1.483 -18.829   5.239
  274    HB   THR  33           HB       THR  33  -1.339 -21.064   4.003
  275    HG1  THR  33           1HG      THR  33  -3.297 -21.414   2.691
  276   HG21  THR  33          3HG2      THR  33  -3.475 -21.863   4.939
  277   HG22  THR  33          1HG2      THR  33  -4.002 -20.193   5.139
  278   HG23  THR  33          2HG2      THR  33  -2.627 -20.801   6.063
  279    H    ARG  34           HN       ARG  34  -1.693 -17.576   2.129
  280    HA   ARG  34           HA       ARG  34   0.607 -18.343   0.824
  281    HB2  ARG  34           2HB      ARG  34   0.498 -15.959  -0.168
  282    HB3  ARG  34           1HB      ARG  34  -0.861 -17.042  -0.432
  283    HG2  ARG  34           2HG      ARG  34  -2.074 -15.943   1.405
  284    HG3  ARG  34           1HG      ARG  34  -0.715 -14.846   1.626
  285    HD2  ARG  34           2HD      ARG  34  -1.236 -13.621  -0.201
  286    HD3  ARG  34           1HD      ARG  34  -1.779 -15.026  -1.116
  287    HE   ARG  34           HE       ARG  34  -3.912 -14.811  -0.171
  288   HH11  ARG  34          1HH1      ARG  34  -1.763 -12.315   1.078
  289   HH12  ARG  34          2HH1      ARG  34  -3.072 -11.276   1.545
  290   HH21  ARG  34          1HH2      ARG  34  -5.612 -13.403   0.479
  291   HH22  ARG  34          2HH2      ARG  34  -5.234 -11.886   1.232
  292    H    THR  35           HN       THR  35   2.690 -17.983   1.035
  293    HA   THR  35           HA       THR  35   3.607 -16.592   3.401
  294    HB   THR  35           HB       THR  35   4.590 -18.772   2.830
  295    HG1  THR  35           1HG      THR  35   6.912 -17.555   2.455
  296   HG21  THR  35          3HG2      THR  35   6.098 -18.986   0.891
  297   HG22  THR  35          1HG2      THR  35   5.638 -17.364   0.374
  298   HG23  THR  35          2HG2      THR  35   4.438 -18.655   0.404
  299    H    LYS  36           HN       LYS  36   5.826 -15.365   3.008
  300    HA   LYS  36           HA       LYS  36   5.203 -12.944   1.708
  301    HB2  LYS  36           2HB      LYS  36   6.771 -13.046   3.576
  302    HB3  LYS  36           1HB      LYS  36   7.875 -14.021   2.621
  303    HG2  LYS  36           2HG      LYS  36   8.152 -12.116   1.068
  304    HG3  LYS  36           1HG      LYS  36   7.128 -11.147   2.129
  305    HD2  LYS  36           2HD      LYS  36   8.702 -11.361   3.936
  306    HD3  LYS  36           1HD      LYS  36   9.678 -12.501   3.007
  307    HE2  LYS  36           2HE      LYS  36  10.127 -10.718   1.358
  308    HE3  LYS  36           1HE      LYS  36   9.209  -9.590   2.353
  309    HZ1  LYS  36           3HZ      LYS  36  11.603  -9.419   2.725
  310    HZ2  LYS  36           1HZ      LYS  36  11.651 -11.034   3.215
  311    HZ3  LYS  36           2HZ      LYS  36  10.799  -9.905   4.132
  312    H    GLU  37           HN       GLU  37   7.080 -15.748   0.721
  313    HA   GLU  37           HA       GLU  37   8.258 -14.766  -1.607
  314    HB2  GLU  37           2HB      GLU  37   7.266 -17.541  -0.934
  315    HB3  GLU  37           1HB      GLU  37   8.153 -17.175  -2.400
  316    HG2  GLU  37           2HG      GLU  37   9.588 -18.149  -0.693
  317    HG3  GLU  37           1HG      GLU  37  10.090 -16.512  -1.094
  318    H    GLU  38           HN       GLU  38   5.030 -16.000  -1.032
  319    HA   GLU  38           HA       GLU  38   4.278 -15.925  -3.805
  320    HB2  GLU  38           2HB      GLU  38   2.593 -16.239  -1.320
  321    HB3  GLU  38           1HB      GLU  38   2.038 -16.491  -2.969
  322    HG2  GLU  38           2HG      GLU  38   3.608 -18.330  -3.228
  323    HG3  GLU  38           1HG      GLU  38   4.193 -18.068  -1.589
  324    H    ALA  39           HN       ALA  39   3.580 -14.015  -0.903
  325    HA   ALA  39           HA       ALA  39   1.842 -12.153  -2.063
  326    HB1  ALA  39           1HB      ALA  39   2.353 -10.724  -0.155
  327    HB2  ALA  39           2HB      ALA  39   3.765 -11.710   0.220
  328    HB3  ALA  39           3HB      ALA  39   2.149 -12.398   0.360
  329    H    LEU  40           HN       LEU  40   5.328 -12.337  -2.022
  330    HA   LEU  40           HA       LEU  40   5.960  -9.766  -2.918
  331    HB2  LEU  40           2HB      LEU  40   7.627 -11.293  -2.028
  332    HB3  LEU  40           1HB      LEU  40   7.366 -12.408  -3.349
  333    HG   LEU  40           HG       LEU  40   8.306  -9.669  -4.053
  334   HD11  LEU  40          1HD1      LEU  40  10.077 -11.785  -2.832
  335   HD12  LEU  40          2HD1      LEU  40   9.686 -10.223  -2.116
  336   HD13  LEU  40          3HD1      LEU  40  10.629 -10.300  -3.603
  337   HD21  LEU  40          3HD2      LEU  40   9.569 -10.936  -5.728
  338   HD22  LEU  40          1HD2      LEU  40   7.855 -11.349  -5.783
  339   HD23  LEU  40          2HD2      LEU  40   9.003 -12.448  -5.019
  340    H    GLU  41           HN       GLU  41   5.018 -12.671  -4.683
  341    HA   GLU  41           HA       GLU  41   5.507 -11.621  -7.283
  342    HB2  GLU  41           2HB      GLU  41   3.591 -13.815  -6.487
  343    HB3  GLU  41           1HB      GLU  41   4.219 -13.513  -8.099
  344    HG2  GLU  41           2HG      GLU  41   6.495 -13.979  -7.227
  345    HG3  GLU  41           1HG      GLU  41   5.759 -14.438  -5.693
  346    H    LEU  42           HN       LEU  42   2.753 -11.684  -5.121
  347    HA   LEU  42           HA       LEU  42   0.849 -10.633  -6.913
  348    HB2  LEU  42           2HB      LEU  42   1.069 -10.747  -3.926
  349    HB3  LEU  42           1HB      LEU  42  -0.174  -9.754  -4.654
  350    HG   LEU  42           HG       LEU  42  -1.096 -11.756  -5.776
  351   HD11  LEU  42          1HD1      LEU  42  -0.361 -13.983  -5.080
  352   HD12  LEU  42          2HD1      LEU  42   0.976 -13.254  -4.187
  353   HD13  LEU  42          3HD1      LEU  42   0.903 -13.106  -5.943
  354   HD21  LEU  42          3HD2      LEU  42  -2.035 -12.792  -3.771
  355   HD22  LEU  42          1HD2      LEU  42  -2.002 -11.034  -3.641
  356   HD23  LEU  42          2HD2      LEU  42  -0.802 -12.004  -2.787
  357    H    ILE  43           HN       ILE  43   2.874  -9.081  -4.448
  358    HA   ILE  43           HA       ILE  43   2.134  -6.439  -4.872
  359    HB   ILE  43           HB       ILE  43   4.829  -7.544  -4.051
  360   HG12  ILE  43          2HG1      ILE  43   2.983  -8.117  -2.536
  361   HG13  ILE  43          1HG1      ILE  43   4.107  -6.995  -1.777
  362   HG21  ILE  43          1HG2      ILE  43   3.812  -4.709  -3.872
  363   HG22  ILE  43          2HG2      ILE  43   5.128  -5.289  -4.893
  364   HG23  ILE  43          3HG2      ILE  43   5.299  -5.306  -3.138
  365   HD11  ILE  43          3HD1      ILE  43   1.841  -6.385  -1.244
  366   HD12  ILE  43          1HD1      ILE  43   1.421  -6.319  -2.955
  367   HD13  ILE  43          2HD1      ILE  43   2.557  -5.152  -2.279
  368    H    ASN  44           HN       ASN  44   4.960  -8.114  -6.276
  369    HA   ASN  44           HA       ASN  44   5.769  -6.051  -7.966
  370    HB2  ASN  44           2HB      ASN  44   6.105  -9.036  -8.187
  371    HB3  ASN  44           1HB      ASN  44   6.799  -7.930  -9.363
  372   HD21  ASN  44          1HD2      ASN  44   8.186  -9.733  -7.638
  373   HD22  ASN  44          2HD2      ASN  44   9.213  -8.775  -6.628
  374    H    GLY  45           HN       GLY  45   3.531  -8.720  -8.577
  375    HA2  GLY  45           2HA      GLY  45   3.040  -8.208 -11.276
  376    HA3  GLY  45           1HA      GLY  45   1.922  -8.999 -10.172
  377    H    TYR  46           HN       TYR  46   1.262  -7.064  -8.411
  378    HA   TYR  46           HA       TYR  46  -0.660  -5.576  -9.818
  379    HB2  TYR  46           2HB      TYR  46   0.403  -5.088  -7.026
  380    HB3  TYR  46           1HB      TYR  46  -1.076  -4.410  -7.687
  381    HD1  TYR  46           1HD      TYR  46  -1.708  -7.173  -9.168
  382    HD2  TYR  46           2HD      TYR  46  -0.844  -6.061  -5.149
  383    HE1  TYR  46           1HE      TYR  46  -2.945  -9.136  -8.364
  384    HE2  TYR  46           2HE      TYR  46  -2.082  -8.027  -4.339
  385    HH   TYR  46           HH       TYR  46  -3.033 -10.571  -6.389
  386    H    ILE  47           HN       ILE  47   2.483  -4.631  -8.482
  387    HA   ILE  47           HA       ILE  47   2.407  -1.906  -9.054
  388    HB   ILE  47           HB       ILE  47   4.751  -3.820  -9.054
  389   HG12  ILE  47          2HG1      ILE  47   3.825  -1.778  -7.020
  390   HG13  ILE  47          1HG1      ILE  47   3.579  -3.516  -6.904
  391   HG21  ILE  47          1HG2      ILE  47   4.825  -0.804  -9.170
  392   HG22  ILE  47          2HG2      ILE  47   5.338  -1.913 -10.441
  393   HG23  ILE  47          3HG2      ILE  47   6.219  -1.854  -8.916
  394   HD11  ILE  47          3HD1      ILE  47   5.420  -2.792  -5.504
  395   HD12  ILE  47          1HD1      ILE  47   6.234  -2.101  -6.906
  396   HD13  ILE  47          2HD1      ILE  47   5.997  -3.845  -6.796
  397    H    GLN  48           HN       GLN  48   3.426  -4.614 -11.088
  398    HA   GLN  48           HA       GLN  48   4.158  -3.045 -13.316
  399    HB2  GLN  48           2HB      GLN  48   3.253  -5.928 -13.265
  400    HB3  GLN  48           1HB      GLN  48   4.089  -5.139 -14.594
  401    HG2  GLN  48           2HG      GLN  48   5.182  -5.692 -11.845
  402    HG3  GLN  48           1HG      GLN  48   5.628  -6.500 -13.344
  403   HE21  GLN  48          1HE2      GLN  48   7.253  -5.029 -11.425
  404   HE22  GLN  48          2HE2      GLN  48   8.026  -3.767 -12.315
  405    H    LYS  49           HN       LYS  49   1.147  -4.732 -12.468
  406    HA   LYS  49           HA       LYS  49  -0.288  -4.279 -14.820
  407    HB2  LYS  49           2HB      LYS  49  -1.321  -4.426 -11.989
  408    HB3  LYS  49           1HB      LYS  49  -2.322  -4.527 -13.428
  409    HG2  LYS  49           2HG      LYS  49  -1.186  -6.572 -14.088
  410    HG3  LYS  49           1HG      LYS  49  -0.148  -6.463 -12.665
  411    HD2  LYS  49           2HD      LYS  49  -2.162  -6.574 -11.237
  412    HD3  LYS  49           1HD      LYS  49  -3.144  -6.788 -12.685
  413    HE2  LYS  49           2HE      LYS  49  -1.877  -8.835 -13.207
  414    HE3  LYS  49           1HE      LYS  49  -0.961  -8.628 -11.716
  415    HZ1  LYS  49           3HZ      LYS  49  -2.696 -10.170 -11.299
  416    HZ2  LYS  49           1HZ      LYS  49  -3.869  -9.158 -11.977
  417    HZ3  LYS  49           2HZ      LYS  49  -3.131  -8.735 -10.524
  418    H    ILE  50           HN       ILE  50  -0.073  -2.281 -11.916
  419    HA   ILE  50           HA       ILE  50  -1.906  -0.313 -12.724
  420    HB   ILE  50           HB       ILE  50   0.424  -0.110 -10.806
  421   HG12  ILE  50          2HG1      ILE  50  -2.529  -0.540 -10.305
  422   HG13  ILE  50          1HG1      ILE  50  -1.301  -1.800 -10.249
  423   HG21  ILE  50          1HG2      ILE  50  -0.691   1.860  -9.884
  424   HG22  ILE  50          2HG2      ILE  50  -1.930   1.752 -11.132
  425   HG23  ILE  50          3HG2      ILE  50  -0.261   2.114 -11.577
  426   HD11  ILE  50          3HD1      ILE  50  -1.921  -1.028  -8.028
  427   HD12  ILE  50          1HD1      ILE  50  -1.427   0.608  -8.458
  428   HD13  ILE  50          2HD1      ILE  50  -0.228  -0.684  -8.381
  429    H    LYS  51           HN       LYS  51   1.579  -0.602 -13.237
  430    HA   LYS  51           HA       LYS  51   1.731   2.000 -14.477
  431    HB2  LYS  51           2HB      LYS  51   3.778  -0.211 -14.324
  432    HB3  LYS  51           1HB      LYS  51   4.087   1.401 -14.940
  433    HG2  LYS  51           2HG      LYS  51   3.306   0.687 -12.116
  434    HG3  LYS  51           1HG      LYS  51   4.911   1.157 -12.666
  435    HD2  LYS  51           2HD      LYS  51   2.509   2.963 -12.959
  436    HD3  LYS  51           1HD      LYS  51   3.501   2.945 -11.507
  437    HE2  LYS  51           2HE      LYS  51   4.330   4.723 -12.815
  438    HE3  LYS  51           1HE      LYS  51   5.485   3.413 -13.019
  439    HZ1  LYS  51           3HZ      LYS  51   3.321   4.051 -14.954
  440    HZ2  LYS  51           1HZ      LYS  51   4.581   2.942 -15.174
  441    HZ3  LYS  51           2HZ      LYS  51   4.909   4.593 -15.093
  442    H    SER  52           HN       SER  52   1.000  -1.175 -15.525
  443    HA   SER  52           HA       SER  52   1.679  -0.635 -18.297
  444    HB2  SER  52           2HB      SER  52   0.258  -3.022 -17.098
  445    HB3  SER  52           1HB      SER  52   0.907  -2.907 -18.734
  446    HG   SER  52           HG       SER  52   2.298  -2.981 -16.273
  447    H    GLY  53           HN       GLY  53  -0.807   0.136 -16.269
  448    HA2  GLY  53           2HA      GLY  53  -2.786   1.221 -16.748
  449    HA3  GLY  53           1HA      GLY  53  -2.490   0.937 -18.458
  450    H    GLU  54           HN       GLU  54  -2.314  -1.819 -16.427
  451    HA   GLU  54           HA       GLU  54  -4.583  -2.994 -17.729
  452    HB2  GLU  54           2HB      GLU  54  -2.803  -3.971 -15.503
  453    HB3  GLU  54           1HB      GLU  54  -4.146  -4.906 -16.136
  454    HG2  GLU  54           2HG      GLU  54  -3.052  -4.778 -18.380
  455    HG3  GLU  54           1HG      GLU  54  -1.654  -4.060 -17.579
  456    H    GLU  55           HN       GLU  55  -3.819  -2.158 -14.375
  457    HA   GLU  55           HA       GLU  55  -6.666  -1.739 -13.885
  458    HB2  GLU  55           2HB      GLU  55  -4.850  -3.330 -12.052
  459    HB3  GLU  55           1HB      GLU  55  -6.537  -2.938 -11.748
  460    HG2  GLU  55           2HG      GLU  55  -7.187  -4.260 -13.706
  461    HG3  GLU  55           1HG      GLU  55  -5.498  -4.671 -13.982
  462    H    ASP  56           HN       ASP  56  -7.052  -0.405 -11.982
  463    HA   ASP  56           HA       ASP  56  -4.848   1.485 -11.588
  464    HB2  ASP  56           2HB      ASP  56  -6.986   2.386 -12.453
  465    HB3  ASP  56           1HB      ASP  56  -7.792   1.831 -10.989
  466    H    PHE  57           HN       PHE  57  -4.384   2.307  -9.489
  467    HA   PHE  57           HA       PHE  57  -4.106   0.316  -7.541
  468    HB2  PHE  57           2HB      PHE  57  -2.647   2.330  -7.795
  469    HB3  PHE  57           1HB      PHE  57  -3.940   3.298  -7.096
  470    HD1  PHE  57           1HD      PHE  57  -4.508   3.084  -4.724
  471    HD2  PHE  57           2HD      PHE  57  -1.297   0.882  -6.439
  472    HE1  PHE  57           1HE      PHE  57  -3.641   2.595  -2.474
  473    HE2  PHE  57           2HE      PHE  57  -0.429   0.391  -4.197
  474    HZ   PHE  57           HZ       PHE  57  -1.601   1.247  -2.210
  475    H    GLU  58           HN       GLU  58  -6.459   2.974  -7.799
  476    HA   GLU  58           HA       GLU  58  -7.628   2.588  -5.253
  477    HB2  GLU  58           2HB      GLU  58  -8.757   3.776  -7.788
  478    HB3  GLU  58           1HB      GLU  58  -9.599   3.799  -6.248
  479    HG2  GLU  58           2HG      GLU  58  -7.814   5.129  -5.271
  480    HG3  GLU  58           1HG      GLU  58  -6.922   5.068  -6.791
  481    H    SER  59           HN       SER  59  -8.352   1.273  -8.437
  482    HA   SER  59           HA       SER  59 -10.637  -0.208  -7.652
  483    HB2  SER  59           2HB      SER  59  -8.757  -0.774  -9.950
  484    HB3  SER  59           1HB      SER  59 -10.440  -1.279  -9.803
  485    HG   SER  59           HG       SER  59  -9.936   0.661 -11.124
  486    H    LEU  60           HN       LEU  60  -7.203  -0.818  -7.706
  487    HA   LEU  60           HA       LEU  60  -7.278  -3.607  -7.248
  488    HB2  LEU  60           2HB      LEU  60  -5.321  -2.437  -8.135
  489    HB3  LEU  60           1HB      LEU  60  -5.148  -1.565  -6.627
  490    HG   LEU  60           HG       LEU  60  -4.765  -3.789  -5.503
  491   HD11  LEU  60          1HD1      LEU  60  -4.507  -4.725  -8.353
  492   HD12  LEU  60          2HD1      LEU  60  -5.754  -5.214  -7.207
  493   HD13  LEU  60          3HD1      LEU  60  -4.069  -5.651  -6.918
  494   HD21  LEU  60          3HD2      LEU  60  -2.445  -3.911  -6.202
  495   HD22  LEU  60          1HD2      LEU  60  -2.959  -2.232  -6.049
  496   HD23  LEU  60          2HD2      LEU  60  -2.814  -2.967  -7.646
  497    H    ALA  61           HN       ALA  61  -6.745  -0.838  -5.077
  498    HA   ALA  61           HA       ALA  61  -6.436  -2.259  -2.698
  499    HB1  ALA  61           1HB      ALA  61  -6.921  -0.161  -1.562
  500    HB2  ALA  61           2HB      ALA  61  -7.588   0.506  -3.052
  501    HB3  ALA  61           3HB      ALA  61  -5.873   0.111  -2.954
  502    H    SER  62           HN       SER  62  -9.333  -1.129  -4.301
  503    HA   SER  62           HA       SER  62 -11.142  -1.701  -2.197
  504    HB2  SER  62           2HB      SER  62 -11.693  -1.404  -5.153
  505    HB3  SER  62           1HB      SER  62 -12.883  -1.306  -3.855
  506    HG   SER  62           HG       SER  62 -10.770   0.487  -4.464
  507    H    GLN  63           HN       GLN  63  -9.362  -3.845  -3.974
  508    HA   GLN  63           HA       GLN  63 -11.369  -5.956  -3.588
  509    HB2  GLN  63           2HB      GLN  63  -9.694  -5.574  -6.068
  510    HB3  GLN  63           1HB      GLN  63 -10.654  -7.003  -5.724
  511    HG2  GLN  63           2HG      GLN  63 -12.684  -5.722  -5.819
  512    HG3  GLN  63           1HG      GLN  63 -11.769  -4.224  -5.995
  513   HE21  GLN  63          1HE2      GLN  63 -10.720  -3.798  -7.924
  514   HE22  GLN  63          2HE2      GLN  63 -11.130  -4.630  -9.391
  515    H    PHE  64           HN       PHE  64  -8.054  -5.773  -4.875
  516    HA   PHE  64           HA       PHE  64  -7.379  -8.174  -3.423
  517    HB2  PHE  64           2HB      PHE  64  -5.766  -6.505  -5.354
  518    HB3  PHE  64           1HB      PHE  64  -5.209  -8.007  -4.627
  519    HD1  PHE  64           2HD      PHE  64  -6.149 -10.140  -5.302
  520    HD2  PHE  64           1HD      PHE  64  -7.444  -6.502  -7.091
  521    HE1  PHE  64           2HE      PHE  64  -7.202 -11.414  -7.124
  522    HE2  PHE  64           1HE      PHE  64  -8.498  -7.770  -8.915
  523    HZ   PHE  64           HZ       PHE  64  -8.377 -10.229  -8.933
  524    H    SER  65           HN       SER  65  -7.728  -6.993  -1.382
  525    HA   SER  65           HA       SER  65  -5.141  -6.356  -0.298
  526    HB2  SER  65           2HB      SER  65  -6.098  -4.133  -1.022
  527    HB3  SER  65           1HB      SER  65  -7.428  -4.407   0.103
  528    HG   SER  65           HG       SER  65  -4.846  -4.696   1.104
  529    H    ASP  66           HN       ASP  66  -5.048  -6.796   1.907
  530    HA   ASP  66           HA       ASP  66  -7.360  -8.317   2.874
  531    HB2  ASP  66           2HB      ASP  66  -4.493  -8.314   3.818
  532    HB3  ASP  66           1HB      ASP  66  -5.774  -9.310   4.496
  533    H    ALA  67           HN       ALA  67  -6.528  -5.281   3.038
  534    HA   ALA  67           HA       ALA  67  -7.009  -5.002   5.924
  535    HB1  ALA  67           1HB      ALA  67  -6.148  -2.710   5.676
  536    HB2  ALA  67           2HB      ALA  67  -5.848  -3.024   3.967
  537    HB3  ALA  67           3HB      ALA  67  -4.966  -3.927   5.201
  538    H    SER  68           HN       SER  68  -8.164  -2.827   6.385
  539    HA   SER  68           HA       SER  68 -10.777  -3.031   5.287
  540    HB2  SER  68           2HB      SER  68  -9.658  -0.825   7.024
  541    HB3  SER  68           1HB      SER  68 -11.348  -1.304   6.857
  542    HG   SER  68           HG       SER  68 -10.616  -2.251   8.709
  543    H    SER  69           HN       SER  69  -8.007  -1.597   4.156
  544    HA   SER  69           HA       SER  69  -8.752   0.866   3.124
  545    HB2  SER  69           2HB      SER  69  -6.887  -1.146   1.845
  546    HB3  SER  69           1HB      SER  69  -6.878   0.601   1.605
  547    HG   SER  69           HG       SER  69  -6.694   0.390   4.147
  548    H    ALA  70           HN       ALA  70  -9.502  -2.358   2.035
  549    HA   ALA  70           HA       ALA  70 -10.252  -1.889  -0.588
  550    HB1  ALA  70           1HB      ALA  70 -11.551  -3.941  -0.419
  551    HB2  ALA  70           2HB      ALA  70 -11.440  -3.876   1.340
  552    HB3  ALA  70           3HB      ALA  70  -9.985  -4.119   0.372
  553    H    LYS  71           HN       LYS  71 -11.958  -1.253   2.393
  554    HA   LYS  71           HA       LYS  71 -14.343  -0.453   0.876
  555    HB2  LYS  71           2HB      LYS  71 -14.037  -0.943   3.843
  556    HB3  LYS  71           1HB      LYS  71 -15.531  -0.535   3.013
  557    HG2  LYS  71           2HG      LYS  71 -15.373  -2.639   1.742
  558    HG3  LYS  71           1HG      LYS  71 -13.915  -3.048   2.644
  559    HD2  LYS  71           2HD      LYS  71 -15.839  -4.177   3.607
  560    HD3  LYS  71           1HD      LYS  71 -15.213  -2.976   4.738
  561    HE2  LYS  71           2HE      LYS  71 -16.967  -1.435   4.143
  562    HE3  LYS  71           1HE      LYS  71 -17.542  -2.515   2.877
  563    HZ1  LYS  71           3HZ      LYS  71 -18.903  -2.668   4.853
  564    HZ2  LYS  71           1HZ      LYS  71 -17.561  -3.086   5.788
  565    HZ3  LYS  71           2HZ      LYS  71 -18.108  -4.132   4.583
  566    H    ALA  72           HN       ALA  72 -11.614   0.899   1.762
  567    HA   ALA  72           HA       ALA  72 -12.873   3.440   2.560
  568    HB1  ALA  72           1HB      ALA  72 -10.833   3.989   3.784
  569    HB2  ALA  72           2HB      ALA  72 -10.127   2.443   3.320
  570    HB3  ALA  72           3HB      ALA  72 -11.533   2.483   4.382
  571    H    ARG  73           HN       ARG  73 -11.904   2.033  -0.026
  572    HA   ARG  73           HA       ARG  73 -11.258   2.707  -2.088
  573    HB2  ARG  73           2HB      ARG  73 -12.285   4.916  -1.461
  574    HB3  ARG  73           1HB      ARG  73 -10.700   5.441  -0.921
  575    HG2  ARG  73           2HG      ARG  73 -11.139   6.314  -3.121
  576    HG3  ARG  73           1HG      ARG  73  -9.843   5.119  -3.215
  577    HD2  ARG  73           2HD      ARG  73 -11.385   3.451  -4.040
  578    HD3  ARG  73           1HD      ARG  73 -12.743   4.553  -3.825
  579    HE   ARG  73           HE       ARG  73 -10.821   5.723  -5.536
  580   HH11  ARG  73          1HH1      ARG  73 -13.190   3.131  -5.512
  581   HH12  ARG  73          2HH1      ARG  73 -13.516   3.235  -7.205
  582   HH21  ARG  73          1HH2      ARG  73 -11.250   5.865  -7.794
  583   HH22  ARG  73          2HH2      ARG  73 -12.405   4.800  -8.514
  584    H    GLY  74           HN       GLY  74  -9.210   3.410   0.626
  585    HA2  GLY  74           2HA      GLY  74  -7.031   2.430   0.762
  586    HA3  GLY  74           1HA      GLY  74  -6.892   2.582  -0.984
  587    H    ASP  75           HN       ASP  75  -8.167   5.344  -0.494
  588    HA   ASP  75           HA       ASP  75  -5.649   6.749  -0.459
  589    HB2  ASP  75           2HB      ASP  75  -7.433   7.353  -2.045
  590    HB3  ASP  75           1HB      ASP  75  -8.470   7.804  -0.700
  591    H    LEU  76           HN       LEU  76  -4.829   7.980   1.142
  592    HA   LEU  76           HA       LEU  76  -6.286   7.997   3.691
  593    HB2  LEU  76           2HB      LEU  76  -3.364   8.395   3.065
  594    HB3  LEU  76           1HB      LEU  76  -4.055   8.541   4.669
  595    HG   LEU  76           HG       LEU  76  -4.111   6.012   3.027
  596   HD11  LEU  76          1HD1      LEU  76  -2.290   6.798   5.297
  597   HD12  LEU  76          2HD1      LEU  76  -1.822   6.624   3.606
  598   HD13  LEU  76          3HD1      LEU  76  -2.357   5.215   4.523
  599   HD21  LEU  76          3HD2      LEU  76  -4.728   4.968   5.155
  600   HD22  LEU  76          1HD2      LEU  76  -5.913   6.176   4.660
  601   HD23  LEU  76          2HD2      LEU  76  -4.746   6.554   5.927
  602    H    GLY  77           HN       GLY  77  -5.806   9.987   1.127
  603    HA2  GLY  77           2HA      GLY  77  -6.258  12.227   0.873
  604    HA3  GLY  77           1HA      GLY  77  -6.537  12.331   2.607
  605    H    ALA  78           HN       ALA  78  -5.368  14.436   2.088
  606    HA   ALA  78           HA       ALA  78  -2.498  14.167   1.810
  607    HB1  ALA  78           1HB      ALA  78  -2.467  16.607   1.855
  608    HB2  ALA  78           2HB      ALA  78  -4.182  16.634   2.262
  609    HB3  ALA  78           3HB      ALA  78  -3.660  16.022   0.692
  610    H    PHE  79           HN       PHE  79  -1.420  13.509   3.541
  611    HA   PHE  79           HA       PHE  79  -2.261  14.551   6.158
  612    HB2  PHE  79           2HB      PHE  79  -1.235  12.507   7.148
  613    HB3  PHE  79           1HB      PHE  79  -2.594  12.160   6.089
  614    HD1  PHE  79           1HD      PHE  79   1.037  11.896   6.521
  615    HD2  PHE  79           2HD      PHE  79  -2.271  10.990   3.996
  616    HE1  PHE  79           1HE      PHE  79   2.436  10.315   5.255
  617    HE2  PHE  79           2HE      PHE  79  -0.877   9.410   2.730
  618    HZ   PHE  79           HZ       PHE  79   1.480   9.071   3.358
  619    H    SER  80           HN       SER  80  -0.625  14.995   7.704
  620    HA   SER  80           HA       SER  80   1.744  16.118   6.452
  621    HB2  SER  80           2HB      SER  80   0.276  17.447   8.028
  622    HB3  SER  80           1HB      SER  80   0.846  16.402   9.328
  623    HG   SER  80           HG       SER  80   2.239  18.332   7.833
  624    H    ARG  81           HN       ARG  81   3.777  16.000   7.771
  625    HA   ARG  81           HA       ARG  81   4.418  13.208   8.163
  626    HB2  ARG  81           2HB      ARG  81   6.743  13.997   8.302
  627    HB3  ARG  81           1HB      ARG  81   5.934  14.588   6.859
  628    HG2  ARG  81           2HG      ARG  81   5.572  16.756   7.988
  629    HG3  ARG  81           1HG      ARG  81   6.475  16.148   9.376
  630    HD2  ARG  81           2HD      ARG  81   8.420  15.779   7.886
  631    HD3  ARG  81           1HD      ARG  81   7.506  16.513   6.571
  632    HE   ARG  81           HE       ARG  81   7.633  18.229   8.842
  633   HH11  ARG  81          1HH1      ARG  81   9.448  17.119   6.066
  634   HH12  ARG  81          2HH1      ARG  81  10.473  18.506   5.998
  635   HH21  ARG  81          1HH2      ARG  81   9.003  20.072   8.788
  636   HH22  ARG  81          2HH2      ARG  81  10.226  20.198   7.564
  637    H    GLY  82           HN       GLY  82   5.447  12.363  10.021
  638    HA2  GLY  82           2HA      GLY  82   6.095  12.347  12.273
  639    HA3  GLY  82           1HA      GLY  82   5.447  13.971  12.453
  640    H    GLN  83           HN       GLN  83   3.514  11.567  10.900
  641    HA   GLN  83           HA       GLN  83   1.863  11.433  13.334
  642    HB2  GLN  83           2HB      GLN  83   0.936  11.665  10.477
  643    HB3  GLN  83           1HB      GLN  83  -0.122  11.407  11.858
  644    HG2  GLN  83           2HG      GLN  83   0.626  13.546  12.808
  645    HG3  GLN  83           1HG      GLN  83   1.632  13.807  11.386
  646   HE21  GLN  83          1HE2      GLN  83  -0.331  12.663   9.572
  647   HE22  GLN  83          2HE2      GLN  83  -1.597  13.830   9.432
  648    H    MET  84           HN       MET  84   3.017   9.758  10.475
  649    HA   MET  84           HA       MET  84   1.851   7.280  11.568
  650    HB2  MET  84           2HB      MET  84   2.573   7.910   8.700
  651    HB3  MET  84           1HB      MET  84   1.928   6.378   9.274
  652    HG2  MET  84           2HG      MET  84  -0.118   7.543   9.994
  653    HG3  MET  84           1HG      MET  84   0.529   9.040   9.326
  654    HE1  MET  84           3HE      MET  84  -2.257   8.252   6.749
  655    HE2  MET  84           1HE      MET  84  -1.551   9.452   7.830
  656    HE3  MET  84           2HE      MET  84  -2.319   8.010   8.494
  657    H    GLN  85           HN       GLN  85   3.240   5.412  10.199
  658    HA   GLN  85           HA       GLN  85   5.609   5.082  11.621
  659    HB2  GLN  85           2HB      GLN  85   4.840   3.876   8.955
  660    HB3  GLN  85           1HB      GLN  85   6.113   3.280  10.008
  661    HG2  GLN  85           2HG      GLN  85   3.250   3.466  10.881
  662    HG3  GLN  85           1HG      GLN  85   3.907   2.052  10.064
  663   HE21  GLN  85          1HE2      GLN  85   2.807   2.350  12.754
  664   HE22  GLN  85          2HE2      GLN  85   4.051   1.819  13.832
  665    H    LYS  86           HN       LYS  86   7.691   5.656  11.281
  666    HA   LYS  86           HA       LYS  86   8.366   7.808   9.683
  667    HB2  LYS  86           2HB      LYS  86   9.657   6.963  11.670
  668    HB3  LYS  86           1HB      LYS  86  10.299   5.685  10.657
  669    HG2  LYS  86           2HG      LYS  86  10.678   8.586   9.959
  670    HG3  LYS  86           1HG      LYS  86  11.755   7.750  11.074
  671    HD2  LYS  86           2HD      LYS  86  12.264   6.100   9.316
  672    HD3  LYS  86           1HD      LYS  86  11.209   6.974   8.206
  673    HE2  LYS  86           2HE      LYS  86  13.682   8.093   9.527
  674    HE3  LYS  86           1HE      LYS  86  13.579   7.532   7.860
  675    HZ1  LYS  86           3HZ      LYS  86  12.031   9.787   9.015
  676    HZ2  LYS  86           1HZ      LYS  86  11.957   9.260   7.415
  677    HZ3  LYS  86           2HZ      LYS  86  13.381   9.933   8.013
  678    HA   PRO  87           HA       PRO  87  10.311   4.696   6.400
  679    HB2  PRO  87           2HB      PRO  87   8.981   2.263   6.337
  680    HB3  PRO  87           1HB      PRO  87  10.561   2.528   7.081
  681    HG2  PRO  87           2HG      PRO  87   7.856   2.454   8.357
  682    HG3  PRO  87           1HG      PRO  87   9.383   1.762   8.931
  683    HD2  PRO  87           2HD      PRO  87   8.435   4.031   9.957
  684    HD3  PRO  87           1HD      PRO  87  10.176   3.821   9.665
  685    H    PHE  88           HN       PHE  88   6.946   4.743   7.370
  686    HA   PHE  88           HA       PHE  88   5.873   4.346   4.746
  687    HB2  PHE  88           2HB      PHE  88   4.622   3.838   6.863
  688    HB3  PHE  88           1HB      PHE  88   4.514   5.566   7.163
  689    HD1  PHE  88           2HD      PHE  88   3.310   2.781   5.133
  690    HD2  PHE  88           1HD      PHE  88   3.029   6.967   5.852
  691    HE1  PHE  88           2HE      PHE  88   1.242   2.867   3.804
  692    HE2  PHE  88           1HE      PHE  88   0.960   7.059   4.525
  693    HZ   PHE  88           HZ       PHE  88   0.067   5.008   3.498
  694    H    GLU  89           HN       GLU  89   6.284   7.158   6.877
  695    HA   GLU  89           HA       GLU  89   5.332   9.039   4.975
  696    HB2  GLU  89           2HB      GLU  89   7.092   9.476   7.388
  697    HB3  GLU  89           1HB      GLU  89   6.251  10.733   6.493
  698    HG2  GLU  89           2HG      GLU  89   4.105   9.702   7.105
  699    HG3  GLU  89           1HG      GLU  89   4.978   8.496   8.050
  700    H    ASP  90           HN       ASP  90   8.520   7.848   5.853
  701    HA   ASP  90           HA       ASP  90  10.077   9.634   4.373
  702    HB2  ASP  90           2HB      ASP  90  11.062   8.076   5.979
  703    HB3  ASP  90           1HB      ASP  90  10.599   6.713   4.966
  704    H    ALA  91           HN       ALA  91   8.350   6.749   3.403
  705    HA   ALA  91           HA       ALA  91   9.444   6.743   0.747
  706    HB1  ALA  91           1HB      ALA  91   7.881   4.921   0.323
  707    HB2  ALA  91           2HB      ALA  91   7.094   5.225   1.874
  708    HB3  ALA  91           3HB      ALA  91   8.763   4.658   1.828
  709    H    SER  92           HN       SER  92   6.280   7.542   2.177
  710    HA   SER  92           HA       SER  92   4.987   8.185  -0.220
  711    HB2  SER  92           2HB      SER  92   3.436   9.518   1.317
  712    HB3  SER  92           1HB      SER  92   3.620   7.798   1.662
  713    HG   SER  92           HG       SER  92   4.659   8.247   3.454
  714    H    PHE  93           HN       PHE  93   6.710  10.311   2.061
  715    HA   PHE  93           HA       PHE  93   6.203  12.664   0.535
  716    HB2  PHE  93           2HB      PHE  93   8.070  12.059   2.815
  717    HB3  PHE  93           1HB      PHE  93   8.089  13.620   2.003
  718    HD1  PHE  93           2HD      PHE  93   6.084  11.345   4.094
  719    HD2  PHE  93           1HD      PHE  93   6.356  15.219   2.357
  720    HE1  PHE  93           2HE      PHE  93   4.239  12.113   5.526
  721    HE2  PHE  93           1HE      PHE  93   4.511  15.992   3.787
  722    HZ   PHE  93           HZ       PHE  93   3.449  14.438   5.373
  723    H    ALA  94           HN       ALA  94   8.291  10.094   0.007
  724    HA   ALA  94           HA       ALA  94  10.227  11.724  -1.466
  725    HB1  ALA  94           1HB      ALA  94  11.544   9.690  -1.674
  726    HB2  ALA  94           2HB      ALA  94  10.252   8.759  -0.914
  727    HB3  ALA  94           3HB      ALA  94  11.118   9.983   0.012
  728    H    LEU  95           HN       LEU  95   7.346  10.165  -1.975
  729    HA   LEU  95           HA       LEU  95   7.909   9.285  -4.677
  730    HB2  LEU  95           2HB      LEU  95   5.312   9.427  -3.146
  731    HB3  LEU  95           1HB      LEU  95   5.499   8.732  -4.742
  732    HG   LEU  95           HG       LEU  95   6.750   7.687  -2.202
  733   HD11  LEU  95          1HD1      LEU  95   4.508   6.609  -3.900
  734   HD12  LEU  95          2HD1      LEU  95   4.345   7.340  -2.304
  735   HD13  LEU  95          3HD1      LEU  95   5.216   5.817  -2.491
  736   HD21  LEU  95          3HD2      LEU  95   7.425   5.774  -3.574
  737   HD22  LEU  95          1HD2      LEU  95   8.174   7.267  -4.133
  738   HD23  LEU  95          2HD2      LEU  95   6.805   6.586  -5.011
  739    H    ARG  96           HN       ARG  96   6.715  10.103  -6.483
  740    HA   ARG  96           HA       ARG  96   6.201  12.982  -6.273
  741    HB2  ARG  96           2HB      ARG  96   6.871  11.220  -8.632
  742    HB3  ARG  96           1HB      ARG  96   6.426  12.911  -8.776
  743    HG2  ARG  96           2HG      ARG  96   8.791  11.893  -7.218
  744    HG3  ARG  96           1HG      ARG  96   8.858  12.520  -8.866
  745    HD2  ARG  96           2HD      ARG  96   7.918  14.654  -8.041
  746    HD3  ARG  96           1HD      ARG  96   7.995  14.020  -6.398
  747    HE   ARG  96           HE       ARG  96  10.504  13.743  -7.046
  748   HH11  ARG  96          1HH1      ARG  96   8.384  16.414  -7.863
  749   HH12  ARG  96          2HH1      ARG  96   9.660  17.577  -7.934
  750   HH21  ARG  96          1HH2      ARG  96  12.189  15.267  -7.125
  751   HH22  ARG  96          2HH2      ARG  96  11.850  16.921  -7.505
  752    H    THR  97           HN       THR  97   4.490  13.737  -7.931
  753    HA   THR  97           HA       THR  97   2.019  12.566  -7.244
  754    HB   THR  97           HB       THR  97   2.595  14.480  -9.520
  755    HG1  THR  97           1HG      THR  97   1.985  14.971  -6.762
  756   HG21  THR  97          3HG2      THR  97   0.261  15.194  -9.161
  757   HG22  THR  97          1HG2      THR  97   0.075  13.942  -7.934
  758   HG23  THR  97          2HG2      THR  97   0.357  13.493  -9.615
  759    H    GLY  98           HN       GLY  98   1.518  10.562  -7.911
  760    HA2  GLY  98           2HA      GLY  98   0.580   9.205  -9.639
  761    HA3  GLY  98           1HA      GLY  98   1.616  10.018 -10.800
  762    H    GLU  99           HN       GLU  99   3.504   9.493  -8.193
  763    HA   GLU  99           HA       GLU  99   4.725   7.151  -9.428
  764    HB2  GLU  99           2HB      GLU  99   6.152   9.081  -8.873
  765    HB3  GLU  99           1HB      GLU  99   5.692   8.932  -7.184
  766    HG2  GLU  99           2HG      GLU  99   7.894   8.011  -7.529
  767    HG3  GLU  99           1HG      GLU  99   6.767   6.731  -7.093
  768    H    MET 100           HN       MET 100   5.280   5.297  -8.217
  769    HA   MET 100           HA       MET 100   3.732   4.917  -5.752
  770    HB2  MET 100           2HB      MET 100   2.488   3.989  -7.675
  771    HB3  MET 100           1HB      MET 100   3.872   2.986  -8.070
  772    HG2  MET 100           2HG      MET 100   3.618   1.731  -6.052
  773    HG3  MET 100           1HG      MET 100   2.359   2.824  -5.479
  774    HE1  MET 100           3HE      MET 100   1.825   0.095  -9.161
  775    HE2  MET 100           1HE      MET 100   3.324   0.199  -8.239
  776    HE3  MET 100           2HE      MET 100   2.771   1.583  -9.184
  777    H    SER 101           HN       SER 101   4.662   3.571  -4.243
  778    HA   SER 101           HA       SER 101   7.504   3.146  -4.531
  779    HB2  SER 101           2HB      SER 101   7.382   2.478  -2.159
  780    HB3  SER 101           1HB      SER 101   6.570   4.018  -2.426
  781    HG   SER 101           HG       SER 101   5.551   1.582  -1.644
  782    H    GLY 102           HN       GLY 102   8.052   0.915  -3.159
  783    HA2  GLY 102           2HA      GLY 102   6.840  -1.220  -4.775
  784    HA3  GLY 102           1HA      GLY 102   8.456  -1.268  -4.073
  785    HA   PRO 103           HA       PRO 103   5.884  -3.621  -1.107
  786    HB2  PRO 103           2HB      PRO 103   8.367  -5.071  -0.575
  787    HB3  PRO 103           1HB      PRO 103   6.829  -5.694  -1.181
  788    HG2  PRO 103           2HG      PRO 103   9.062  -5.545  -2.716
  789    HG3  PRO 103           1HG      PRO 103   7.427  -5.398  -3.381
  790    HD2  PRO 103           2HD      PRO 103   9.417  -3.255  -2.744
  791    HD3  PRO 103           1HD      PRO 103   8.322  -3.400  -4.137
  792    H    VAL 104           HN       VAL 104   5.719  -1.950   0.379
  793    HA   VAL 104           HA       VAL 104   8.063  -1.354   2.032
  794    HB   VAL 104           HB       VAL 104   5.387   0.065   1.956
  795   HG11  VAL 104          1HG1      VAL 104   8.005   0.880   3.215
  796   HG12  VAL 104          2HG1      VAL 104   6.572   0.323   4.077
  797   HG13  VAL 104          3HG1      VAL 104   6.527   1.843   3.182
  798   HG21  VAL 104          3HG2      VAL 104   8.006   0.832   0.666
  799   HG22  VAL 104          1HG2      VAL 104   6.548   1.822   0.701
  800   HG23  VAL 104          2HG2      VAL 104   6.554   0.291  -0.174
  801    H    PHE 105           HN       PHE 105   8.259  -2.256   3.961
  802    HA   PHE 105           HA       PHE 105   5.912  -3.538   5.156
  803    HB2  PHE 105           2HB      PHE 105   8.870  -3.945   5.590
  804    HB3  PHE 105           1HB      PHE 105   7.648  -4.655   6.636
  805    HD1  PHE 105           1HD      PHE 105   8.735  -4.493   3.086
  806    HD2  PHE 105           2HD      PHE 105   6.718  -6.707   6.106
  807    HE1  PHE 105           1HE      PHE 105   8.568  -6.414   1.558
  808    HE2  PHE 105           2HE      PHE 105   6.545  -8.632   4.586
  809    HZ   PHE 105           HZ       PHE 105   7.471  -8.485   2.308
  810    H    THR 106           HN       THR 106   4.875  -2.301   6.534
  811    HA   THR 106           HA       THR 106   6.433  -0.802   8.536
  812    HB   THR 106           HB       THR 106   4.502   0.779   8.657
  813    HG1  THR 106           1HG      THR 106   2.807  -0.326   7.787
  814   HG21  THR 106          3HG2      THR 106   4.976   1.944   6.522
  815   HG22  THR 106          1HG2      THR 106   5.817   0.504   5.953
  816   HG23  THR 106          2HG2      THR 106   6.444   1.402   7.336
  817    H    ASP 107           HN       ASP 107   4.213  -3.196   7.854
  818    HA   ASP 107           HA       ASP 107   3.429  -3.463  10.661
  819    HB2  ASP 107           2HB      ASP 107   1.599  -3.729   8.251
  820    HB3  ASP 107           1HB      ASP 107   1.166  -4.208   9.885
  821    H    SER 108           HN       SER 108   1.860  -5.796  10.118
  822    HA   SER 108           HA       SER 108   3.936  -7.719   9.805
  823    HB2  SER 108           2HB      SER 108   0.956  -8.186   9.798
  824    HB3  SER 108           1HB      SER 108   2.220  -9.353  10.181
  825    HG   SER 108           HG       SER 108   2.780  -7.677  11.879
  826    H    GLY 109           HN       GLY 109   1.299  -6.487   7.823
  827    HA2  GLY 109           2HA      GLY 109   1.987  -8.299   5.653
  828    HA3  GLY 109           1HA      GLY 109   0.623  -7.193   5.696
  829    H    ILE 110           HN       ILE 110   1.886  -7.230   3.420
  830    HA   ILE 110           HA       ILE 110   4.011  -5.229   3.382
  831    HB   ILE 110           HB       ILE 110   2.785  -6.609   0.991
  832   HG12  ILE 110          2HG1      ILE 110   5.138  -7.555   2.645
  833   HG13  ILE 110          1HG1      ILE 110   3.547  -8.307   2.626
  834   HG21  ILE 110          1HG2      ILE 110   5.478  -5.337   1.457
  835   HG22  ILE 110          2HG2      ILE 110   4.157  -4.673   0.495
  836   HG23  ILE 110          3HG2      ILE 110   4.974  -6.147  -0.025
  837   HD11  ILE 110          3HD1      ILE 110   5.429  -8.093   0.285
  838   HD12  ILE 110          1HD1      ILE 110   3.835  -8.847   0.260
  839   HD13  ILE 110          2HD1      ILE 110   5.121  -9.537   1.249
  840    H    HIS 111           HN       HIS 111   3.757  -3.177   2.598
  841    HA   HIS 111           HA       HIS 111   1.046  -2.434   1.712
  842    HB2  HIS 111           2HB      HIS 111   3.062  -0.807   3.266
  843    HB3  HIS 111           1HB      HIS 111   1.608  -0.134   2.551
  844    HD1  HIS 111           1HD      HIS 111  -0.667  -0.760   3.702
  845    HD2  HIS 111           2HD      HIS 111   2.728  -2.158   5.641
  846    HE1  HIS 111           1HE      HIS 111  -1.407  -1.333   6.026
  847    HE2  HIS 111           2HE      HIS 111   0.748  -1.791   7.238
  848    H    ILE 112           HN       ILE 112   0.842  -1.042   0.015
  849    HA   ILE 112           HA       ILE 112   3.306  -0.232  -1.384
  850    HB   ILE 112           HB       ILE 112   0.621  -0.748  -2.689
  851   HG12  ILE 112          2HG1      ILE 112   3.092  -2.502  -2.676
  852   HG13  ILE 112          1HG1      ILE 112   1.553  -2.877  -1.909
  853   HG21  ILE 112          1HG2      ILE 112   3.350  -0.238  -3.868
  854   HG22  ILE 112          2HG2      ILE 112   1.994   0.888  -3.845
  855   HG23  ILE 112          3HG2      ILE 112   1.889  -0.599  -4.787
  856   HD11  ILE 112          3HD1      ILE 112   1.774  -4.098  -3.981
  857   HD12  ILE 112          1HD1      ILE 112   2.055  -2.599  -4.864
  858   HD13  ILE 112          2HD1      ILE 112   0.485  -2.903  -4.126
  859    H    ILE 113           HN       ILE 113   3.400   1.932  -1.952
  860    HA   ILE 113           HA       ILE 113   1.142   3.561  -0.999
  861    HB   ILE 113           HB       ILE 113   4.065   4.302  -1.036
  862   HG12  ILE 113          2HG1      ILE 113   2.324   3.600   1.337
  863   HG13  ILE 113          1HG1      ILE 113   3.516   2.522   0.619
  864   HG21  ILE 113          1HG2      ILE 113   1.682   5.713   0.173
  865   HG22  ILE 113          2HG2      ILE 113   2.563   6.220  -1.269
  866   HG23  ILE 113          3HG2      ILE 113   3.361   6.235   0.304
  867   HD11  ILE 113          3HD1      ILE 113   4.096   5.182   1.906
  868   HD12  ILE 113          1HD1      ILE 113   5.288   4.090   1.203
  869   HD13  ILE 113          2HD1      ILE 113   4.371   3.596   2.627
  870    H    LEU 114           HN       LEU 114   0.246   4.906  -2.415
  871    HA   LEU 114           HA       LEU 114   1.743   5.614  -4.856
  872    HB2  LEU 114           2HB      LEU 114  -0.022   4.082  -5.471
  873    HB3  LEU 114           1HB      LEU 114  -1.198   5.003  -4.553
  874    HG   LEU 114           HG       LEU 114  -0.764   6.925  -6.148
  875   HD11  LEU 114          1HD1      LEU 114   0.551   4.759  -7.769
  876   HD12  LEU 114          2HD1      LEU 114   1.364   6.143  -7.035
  877   HD13  LEU 114          3HD1      LEU 114   0.178   6.393  -8.317
  878   HD21  LEU 114          3HD2      LEU 114  -2.223   6.013  -7.878
  879   HD22  LEU 114          1HD2      LEU 114  -2.772   5.557  -6.267
  880   HD23  LEU 114          2HD2      LEU 114  -1.924   4.384  -7.275
  881    H    ARG 115           HN       ARG 115   2.125   7.746  -4.951
  882    HA   ARG 115           HA       ARG 115   0.584   9.512  -3.243
  883    HB2  ARG 115           2HB      ARG 115   2.998   9.841  -3.305
  884    HB3  ARG 115           1HB      ARG 115   2.943  10.091  -5.045
  885    HG2  ARG 115           2HG      ARG 115   1.646  12.121  -4.741
  886    HG3  ARG 115           1HG      ARG 115   1.615  11.859  -2.998
  887    HD2  ARG 115           2HD      ARG 115   3.988  12.162  -2.851
  888    HD3  ARG 115           1HD      ARG 115   4.137  12.209  -4.609
  889    HE   ARG 115           HE       ARG 115   2.382  14.237  -3.903
  890   HH11  ARG 115          1HH1      ARG 115   5.765  13.441  -3.369
  891   HH12  ARG 115          2HH1      ARG 115   6.262  15.090  -3.215
  892   HH21  ARG 115          1HH2      ARG 115   3.045  16.418  -3.697
  893   HH22  ARG 115          2HH2      ARG 115   4.705  16.794  -3.413
  894    H    THR 116           HN       THR 116  -1.326  10.060  -3.976
  895    HA   THR 116           HA       THR 116  -1.983  10.221  -6.739
  896    HB   THR 116           HB       THR 116  -3.605  11.378  -4.477
  897    HG1  THR 116           1HG      THR 116  -4.398   8.914  -4.944
  898   HG21  THR 116          3HG2      THR 116  -5.491  10.686  -5.884
  899   HG22  THR 116          1HG2      THR 116  -4.368  10.027  -7.074
  900   HG23  THR 116          2HG2      THR 116  -4.413  11.763  -6.770
  901    H    GLU 117           HN       GLU 117  -1.234  12.560  -4.201
  902    HA   GLU 117           HA       GLU 117  -1.023  14.640  -6.254
  903    HB2  GLU 117           2HB      GLU 117  -2.346  14.962  -3.557
  904    HB3  GLU 117           1HB      GLU 117  -1.947  16.287  -4.636
  905    HG2  GLU 117           2HG      GLU 117  -3.451  15.329  -6.327
  906    HG3  GLU 117           1HG      GLU 117  -3.882  14.053  -5.192
  Start of MODEL    2
    1    H1   GLY   1           1HT      GLY   1   7.060  31.616   7.344
    2    H2   GLY   1           2HT      GLY   1   8.424  32.611   7.390
    3    H3   GLY   1           3HT      GLY   1   7.310  32.646   8.664
    4    HA2  GLY   1           1HA      GLY   1   9.289  31.409   9.280
    5    HA3  GLY   1           2HA      GLY   1   7.853  30.398   9.273
    6    H    SER   2           HN       SER   2  10.475  29.404   9.063
    7    HA   SER   2           HA       SER   2  10.755  28.693   6.244
    8    HB2  SER   2           2HB      SER   2  12.632  28.212   8.562
    9    HB3  SER   2           1HB      SER   2  12.976  27.887   6.863
   10    HG   SER   2           HG       SER   2  12.133  30.399   7.071
   11    H    HIS   3           HN       HIS   3  10.390  26.694   5.506
   12    HA   HIS   3           HA       HIS   3  10.339  24.418   7.251
   13    HB2  HIS   3           2HB      HIS   3   7.998  23.741   6.500
   14    HB3  HIS   3           1HB      HIS   3   8.088  25.028   7.688
   15    HD1  HIS   3           1HD      HIS   3   6.898  27.161   7.125
   16    HD2  HIS   3           2HD      HIS   3   7.369  24.702   3.812
   17    HE1  HIS   3           1HE      HIS   3   5.545  28.226   5.295
   18    HE2  HIS   3           2HE      HIS   3   5.989  26.812   3.262
   19    H    MET   4           HN       MET   4  10.913  22.622   6.215
   20    HA   MET   4           HA       MET   4  11.198  22.808   3.286
   21    HB2  MET   4           2HB      MET   4  13.327  22.771   4.573
   22    HB3  MET   4           1HB      MET   4  12.867  21.216   5.245
   23    HG2  MET   4           2HG      MET   4  12.828  20.295   2.940
   24    HG3  MET   4           1HG      MET   4  13.446  21.840   2.361
   25    HE1  MET   4           3HE      MET   4  15.442  22.584   4.821
   26    HE2  MET   4           1HE      MET   4  15.799  22.843   3.113
   27    HE3  MET   4           2HE      MET   4  16.953  21.987   4.135
   28    H    GLU   5           HN       GLU   5  10.724  20.987   2.032
   29    HA   GLU   5           HA       GLU   5   9.795  19.011   1.418
   30    HB2  GLU   5           2HB      GLU   5  11.108  17.872   3.090
   31    HB3  GLU   5           1HB      GLU   5  10.020  18.381   4.367
   32    HG2  GLU   5           2HG      GLU   5   8.261  16.968   3.422
   33    HG3  GLU   5           1HG      GLU   5   9.365  16.461   2.144
   34    HA   PRO   6           HA       PRO   6   5.466  20.024   1.570
   35    HB2  PRO   6           2HB      PRO   6   5.120  17.135   0.915
   36    HB3  PRO   6           1HB      PRO   6   4.460  18.557   0.099
   37    HG2  PRO   6           2HG      PRO   6   6.480  17.200  -0.970
   38    HG3  PRO   6           1HG      PRO   6   6.424  18.970  -1.057
   39    HD2  PRO   6           2HD      PRO   6   8.076  17.207   0.695
   40    HD3  PRO   6           1HD      PRO   6   8.494  18.754  -0.069
   41    H    ALA   7           HN       ALA   7   4.525  20.259   3.484
   42    HA   ALA   7           HA       ALA   7   4.958  18.498   5.655
   43    HB1  ALA   7           1HB      ALA   7   3.432  19.934   6.882
   44    HB2  ALA   7           2HB      ALA   7   2.939  20.710   5.376
   45    HB3  ALA   7           3HB      ALA   7   4.594  20.887   5.958
   46    H    ARG   8           HN       ARG   8   2.310  18.882   3.366
   47    HA   ARG   8           HA       ARG   8   1.117  16.450   4.501
   48    HB2  ARG   8           2HB      ARG   8  -0.397  18.887   3.556
   49    HB3  ARG   8           1HB      ARG   8  -1.131  17.363   4.031
   50    HG2  ARG   8           2HG      ARG   8  -0.209  17.650   6.285
   51    HG3  ARG   8           1HG      ARG   8   0.455  19.207   5.798
   52    HD2  ARG   8           2HD      ARG   8  -1.826  19.976   5.270
   53    HD3  ARG   8           1HD      ARG   8  -2.452  18.428   5.842
   54    HE   ARG   8           HE       ARG   8  -0.855  20.064   7.665
   55   HH11  ARG   8          1HH1      ARG   8  -3.974  18.740   6.758
   56   HH12  ARG   8          2HH1      ARG   8  -4.722  19.113   8.267
   57   HH21  ARG   8          1HH2      ARG   8  -1.837  20.556   9.681
   58   HH22  ARG   8          2HH2      ARG   8  -3.502  20.161   9.938
   59    H    VAL   9           HN       VAL   9   0.911  14.897   3.070
   60    HA   VAL   9           HA       VAL   9   0.619  15.616   0.233
   61    HB   VAL   9           HB       VAL   9   1.964  13.651  -0.398
   62   HG11  VAL   9          1HG1      VAL   9   3.410  15.538   1.454
   63   HG12  VAL   9          2HG1      VAL   9   3.085  15.793  -0.261
   64   HG13  VAL   9          3HG1      VAL   9   4.174  14.503   0.247
   65   HG21  VAL   9          3HG2      VAL   9   3.295  12.447   1.266
   66   HG22  VAL   9          1HG2      VAL   9   1.570  12.276   1.586
   67   HG23  VAL   9          2HG2      VAL   9   2.540  13.385   2.554
   68    H    ARG  10           HN       ARG  10  -0.676  14.246  -1.006
   69    HA   ARG  10           HA       ARG  10  -2.438  12.525   0.588
   70    HB2  ARG  10           2HB      ARG  10  -3.540  14.290  -0.715
   71    HB3  ARG  10           1HB      ARG  10  -2.804  13.660  -2.184
   72    HG2  ARG  10           2HG      ARG  10  -4.039  11.576  -1.922
   73    HG3  ARG  10           1HG      ARG  10  -4.772  12.194  -0.442
   74    HD2  ARG  10           2HD      ARG  10  -5.776  14.025  -1.731
   75    HD3  ARG  10           1HD      ARG  10  -5.071  13.355  -3.204
   76    HE   ARG  10           HE       ARG  10  -6.717  11.497  -1.732
   77   HH11  ARG  10          1HH1      ARG  10  -6.657  13.980  -4.232
   78   HH12  ARG  10          2HH1      ARG  10  -8.140  13.441  -4.956
   79   HH21  ARG  10          1HH2      ARG  10  -8.682  10.835  -2.667
   80   HH22  ARG  10          2HH2      ARG  10  -9.296  11.658  -4.066
   81    H    CYS  11           HN       CYS  11  -1.891  10.456   0.576
   82    HA   CYS  11           HA       CYS  11  -0.918   9.321  -1.950
   83    HB2  CYS  11           2HB      CYS  11   0.095   8.623   0.812
   84    HB3  CYS  11           1HB      CYS  11   0.604   7.870  -0.693
   85    HG   CYS  11           HG       CYS  11   1.723  10.612   0.761
   86    H    SER  12           HN       SER  12  -1.634   7.336  -2.488
   87    HA   SER  12           HA       SER  12  -3.803   6.229  -0.878
   88    HB2  SER  12           2HB      SER  12  -2.912   5.529  -3.694
   89    HB3  SER  12           1HB      SER  12  -4.383   4.977  -2.894
   90    HG   SER  12           HG       SER  12  -3.884   7.736  -3.162
   91    H    HIS  13           HN       HIS  13  -3.726   4.054  -0.173
   92    HA   HIS  13           HA       HIS  13  -1.135   2.726  -0.493
   93    HB2  HIS  13           2HB      HIS  13  -0.902   2.275   1.866
   94    HB3  HIS  13           1HB      HIS  13  -1.058   4.006   1.620
   95    HD1  HIS  13           1HD      HIS  13  -1.613   2.702   4.365
   96    HD2  HIS  13           2HD      HIS  13  -4.545   3.556   1.545
   97    HE1  HIS  13           1HE      HIS  13  -3.757   2.860   5.647
   98    HE2  HIS  13           2HE      HIS  13  -5.490   3.523   3.943
   99    H    LEU  14           HN       LEU  14  -1.092   0.517   0.027
  100    HA   LEU  14           HA       LEU  14  -3.686  -0.837   0.217
  101    HB2  LEU  14           2HB      LEU  14  -2.869  -0.771  -2.158
  102    HB3  LEU  14           1HB      LEU  14  -1.423  -1.608  -1.650
  103    HG   LEU  14           HG       LEU  14  -4.111  -2.879  -1.226
  104   HD11  LEU  14          1HD1      LEU  14  -2.502  -2.939  -3.773
  105   HD12  LEU  14          2HD1      LEU  14  -4.079  -2.179  -3.558
  106   HD13  LEU  14          3HD1      LEU  14  -3.917  -3.929  -3.420
  107   HD21  LEU  14          3HD2      LEU  14  -2.813  -4.940  -1.482
  108   HD22  LEU  14          1HD2      LEU  14  -2.138  -3.924  -0.208
  109   HD23  LEU  14          2HD2      LEU  14  -1.358  -3.992  -1.788
  110    H    LEU  15           HN       LEU  15  -3.610  -2.747   1.445
  111    HA   LEU  15           HA       LEU  15  -0.985  -3.504   2.525
  112    HB2  LEU  15           2HB      LEU  15  -1.956  -2.166   4.251
  113    HB3  LEU  15           1HB      LEU  15  -3.496  -2.989   4.108
  114    HG   LEU  15           HG       LEU  15  -2.522  -5.033   5.038
  115   HD11  LEU  15          1HD1      LEU  15   0.021  -3.437   5.289
  116   HD12  LEU  15          2HD1      LEU  15  -0.250  -4.800   4.205
  117   HD13  LEU  15          3HD1      LEU  15  -0.258  -5.048   5.950
  118   HD21  LEU  15          3HD2      LEU  15  -2.105  -4.223   7.318
  119   HD22  LEU  15          1HD2      LEU  15  -3.499  -3.437   6.580
  120   HD23  LEU  15          2HD2      LEU  15  -1.965  -2.579   6.697
  121    H    VAL  16           HN       VAL  16  -0.602  -5.534   2.104
  122    HA   VAL  16           HA       VAL  16  -2.869  -7.399   2.000
  123    HB   VAL  16           HB       VAL  16  -1.761  -7.145  -0.180
  124   HG11  VAL  16          1HG1      VAL  16   0.721  -8.098   1.231
  125   HG12  VAL  16          2HG1      VAL  16   0.451  -6.508   0.513
  126   HG13  VAL  16          3HG1      VAL  16   0.544  -7.936  -0.518
  127   HG21  VAL  16          3HG2      VAL  16  -1.294  -9.514  -0.636
  128   HG22  VAL  16          1HG2      VAL  16  -2.745  -9.298   0.345
  129   HG23  VAL  16          2HG2      VAL  16  -1.242  -9.825   1.098
  130    H    LYS  17           HN       LYS  17  -2.855  -9.131   3.315
  131    HA   LYS  17           HA       LYS  17  -0.902  -9.269   5.411
  132    HB2  LYS  17           2HB      LYS  17  -3.343 -10.902   4.754
  133    HB3  LYS  17           1HB      LYS  17  -2.260 -11.338   6.066
  134    HG2  LYS  17           2HG      LYS  17  -3.681  -8.696   5.846
  135    HG3  LYS  17           1HG      LYS  17  -4.260 -10.074   6.784
  136    HD2  LYS  17           2HD      LYS  17  -2.156 -10.019   8.088
  137    HD3  LYS  17           1HD      LYS  17  -1.672  -8.577   7.194
  138    HE2  LYS  17           2HE      LYS  17  -4.108  -8.846   8.953
  139    HE3  LYS  17           1HE      LYS  17  -2.623  -7.992   9.361
  140    HZ1  LYS  17           3HZ      LYS  17  -4.168  -6.391   8.641
  141    HZ2  LYS  17           1HZ      LYS  17  -4.611  -7.288   7.275
  142    HZ3  LYS  17           2HZ      LYS  17  -3.081  -6.576   7.360
  143    H    HIS  18           HN       HIS  18   0.269 -11.150   6.000
  144    HA   HIS  18           HA       HIS  18   1.007 -12.862   3.736
  145    HB2  HIS  18           2HB      HIS  18   3.329 -12.974   4.745
  146    HB3  HIS  18           1HB      HIS  18   2.895 -11.421   4.055
  147    HD1  HIS  18           1HD      HIS  18   4.586 -12.733   6.857
  148    HD2  HIS  18           2HD      HIS  18   1.866  -9.646   6.341
  149    HE1  HIS  18           1HE      HIS  18   4.917 -11.211   8.827
  150    HE2  HIS  18           2HE      HIS  18   3.341  -9.293   8.450
  151    H    SER  19           HN       SER  19   1.616 -15.029   4.241
  152    HA   SER  19           HA       SER  19  -0.182 -16.258   5.959
  153    HB2  SER  19           2HB      SER  19   1.039 -17.267   3.963
  154    HB3  SER  19           1HB      SER  19   2.398 -17.533   5.053
  155    HG   SER  19           HG       SER  19  -0.242 -18.501   5.450
  156    H    GLN  20           HN       GLN  20   3.338 -15.927   6.428
  157    HA   GLN  20           HA       GLN  20   3.077 -16.852   9.147
  158    HB2  GLN  20           2HB      GLN  20   5.480 -15.868   7.609
  159    HB3  GLN  20           1HB      GLN  20   5.535 -16.493   9.251
  160    HG2  GLN  20           2HG      GLN  20   4.666 -18.023   6.806
  161    HG3  GLN  20           1HG      GLN  20   6.218 -18.173   7.628
  162   HE21  GLN  20          1HE2      GLN  20   6.293 -19.144   9.665
  163   HE22  GLN  20          2HE2      GLN  20   5.022 -20.170  10.227
  164    H    SER  21           HN       SER  21   1.751 -15.264  10.013
  165    HA   SER  21           HA       SER  21   3.201 -12.913  10.925
  166    HB2  SER  21           2HB      SER  21   1.203 -11.462  10.449
  167    HB3  SER  21           1HB      SER  21   2.034 -12.028   9.002
  168    HG   SER  21           HG       SER  21   0.395 -13.377   8.558
  169    H    ARG  22           HN       ARG  22   1.583 -11.705  12.558
  170    HA   ARG  22           HA       ARG  22   0.944 -13.700  14.507
  171    HB2  ARG  22           2HB      ARG  22   0.513 -10.713  14.554
  172    HB3  ARG  22           1HB      ARG  22   0.231 -11.785  15.916
  173    HG2  ARG  22           2HG      ARG  22   2.656 -12.446  15.758
  174    HG3  ARG  22           1HG      ARG  22   2.852 -11.126  14.602
  175    HD2  ARG  22           2HD      ARG  22   3.468 -10.366  16.808
  176    HD3  ARG  22           1HD      ARG  22   1.986  -9.559  16.296
  177    HE   ARG  22           HE       ARG  22   2.033 -11.852  18.156
  178   HH11  ARG  22          1HH1      ARG  22   0.768  -8.708  17.195
  179   HH12  ARG  22          2HH1      ARG  22  -0.380  -8.648  18.485
  180   HH21  ARG  22          1HH2      ARG  22   0.519 -11.741  19.866
  181   HH22  ARG  22          2HH2      ARG  22  -0.517 -10.357  20.008
  182    H    ARG  23           HN       ARG  23  -0.861 -11.659  12.310
  183    HA   ARG  23           HA       ARG  23  -3.258 -13.200  13.001
  184    HB2  ARG  23           2HB      ARG  23  -3.146 -10.223  12.498
  185    HB3  ARG  23           1HB      ARG  23  -4.631 -11.158  12.562
  186    HG2  ARG  23           2HG      ARG  23  -4.114 -11.772  14.890
  187    HG3  ARG  23           1HG      ARG  23  -2.668 -10.762  14.812
  188    HD2  ARG  23           2HD      ARG  23  -5.509  -9.821  14.435
  189    HD3  ARG  23           1HD      ARG  23  -4.529  -9.587  15.882
  190    HE   ARG  23           HE       ARG  23  -2.993  -8.433  14.050
  191   HH11  ARG  23          1HH1      ARG  23  -6.457  -8.152  14.566
  192   HH12  ARG  23          2HH1      ARG  23  -6.533  -6.524  13.993
  193   HH21  ARG  23          1HH2      ARG  23  -3.098  -6.286  13.294
  194   HH22  ARG  23          2HH2      ARG  23  -4.614  -5.450  13.272
  195    HA   PRO  24           HA       PRO  24  -2.655 -13.371   8.484
  196    HB2  PRO  24           2HB      PRO  24  -2.728 -16.044   8.209
  197    HB3  PRO  24           1HB      PRO  24  -1.259 -15.198   8.709
  198    HG2  PRO  24           2HG      PRO  24  -3.168 -16.797  10.334
  199    HG3  PRO  24           1HG      PRO  24  -1.422 -16.587  10.530
  200    HD2  PRO  24           2HD      PRO  24  -3.437 -15.250  11.971
  201    HD3  PRO  24           1HD      PRO  24  -1.716 -14.829  11.933
  202    H    SER  25           HN       SER  25  -4.908 -12.401   8.960
  203    HA   SER  25           HA       SER  25  -6.872 -14.190   7.768
  204    HB2  SER  25           2HB      SER  25  -7.355 -12.695  10.354
  205    HB3  SER  25           1HB      SER  25  -8.597 -13.530   9.424
  206    HG   SER  25           HG       SER  25  -7.194 -15.439   9.666
  207    H    SER  26           HN       SER  26  -8.101 -13.195   6.295
  208    HA   SER  26           HA       SER  26  -8.332 -10.265   6.362
  209    HB2  SER  26           2HB      SER  26  -8.092 -10.222   3.918
  210    HB3  SER  26           1HB      SER  26  -6.654 -10.940   4.646
  211    H    TRP  27           HN       TRP  27 -10.083  -9.804   4.402
  212    HA   TRP  27           HA       TRP  27 -12.419 -11.308   5.220
  213    HB2  TRP  27           2HB      TRP  27 -13.726  -9.659   3.948
  214    HB3  TRP  27           1HB      TRP  27 -12.640  -8.872   5.079
  215    HD1  TRP  27           1HD      TRP  27 -10.256  -7.931   3.821
  216    HE1  TRP  27           1HE      TRP  27 -10.083  -6.664   1.593
  217    HE3  TRP  27           3HE      TRP  27 -14.697  -9.353   1.758
  218    HZ2  TRP  27           2HZ      TRP  27 -11.632  -6.317  -0.733
  219    HZ3  TRP  27           3HZ      TRP  27 -15.283  -8.503  -0.476
  220    HH2  TRP  27           2HH      TRP  27 -13.780  -7.017  -1.694
  221    H    ARG  28           HN       ARG  28 -10.052 -11.816   3.129
  222    HA   ARG  28           HA       ARG  28 -11.755 -13.071   1.095
  223    HB2  ARG  28           2HB      ARG  28  -8.838 -12.291   1.071
  224    HB3  ARG  28           1HB      ARG  28  -9.566 -13.301  -0.169
  225    HG2  ARG  28           2HG      ARG  28 -10.347 -10.469   0.497
  226    HG3  ARG  28           1HG      ARG  28  -9.414 -10.997  -0.907
  227    HD2  ARG  28           2HD      ARG  28 -11.348 -12.400  -1.584
  228    HD3  ARG  28           1HD      ARG  28 -12.268 -11.699  -0.256
  229    HE   ARG  28           HE       ARG  28 -11.218  -9.647  -1.866
  230   HH11  ARG  28          1HH1      ARG  28 -13.676 -12.155  -1.863
  231   HH12  ARG  28          2HH1      ARG  28 -14.699 -11.345  -2.999
  232   HH21  ARG  28          1HH2      ARG  28 -12.602  -8.558  -3.378
  233   HH22  ARG  28          2HH2      ARG  28 -14.092  -9.291  -3.849
  234    H    GLN  29           HN       GLN  29  -8.892 -13.629   3.112
  235    HA   GLN  29           HA       GLN  29  -9.563 -16.494   3.072
  236    HB2  GLN  29           2HB      GLN  29  -6.853 -15.182   3.312
  237    HB3  GLN  29           1HB      GLN  29  -7.141 -16.900   3.530
  238    HG2  GLN  29           2HG      GLN  29  -7.942 -17.012   1.198
  239    HG3  GLN  29           1HG      GLN  29  -7.531 -15.309   1.008
  240   HE21  GLN  29          1HE2      GLN  29  -6.509 -17.652  -0.378
  241   HE22  GLN  29          2HE2      GLN  29  -4.795 -17.646  -0.150
  242    H    GLU  30           HN       GLU  30 -10.149 -17.285   4.969
  243    HA   GLU  30           HA       GLU  30 -10.122 -15.754   7.355
  244    HB2  GLU  30           2HB      GLU  30 -11.666 -17.717   6.704
  245    HB3  GLU  30           1HB      GLU  30 -10.349 -18.759   7.222
  246    HG2  GLU  30           2HG      GLU  30 -11.988 -18.499   8.981
  247    HG3  GLU  30           1HG      GLU  30 -10.446 -17.781   9.451
  248    H    LYS  31           HN       LYS  31  -8.062 -18.111   5.888
  249    HA   LYS  31           HA       LYS  31  -5.991 -17.502   7.852
  250    HB2  LYS  31           2HB      LYS  31  -5.163 -19.877   7.529
  251    HB3  LYS  31           1HB      LYS  31  -6.652 -19.714   8.446
  252    HG2  LYS  31           2HG      LYS  31  -7.934 -20.314   6.435
  253    HG3  LYS  31           1HG      LYS  31  -6.419 -20.537   5.558
  254    HD2  LYS  31           2HD      LYS  31  -5.771 -22.314   7.071
  255    HD3  LYS  31           1HD      LYS  31  -7.214 -22.044   8.048
  256    HE2  LYS  31           2HE      LYS  31  -8.605 -22.629   6.095
  257    HE3  LYS  31           1HE      LYS  31  -7.138 -22.969   5.180
  258    HZ1  LYS  31           3HZ      LYS  31  -8.144 -24.974   6.093
  259    HZ2  LYS  31           1HZ      LYS  31  -7.970 -24.367   7.661
  260    HZ3  LYS  31           2HZ      LYS  31  -6.600 -24.720   6.735
  261    H    ILE  32           HN       ILE  32  -4.600 -16.310   6.778
  262    HA   ILE  32           HA       ILE  32  -4.389 -16.164   3.991
  263    HB   ILE  32           HB       ILE  32  -2.300 -15.375   6.035
  264   HG12  ILE  32          2HG1      ILE  32  -4.458 -14.271   6.425
  265   HG13  ILE  32          1HG1      ILE  32  -3.249 -13.126   5.860
  266   HG21  ILE  32          1HG2      ILE  32  -2.659 -14.509   3.173
  267   HG22  ILE  32          2HG2      ILE  32  -1.376 -15.551   3.792
  268   HG23  ILE  32          3HG2      ILE  32  -1.467 -13.864   4.302
  269   HD11  ILE  32          3HD1      ILE  32  -5.402 -12.717   4.830
  270   HD12  ILE  32          1HD1      ILE  32  -5.429 -14.363   4.205
  271   HD13  ILE  32          2HD1      ILE  32  -4.221 -13.222   3.620
  272    H    THR  33           HN       THR  33  -3.650 -17.596   2.625
  273    HA   THR  33           HA       THR  33  -1.663 -19.531   3.561
  274    HB   THR  33           HB       THR  33  -2.370 -20.868   1.553
  275    HG1  THR  33           1HG      THR  33  -4.774 -19.749   1.197
  276   HG21  THR  33          3HG2      THR  33  -4.504 -21.587   2.552
  277   HG22  THR  33          1HG2      THR  33  -4.529 -20.125   3.534
  278   HG23  THR  33          2HG2      THR  33  -3.268 -21.332   3.781
  279    H    ARG  34           HN       ARG  34  -1.861 -16.738   1.736
  280    HA   ARG  34           HA       ARG  34   0.000 -17.407  -0.315
  281    HB2  ARG  34           2HB      ARG  34   0.040 -15.077  -0.871
  282    HB3  ARG  34           1HB      ARG  34  -1.612 -15.470  -0.429
  283    HG2  ARG  34           2HG      ARG  34  -1.099 -14.549   1.856
  284    HG3  ARG  34           1HG      ARG  34   0.421 -13.961   1.188
  285    HD2  ARG  34           2HD      ARG  34  -1.166 -12.177   1.118
  286    HD3  ARG  34           1HD      ARG  34  -0.891 -12.731  -0.533
  287    HE   ARG  34           HE       ARG  34  -3.012 -13.916  -0.392
  288   HH11  ARG  34          1HH1      ARG  34  -2.425 -11.437   2.029
  289   HH12  ARG  34          2HH1      ARG  34  -4.103 -11.144   2.326
  290   HH21  ARG  34          1HH2      ARG  34  -5.221 -13.562   0.013
  291   HH22  ARG  34          2HH2      ARG  34  -5.714 -12.379   1.182
  292    H    THR  35           HN       THR  35   2.108 -17.684  -0.139
  293    HA   THR  35           HA       THR  35   3.348 -17.284   2.406
  294    HB   THR  35           HB       THR  35   3.850 -19.289   1.039
  295    HG1  THR  35           1HG      THR  35   5.741 -19.340   1.954
  296   HG21  THR  35          3HG2      THR  35   5.386 -19.107  -0.870
  297   HG22  THR  35          1HG2      THR  35   5.300 -17.349  -0.765
  298   HG23  THR  35          2HG2      THR  35   3.860 -18.279  -1.181
  299    H    LYS  36           HN       LYS  36   5.615 -16.336   2.447
  300    HA   LYS  36           HA       LYS  36   5.468 -13.600   2.258
  301    HB2  LYS  36           2HB      LYS  36   7.063 -14.661   3.690
  302    HB3  LYS  36           1HB      LYS  36   7.871 -15.419   2.331
  303    HG2  LYS  36           2HG      LYS  36   8.684 -13.292   1.568
  304    HG3  LYS  36           1HG      LYS  36   7.778 -12.454   2.830
  305    HD2  LYS  36           2HD      LYS  36   9.113 -13.481   4.541
  306    HD3  LYS  36           1HD      LYS  36   9.921 -14.507   3.355
  307    HE2  LYS  36           2HE      LYS  36  10.047 -11.499   3.343
  308    HE3  LYS  36           1HE      LYS  36  11.249 -12.528   4.115
  309    HZ1  LYS  36           3HZ      LYS  36  11.850 -11.800   1.843
  310    HZ2  LYS  36           1HZ      LYS  36  10.549 -12.688   1.224
  311    HZ3  LYS  36           2HZ      LYS  36  11.814 -13.476   2.018
  312    H    GLU  37           HN       GLU  37   7.284 -15.713   0.018
  313    HA   GLU  37           HA       GLU  37   7.971 -13.525  -1.670
  314    HB2  GLU  37           2HB      GLU  37   8.165 -16.492  -2.161
  315    HB3  GLU  37           1HB      GLU  37   8.876 -15.249  -3.181
  316    HG2  GLU  37           2HG      GLU  37   9.567 -15.790  -0.300
  317    HG3  GLU  37           1HG      GLU  37  10.538 -16.223  -1.703
  318    H    GLU  38           HN       GLU  38   5.282 -15.710  -1.554
  319    HA   GLU  38           HA       GLU  38   4.445 -15.326  -4.253
  320    HB2  GLU  38           2HB      GLU  38   3.655 -17.247  -2.972
  321    HB3  GLU  38           1HB      GLU  38   2.841 -16.179  -1.835
  322    HG2  GLU  38           2HG      GLU  38   1.356 -15.414  -3.603
  323    HG3  GLU  38           1HG      GLU  38   2.186 -16.451  -4.760
  324    H    ALA  39           HN       ALA  39   3.587 -13.851  -1.158
  325    HA   ALA  39           HA       ALA  39   1.664 -12.053  -2.127
  326    HB1  ALA  39           1HB      ALA  39   2.096 -10.771  -0.081
  327    HB2  ALA  39           2HB      ALA  39   3.567 -11.703   0.197
  328    HB3  ALA  39           3HB      ALA  39   1.995 -12.498   0.264
  329    H    LEU  40           HN       LEU  40   5.152 -11.923  -1.934
  330    HA   LEU  40           HA       LEU  40   5.519  -9.255  -2.715
  331    HB2  LEU  40           2HB      LEU  40   7.289 -10.584  -1.719
  332    HB3  LEU  40           1HB      LEU  40   7.282 -11.672  -3.088
  333    HG   LEU  40           HG       LEU  40   8.072  -9.823  -4.531
  334   HD11  LEU  40          1HD1      LEU  40   8.277  -8.308  -1.938
  335   HD12  LEU  40          2HD1      LEU  40   7.183  -7.946  -3.273
  336   HD13  LEU  40          3HD1      LEU  40   8.926  -7.784  -3.491
  337   HD21  LEU  40          3HD2      LEU  40   9.785 -10.351  -2.109
  338   HD22  LEU  40          1HD2      LEU  40  10.349  -9.790  -3.683
  339   HD23  LEU  40          2HD2      LEU  40   9.645 -11.399  -3.521
  340    H    GLU  41           HN       GLU  41   5.618 -12.262  -4.636
  341    HA   GLU  41           HA       GLU  41   5.955 -11.034  -7.131
  342    HB2  GLU  41           2HB      GLU  41   4.844 -13.704  -6.322
  343    HB3  GLU  41           1HB      GLU  41   4.931 -13.215  -8.008
  344    HG2  GLU  41           2HG      GLU  41   7.263 -13.389  -6.117
  345    HG3  GLU  41           1HG      GLU  41   6.840 -14.581  -7.348
  346    H    LEU  42           HN       LEU  42   3.044 -11.862  -5.344
  347    HA   LEU  42           HA       LEU  42   1.145 -11.324  -7.311
  348    HB2  LEU  42           2HB      LEU  42   0.690 -12.390  -5.121
  349    HB3  LEU  42           1HB      LEU  42   0.949 -10.846  -4.335
  350    HG   LEU  42           HG       LEU  42  -0.988  -9.945  -5.634
  351   HD11  LEU  42          1HD1      LEU  42  -1.395 -12.849  -6.326
  352   HD12  LEU  42          2HD1      LEU  42  -0.999 -11.553  -7.454
  353   HD13  LEU  42          3HD1      LEU  42  -2.552 -11.551  -6.619
  354   HD21  LEU  42          3HD2      LEU  42  -2.679 -11.012  -4.218
  355   HD22  LEU  42          1HD2      LEU  42  -1.217 -10.634  -3.308
  356   HD23  LEU  42          2HD2      LEU  42  -1.533 -12.292  -3.819
  357    H    ILE  43           HN       ILE  43   2.632  -9.209  -4.895
  358    HA   ILE  43           HA       ILE  43   1.271  -6.860  -5.714
  359    HB   ILE  43           HB       ILE  43   3.845  -7.182  -4.151
  360   HG12  ILE  43          2HG1      ILE  43   1.952  -8.175  -3.002
  361   HG13  ILE  43          1HG1      ILE  43   2.413  -6.686  -2.189
  362   HG21  ILE  43          1HG2      ILE  43   2.133  -4.728  -4.513
  363   HG22  ILE  43          2HG2      ILE  43   3.761  -4.971  -5.147
  364   HG23  ILE  43          3HG2      ILE  43   3.499  -4.870  -3.405
  365   HD11  ILE  43          3HD1      ILE  43   0.008  -6.887  -2.315
  366   HD12  ILE  43          1HD1      ILE  43   0.087  -7.043  -4.070
  367   HD13  ILE  43          2HD1      ILE  43   0.555  -5.530  -3.297
  368    H    ASN  44           HN       ASN  44   4.464  -8.209  -6.458
  369    HA   ASN  44           HA       ASN  44   5.492  -6.117  -7.990
  370    HB2  ASN  44           2HB      ASN  44   5.932  -9.096  -8.202
  371    HB3  ASN  44           1HB      ASN  44   6.813  -7.935  -9.185
  372   HD21  ASN  44          1HD2      ASN  44   7.799  -9.824  -7.213
  373   HD22  ASN  44          2HD2      ASN  44   8.634  -8.881  -6.030
  374    H    GLY  45           HN       GLY  45   3.679  -8.973  -9.100
  375    HA2  GLY  45           2HA      GLY  45   3.588  -8.298 -11.816
  376    HA3  GLY  45           1HA      GLY  45   2.421  -9.320 -10.987
  377    H    TYR  46           HN       TYR  46   1.354  -7.502  -9.191
  378    HA   TYR  46           HA       TYR  46  -0.534  -6.174 -10.811
  379    HB2  TYR  46           2HB      TYR  46   0.073  -6.038  -7.863
  380    HB3  TYR  46           1HB      TYR  46  -1.202  -5.075  -8.599
  381    HD1  TYR  46           1HD      TYR  46  -1.098  -8.024 -10.444
  382    HD2  TYR  46           2HD      TYR  46  -2.304  -6.578  -6.625
  383    HE1  TYR  46           1HE      TYR  46  -2.659  -9.903 -10.231
  384    HE2  TYR  46           2HE      TYR  46  -3.868  -8.462  -6.407
  385    HH   TYR  46           HH       TYR  46  -3.778 -11.174  -8.385
  386    H    ILE  47           HN       ILE  47   2.247  -4.983  -8.962
  387    HA   ILE  47           HA       ILE  47   1.961  -2.257  -9.454
  388    HB   ILE  47           HB       ILE  47   4.408  -3.968  -9.030
  389   HG12  ILE  47          2HG1      ILE  47   3.041  -1.878  -7.318
  390   HG13  ILE  47          1HG1      ILE  47   2.926  -3.622  -7.111
  391   HG21  ILE  47          1HG2      ILE  47   5.182  -2.160 -10.411
  392   HG22  ILE  47          2HG2      ILE  47   5.727  -1.892  -8.755
  393   HG23  ILE  47          3HG2      ILE  47   4.362  -0.978  -9.395
  394   HD11  ILE  47          3HD1      ILE  47   4.459  -2.631  -5.504
  395   HD12  ILE  47          1HD1      ILE  47   5.430  -1.975  -6.821
  396   HD13  ILE  47          2HD1      ILE  47   5.310  -3.720  -6.601
  397    H    GLN  48           HN       GLN  48   3.500  -4.759 -11.417
  398    HA   GLN  48           HA       GLN  48   4.517  -3.094 -13.432
  399    HB2  GLN  48           2HB      GLN  48   3.557  -5.955 -13.659
  400    HB3  GLN  48           1HB      GLN  48   4.552  -5.120 -14.843
  401    HG2  GLN  48           2HG      GLN  48   5.321  -5.767 -12.007
  402    HG3  GLN  48           1HG      GLN  48   5.902  -6.573 -13.462
  403   HE21  GLN  48          1HE2      GLN  48   7.434  -5.570 -14.737
  404   HE22  GLN  48          2HE2      GLN  48   8.295  -4.162 -14.225
  405    H    LYS  49           HN       LYS  49   1.358  -4.618 -13.047
  406    HA   LYS  49           HA       LYS  49   0.368  -3.769 -15.572
  407    HB2  LYS  49           2HB      LYS  49  -1.140  -4.613 -13.097
  408    HB3  LYS  49           1HB      LYS  49  -1.834  -4.427 -14.702
  409    HG2  LYS  49           2HG      LYS  49  -0.336  -6.204 -15.522
  410    HG3  LYS  49           1HG      LYS  49   0.268  -6.418 -13.878
  411    HD2  LYS  49           2HD      LYS  49  -2.017  -6.962 -13.136
  412    HD3  LYS  49           1HD      LYS  49  -2.581  -6.800 -14.801
  413    HE2  LYS  49           2HE      LYS  49  -1.003  -8.592 -15.458
  414    HE3  LYS  49           1HE      LYS  49  -0.570  -8.791 -13.761
  415    HZ1  LYS  49           3HZ      LYS  49  -2.199 -10.418 -14.403
  416    HZ2  LYS  49           1HZ      LYS  49  -3.257  -9.217 -14.947
  417    HZ3  LYS  49           2HZ      LYS  49  -2.898  -9.345 -13.301
  418    H    ILE  50           HN       ILE  50   0.082  -2.502 -12.277
  419    HA   ILE  50           HA       ILE  50  -1.716  -0.427 -12.806
  420    HB   ILE  50           HB       ILE  50   0.490  -0.495 -10.736
  421   HG12  ILE  50          2HG1      ILE  50  -2.448  -1.180 -10.496
  422   HG13  ILE  50          1HG1      ILE  50  -1.141  -2.357 -10.593
  423   HG21  ILE  50          1HG2      ILE  50  -1.965   1.259 -10.886
  424   HG22  ILE  50          2HG2      ILE  50  -0.298   1.786 -11.114
  425   HG23  ILE  50          3HG2      ILE  50  -0.828   1.196  -9.540
  426   HD11  ILE  50          3HD1      ILE  50  -1.874  -2.065  -8.306
  427   HD12  ILE  50          1HD1      ILE  50  -1.558  -0.335  -8.411
  428   HD13  ILE  50          2HD1      ILE  50  -0.221  -1.480  -8.498
  429    H    LYS  51           HN       LYS  51   1.857  -0.361 -12.834
  430    HA   LYS  51           HA       LYS  51   2.069   2.380 -13.461
  431    HB2  LYS  51           2HB      LYS  51   4.008   0.127 -13.978
  432    HB3  LYS  51           1HB      LYS  51   4.389   1.823 -14.222
  433    HG2  LYS  51           2HG      LYS  51   3.818   2.174 -11.789
  434    HG3  LYS  51           1HG      LYS  51   3.783   0.417 -11.640
  435    HD2  LYS  51           2HD      LYS  51   6.138   2.047 -12.600
  436    HD3  LYS  51           1HD      LYS  51   5.957   1.374 -10.982
  437    HE2  LYS  51           2HE      LYS  51   5.954  -0.880 -11.902
  438    HE3  LYS  51           1HE      LYS  51   6.060  -0.228 -13.537
  439    HZ1  LYS  51           3HZ      LYS  51   8.216  -0.971 -12.672
  440    HZ2  LYS  51           1HZ      LYS  51   8.104   0.160 -11.420
  441    HZ3  LYS  51           2HZ      LYS  51   8.216   0.683 -13.020
  442    H    SER  52           HN       SER  52   1.406  -0.367 -15.454
  443    HA   SER  52           HA       SER  52   1.978   1.092 -17.904
  444    HB2  SER  52           2HB      SER  52   0.841  -1.690 -17.579
  445    HB3  SER  52           1HB      SER  52   1.555  -0.991 -19.033
  446    HG   SER  52           HG       SER  52   2.763  -2.106 -16.830
  447    H    GLY  53           HN       GLY  53  -0.547   0.959 -15.774
  448    HA2  GLY  53           2HA      GLY  53  -2.679   1.836 -15.939
  449    HA3  GLY  53           1HA      GLY  53  -2.389   2.127 -17.648
  450    H    GLU  54           HN       GLU  54  -1.907  -0.986 -16.223
  451    HA   GLU  54           HA       GLU  54  -4.139  -2.047 -17.815
  452    HB2  GLU  54           2HB      GLU  54  -1.556  -3.252 -16.858
  453    HB3  GLU  54           1HB      GLU  54  -2.877  -4.240 -17.459
  454    HG2  GLU  54           2HG      GLU  54  -1.554  -2.044 -19.020
  455    HG3  GLU  54           1HG      GLU  54  -1.123  -3.750 -19.131
  456    H    GLU  55           HN       GLU  55  -3.788  -1.031 -14.813
  457    HA   GLU  55           HA       GLU  55  -5.690  -2.912 -13.770
  458    HB2  GLU  55           2HB      GLU  55  -3.450  -4.009 -13.423
  459    HB3  GLU  55           1HB      GLU  55  -3.036  -2.680 -12.353
  460    HG2  GLU  55           2HG      GLU  55  -3.762  -4.629 -11.114
  461    HG3  GLU  55           1HG      GLU  55  -4.871  -3.276 -10.886
  462    H    ASP  56           HN       ASP  56  -6.647  -2.221 -11.809
  463    HA   ASP  56           HA       ASP  56  -6.319   0.659 -11.324
  464    HB2  ASP  56           2HB      ASP  56  -8.587  -1.206 -10.583
  465    HB3  ASP  56           1HB      ASP  56  -8.524   0.501 -10.170
  466    H    PHE  57           HN       PHE  57  -5.057   1.161  -9.674
  467    HA   PHE  57           HA       PHE  57  -4.180  -0.558  -7.649
  468    HB2  PHE  57           2HB      PHE  57  -3.020   1.530  -8.199
  469    HB3  PHE  57           1HB      PHE  57  -4.399   2.466  -7.639
  470    HD1  PHE  57           1HD      PHE  57  -1.566   0.377  -6.606
  471    HD2  PHE  57           2HD      PHE  57  -4.765   2.855  -5.297
  472    HE1  PHE  57           1HE      PHE  57  -0.582   0.456  -4.367
  473    HE2  PHE  57           2HE      PHE  57  -3.782   2.935  -3.045
  474    HZ   PHE  57           HZ       PHE  57  -1.686   1.737  -2.577
  475    H    GLU  58           HN       GLU  58  -6.813   1.772  -7.706
  476    HA   GLU  58           HA       GLU  58  -7.667   1.614  -5.060
  477    HB2  GLU  58           2HB      GLU  58  -9.543   1.920  -7.391
  478    HB3  GLU  58           1HB      GLU  58  -9.718   2.582  -5.780
  479    HG2  GLU  58           2HG      GLU  58  -9.130   4.430  -7.027
  480    HG3  GLU  58           1HG      GLU  58  -7.577   3.918  -6.368
  481    H    SER  59           HN       SER  59  -8.762  -0.227  -7.887
  482    HA   SER  59           HA       SER  59 -10.700  -1.749  -6.563
  483    HB2  SER  59           2HB      SER  59 -10.372  -1.444  -9.087
  484    HB3  SER  59           1HB      SER  59  -9.151  -2.709  -8.969
  485    HG   SER  59           HG       SER  59 -10.685  -4.138  -8.869
  486    H    LEU  60           HN       LEU  60  -7.255  -2.275  -7.075
  487    HA   LEU  60           HA       LEU  60  -7.134  -4.914  -6.110
  488    HB2  LEU  60           2HB      LEU  60  -5.203  -2.708  -6.528
  489    HB3  LEU  60           1HB      LEU  60  -4.711  -3.987  -5.440
  490    HG   LEU  60           HG       LEU  60  -4.757  -5.615  -7.154
  491   HD11  LEU  60          1HD1      LEU  60  -6.135  -3.571  -8.885
  492   HD12  LEU  60          2HD1      LEU  60  -6.859  -5.034  -8.214
  493   HD13  LEU  60          3HD1      LEU  60  -5.575  -5.153  -9.420
  494   HD21  LEU  60          3HD2      LEU  60  -3.263  -4.690  -8.833
  495   HD22  LEU  60          1HD2      LEU  60  -2.837  -4.116  -7.220
  496   HD23  LEU  60          2HD2      LEU  60  -3.702  -3.057  -8.336
  497    H    ALA  61           HN       ALA  61  -6.871  -1.795  -4.492
  498    HA   ALA  61           HA       ALA  61  -6.342  -2.834  -1.920
  499    HB1  ALA  61           1HB      ALA  61  -6.965  -0.616  -1.103
  500    HB2  ALA  61           2HB      ALA  61  -7.646  -0.218  -2.680
  501    HB3  ALA  61           3HB      ALA  61  -5.913  -0.493  -2.513
  502    H    SER  62           HN       SER  62  -9.313  -1.916  -3.585
  503    HA   SER  62           HA       SER  62 -11.022  -2.522  -1.385
  504    HB2  SER  62           2HB      SER  62 -11.675  -2.105  -4.305
  505    HB3  SER  62           1HB      SER  62 -12.830  -2.086  -2.973
  506    HG   SER  62           HG       SER  62 -11.725  -0.300  -2.117
  507    H    GLN  63           HN       GLN  63  -9.266  -4.686  -2.985
  508    HA   GLN  63           HA       GLN  63 -11.384  -6.717  -2.823
  509    HB2  GLN  63           2HB      GLN  63  -9.429  -6.388  -5.091
  510    HB3  GLN  63           1HB      GLN  63 -10.358  -7.855  -4.827
  511    HG2  GLN  63           2HG      GLN  63 -12.426  -6.651  -5.155
  512    HG3  GLN  63           1HG      GLN  63 -11.549  -5.129  -5.296
  513   HE21  GLN  63          1HE2      GLN  63  -9.394  -6.326  -6.854
  514   HE22  GLN  63          2HE2      GLN  63 -10.029  -6.598  -8.437
  515    H    PHE  64           HN       PHE  64  -7.866  -6.225  -3.021
  516    HA   PHE  64           HA       PHE  64  -7.512  -8.855  -1.789
  517    HB2  PHE  64           2HB      PHE  64  -5.468  -7.035  -3.072
  518    HB3  PHE  64           1HB      PHE  64  -5.158  -8.656  -2.457
  519    HD1  PHE  64           1HD      PHE  64  -6.209 -10.614  -3.572
  520    HD2  PHE  64           2HD      PHE  64  -6.442  -6.688  -5.201
  521    HE1  PHE  64           1HE      PHE  64  -6.848 -11.559  -5.751
  522    HE2  PHE  64           2HE      PHE  64  -7.082  -7.626  -7.382
  523    HZ   PHE  64           HZ       PHE  64  -7.287 -10.064  -7.660
  524    H    SER  65           HN       SER  65  -7.184  -5.481  -1.079
  525    HA   SER  65           HA       SER  65  -5.477  -5.931   1.191
  526    HB2  SER  65           2HB      SER  65  -5.497  -3.792  -0.162
  527    HB3  SER  65           1HB      SER  65  -7.061  -3.432   0.561
  528    HG   SER  65           HG       SER  65  -4.908  -4.098   2.224
  529    H    ASP  66           HN       ASP  66  -6.084  -6.169   3.273
  530    HA   ASP  66           HA       ASP  66  -8.952  -6.544   3.745
  531    HB2  ASP  66           2HB      ASP  66  -8.289  -7.869   5.678
  532    HB3  ASP  66           1HB      ASP  66  -7.448  -8.430   4.236
  533    H    ALA  67           HN       ALA  67  -6.817  -4.155   4.055
  534    HA   ALA  67           HA       ALA  67  -7.509  -3.310   6.736
  535    HB1  ALA  67           1HB      ALA  67  -5.239  -2.958   5.868
  536    HB2  ALA  67           2HB      ALA  67  -6.020  -1.446   6.327
  537    HB3  ALA  67           3HB      ALA  67  -5.892  -1.890   4.625
  538    H    SER  68           HN       SER  68  -8.031  -0.824   6.841
  539    HA   SER  68           HA       SER  68 -10.616  -0.467   5.788
  540    HB2  SER  68           2HB      SER  68  -8.765   1.673   6.850
  541    HB3  SER  68           1HB      SER  68 -10.530   1.706   6.819
  542    HG   SER  68           HG       SER  68 -10.571   0.052   8.319
  543    H    SER  69           HN       SER  69  -7.591  -0.112   4.399
  544    HA   SER  69           HA       SER  69  -7.832   2.012   2.627
  545    HB2  SER  69           2HB      SER  69  -6.484  -0.610   1.999
  546    HB3  SER  69           1HB      SER  69  -6.028   1.005   1.454
  547    HG   SER  69           HG       SER  69  -6.022   1.123   4.062
  548    H    ALA  70           HN       ALA  70  -9.097  -1.257   2.540
  549    HA   ALA  70           HA       ALA  70  -9.835  -1.441  -0.138
  550    HB1  ALA  70           1HB      ALA  70 -11.405  -3.168   0.602
  551    HB2  ALA  70           2HB      ALA  70 -11.205  -2.637   2.273
  552    HB3  ALA  70           3HB      ALA  70  -9.842  -3.342   1.401
  553    H    LYS  71           HN       LYS  71 -11.572  -0.111   2.629
  554    HA   LYS  71           HA       LYS  71 -13.981   0.364   1.180
  555    HB2  LYS  71           2HB      LYS  71 -13.084   1.580   3.793
  556    HB3  LYS  71           1HB      LYS  71 -14.724   1.547   3.170
  557    HG2  LYS  71           2HG      LYS  71 -13.086  -0.837   4.021
  558    HG3  LYS  71           1HG      LYS  71 -14.442  -0.127   4.896
  559    HD2  LYS  71           2HD      LYS  71 -14.591  -1.398   2.157
  560    HD3  LYS  71           1HD      LYS  71 -15.091  -2.158   3.666
  561    HE2  LYS  71           2HE      LYS  71 -16.766  -0.398   3.990
  562    HE3  LYS  71           1HE      LYS  71 -16.266   0.356   2.479
  563    HZ1  LYS  71           3HZ      LYS  71 -18.239  -0.996   2.186
  564    HZ2  LYS  71           1HZ      LYS  71 -17.419  -2.363   2.748
  565    HZ3  LYS  71           2HZ      LYS  71 -16.949  -1.632   1.300
  566    H    ALA  72           HN       ALA  72 -11.096   2.208   1.804
  567    HA   ALA  72           HA       ALA  72 -12.341   4.639   0.755
  568    HB1  ALA  72           1HB      ALA  72 -10.370   5.803   1.560
  569    HB2  ALA  72           2HB      ALA  72  -9.620   4.267   1.993
  570    HB3  ALA  72           3HB      ALA  72 -11.067   4.811   2.841
  571    H    ARG  73           HN       ARG  73 -11.003   2.051  -0.627
  572    HA   ARG  73           HA       ARG  73 -10.059   1.603  -2.645
  573    HB2  ARG  73           2HB      ARG  73 -11.014   4.402  -3.049
  574    HB3  ARG  73           1HB      ARG  73  -9.959   3.703  -4.263
  575    HG2  ARG  73           2HG      ARG  73 -12.255   3.405  -4.914
  576    HG3  ARG  73           1HG      ARG  73 -11.556   1.834  -4.520
  577    HD2  ARG  73           2HD      ARG  73 -12.576   2.012  -2.266
  578    HD3  ARG  73           1HD      ARG  73 -13.357   3.507  -2.778
  579    HE   ARG  73           HE       ARG  73 -13.868   1.222  -4.466
  580   HH11  ARG  73          1HH1      ARG  73 -14.921   3.051  -1.674
  581   HH12  ARG  73          2HH1      ARG  73 -16.560   2.513  -1.769
  582   HH21  ARG  73          1HH2      ARG  73 -16.018   0.490  -4.598
  583   HH22  ARG  73          2HH2      ARG  73 -17.197   1.042  -3.459
  584    H    GLY  74           HN       GLY  74  -8.478   2.677  -0.369
  585    HA2  GLY  74           2HA      GLY  74  -6.137   2.581  -0.178
  586    HA3  GLY  74           1HA      GLY  74  -6.003   3.010  -1.876
  587    H    ASP  75           HN       ASP  75  -7.910   5.257  -1.508
  588    HA   ASP  75           HA       ASP  75  -5.989   7.279  -1.120
  589    HB2  ASP  75           2HB      ASP  75  -7.873   7.674  -2.562
  590    HB3  ASP  75           1HB      ASP  75  -9.002   7.433  -1.237
  591    H    LEU  76           HN       LEU  76  -5.378   8.438   0.546
  592    HA   LEU  76           HA       LEU  76  -6.687   7.998   3.153
  593    HB2  LEU  76           2HB      LEU  76  -3.831   8.501   2.387
  594    HB3  LEU  76           1HB      LEU  76  -4.403   8.780   4.016
  595    HG   LEU  76           HG       LEU  76  -4.627   6.116   2.639
  596   HD11  LEU  76          1HD1      LEU  76  -2.477   7.153   4.483
  597   HD12  LEU  76          2HD1      LEU  76  -2.280   6.755   2.776
  598   HD13  LEU  76          3HD1      LEU  76  -2.647   5.484   3.942
  599   HD21  LEU  76          3HD2      LEU  76  -4.910   5.307   4.922
  600   HD22  LEU  76          1HD2      LEU  76  -6.142   6.502   4.526
  601   HD23  LEU  76          2HD2      LEU  76  -4.768   6.953   5.534
  602    H    GLY  77           HN       GLY  77  -6.233  10.242   0.731
  603    HA2  GLY  77           2HA      GLY  77  -6.673  12.503   0.680
  604    HA3  GLY  77           1HA      GLY  77  -7.040  12.429   2.403
  605    H    ALA  78           HN       ALA  78  -5.792  14.563   2.127
  606    HA   ALA  78           HA       ALA  78  -2.931  14.265   1.931
  607    HB1  ALA  78           1HB      ALA  78  -2.872  16.675   2.375
  608    HB2  ALA  78           2HB      ALA  78  -4.611  16.657   2.668
  609    HB3  ALA  78           3HB      ALA  78  -3.983  16.274   1.066
  610    H    PHE  79           HN       PHE  79  -1.817  13.450   3.555
  611    HA   PHE  79           HA       PHE  79  -2.641  14.148   6.289
  612    HB2  PHE  79           2HB      PHE  79  -1.565  12.025   7.022
  613    HB3  PHE  79           1HB      PHE  79  -2.936  11.767   5.954
  614    HD1  PHE  79           2HD      PHE  79   0.701  11.522   6.306
  615    HD2  PHE  79           1HD      PHE  79  -2.625  10.857   3.733
  616    HE1  PHE  79           2HE      PHE  79   2.108  10.122   4.853
  617    HE2  PHE  79           1HE      PHE  79  -1.223   9.455   2.280
  618    HZ   PHE  79           HZ       PHE  79   1.148   9.088   2.837
  619    H    SER  80           HN       SER  80  -0.894  14.317   7.853
  620    HA   SER  80           HA       SER  80   1.482  15.479   6.586
  621    HB2  SER  80           2HB      SER  80  -0.042  16.886   8.130
  622    HB3  SER  80           1HB      SER  80   0.636  15.933   9.448
  623    HG   SER  80           HG       SER  80   2.272  17.269   7.563
  624    H    ARG  81           HN       ARG  81   3.430  15.370   8.216
  625    HA   ARG  81           HA       ARG  81   4.043  12.602   8.479
  626    HB2  ARG  81           2HB      ARG  81   5.590  15.007   9.451
  627    HB3  ARG  81           1HB      ARG  81   6.203  13.363   9.368
  628    HG2  ARG  81           2HG      ARG  81   5.658  13.496   6.866
  629    HG3  ARG  81           1HG      ARG  81   5.548  15.237   7.128
  630    HD2  ARG  81           2HD      ARG  81   7.773  14.616   6.370
  631    HD3  ARG  81           1HD      ARG  81   7.829  15.239   8.020
  632    HE   ARG  81           HE       ARG  81   7.658  12.641   8.502
  633   HH11  ARG  81          1HH1      ARG  81   9.658  14.313   6.139
  634   HH12  ARG  81          2HH1      ARG  81  10.914  13.126   6.207
  635   HH21  ARG  81          1HH2      ARG  81   9.284  11.078   8.552
  636   HH22  ARG  81          2HH2      ARG  81  10.710  11.270   7.579
  637    H    GLY  82           HN       GLY  82   4.620  11.478  10.377
  638    HA2  GLY  82           2HA      GLY  82   4.550  11.018  12.659
  639    HA3  GLY  82           1HA      GLY  82   3.866  12.612  12.945
  640    H    GLN  83           HN       GLN  83   2.147  11.322  10.484
  641    HA   GLN  83           HA       GLN  83   0.136  10.164  12.309
  642    HB2  GLN  83           2HB      GLN  83  -0.392  11.633   9.716
  643    HB3  GLN  83           1HB      GLN  83  -1.594  11.051  10.856
  644    HG2  GLN  83           2HG      GLN  83   0.414  13.239  11.350
  645    HG3  GLN  83           1HG      GLN  83  -1.303  13.452  11.029
  646   HE21  GLN  83          1HE2      GLN  83  -2.047  11.141  12.679
  647   HE22  GLN  83          2HE2      GLN  83  -1.869  11.662  14.316
  648    H    MET  84           HN       MET  84   2.373   9.092  10.498
  649    HA   MET  84           HA       MET  84   0.790   6.982   9.255
  650    HB2  MET  84           2HB      MET  84   1.133   8.676   7.504
  651    HB3  MET  84           1HB      MET  84   2.862   8.641   7.798
  652    HG2  MET  84           2HG      MET  84   2.212   7.406   5.791
  653    HG3  MET  84           1HG      MET  84   3.002   6.383   6.990
  654    HE1  MET  84           3HE      MET  84  -1.555   6.424   6.279
  655    HE2  MET  84           1HE      MET  84  -0.421   7.491   5.453
  656    HE3  MET  84           2HE      MET  84  -0.717   7.682   7.182
  657    H    GLN  85           HN       GLN  85   2.098   5.088   8.725
  658    HA   GLN  85           HA       GLN  85   3.939   4.290  10.659
  659    HB2  GLN  85           2HB      GLN  85   3.738   3.325   7.798
  660    HB3  GLN  85           1HB      GLN  85   4.538   2.475   9.109
  661    HG2  GLN  85           2HG      GLN  85   2.417   2.175  10.237
  662    HG3  GLN  85           1HG      GLN  85   1.599   3.090   8.968
  663   HE21  GLN  85          1HE2      GLN  85   3.236   0.132   9.755
  664   HE22  GLN  85          2HE2      GLN  85   2.686  -0.777   8.395
  665    H    LYS  86           HN       LYS  86   6.166   4.407  10.805
  666    HA   LYS  86           HA       LYS  86   7.434   6.538   9.520
  667    HB2  LYS  86           2HB      LYS  86   8.136   5.600  11.713
  668    HB3  LYS  86           1HB      LYS  86   8.807   4.212  10.871
  669    HG2  LYS  86           2HG      LYS  86  10.532   5.843  11.475
  670    HG3  LYS  86           1HG      LYS  86  10.407   5.632   9.727
  671    HD2  LYS  86           2HD      LYS  86  10.662   7.998  10.334
  672    HD3  LYS  86           1HD      LYS  86   9.107   7.702   9.559
  673    HE2  LYS  86           2HE      LYS  86   8.022   7.665  11.756
  674    HE3  LYS  86           1HE      LYS  86   9.581   7.937  12.532
  675    HZ1  LYS  86           3HZ      LYS  86   8.277   9.972  12.328
  676    HZ2  LYS  86           1HZ      LYS  86   8.259   9.823  10.640
  677    HZ3  LYS  86           2HZ      LYS  86   9.719  10.081  11.458
  678    HA   PRO  87           HA       PRO  87   9.713   3.216   6.666
  679    HB2  PRO  87           2HB      PRO  87   8.084   1.042   6.121
  680    HB3  PRO  87           1HB      PRO  87   9.429   1.024   7.264
  681    HG2  PRO  87           2HG      PRO  87   6.506   1.375   7.782
  682    HG3  PRO  87           1HG      PRO  87   7.702   0.434   8.695
  683    HD2  PRO  87           2HD      PRO  87   6.871   2.814   9.566
  684    HD3  PRO  87           1HD      PRO  87   8.568   2.319   9.741
  685    H    PHE  88           HN       PHE  88   6.285   3.803   6.785
  686    HA   PHE  88           HA       PHE  88   5.950   3.792   3.905
  687    HB2  PHE  88           2HB      PHE  88   4.165   3.033   5.518
  688    HB3  PHE  88           1HB      PHE  88   4.023   4.698   6.061
  689    HD1  PHE  88           1HD      PHE  88   3.393   6.453   4.263
  690    HD2  PHE  88           2HD      PHE  88   2.880   2.259   3.765
  691    HE1  PHE  88           1HE      PHE  88   1.725   6.871   2.511
  692    HE2  PHE  88           2HE      PHE  88   1.213   2.672   2.007
  693    HZ   PHE  88           HZ       PHE  88   0.635   4.984   1.377
  694    H    GLU  89           HN       GLU  89   5.874   6.098   6.567
  695    HA   GLU  89           HA       GLU  89   5.356   8.463   5.217
  696    HB2  GLU  89           2HB      GLU  89   5.313   8.205   7.646
  697    HB3  GLU  89           1HB      GLU  89   7.052   7.976   7.667
  698    HG2  GLU  89           2HG      GLU  89   7.332  10.269   6.827
  699    HG3  GLU  89           1HG      GLU  89   5.583  10.484   6.908
  700    H    ASP  90           HN       ASP  90   8.480   6.993   6.013
  701    HA   ASP  90           HA       ASP  90  10.162   8.981   5.037
  702    HB2  ASP  90           2HB      ASP  90  10.962   7.117   6.397
  703    HB3  ASP  90           1HB      ASP  90  10.614   5.992   5.089
  704    H    ALA  91           HN       ALA  91   8.663   6.282   3.343
  705    HA   ALA  91           HA       ALA  91  10.046   6.868   0.887
  706    HB1  ALA  91           1HB      ALA  91   8.808   4.992  -0.035
  707    HB2  ALA  91           2HB      ALA  91   7.812   4.921   1.418
  708    HB3  ALA  91           3HB      ALA  91   9.535   4.561   1.514
  709    H    SER  92           HN       SER  92   6.728   7.222   2.106
  710    HA   SER  92           HA       SER  92   5.542   7.999  -0.309
  711    HB2  SER  92           2HB      SER  92   3.775   9.049   1.186
  712    HB3  SER  92           1HB      SER  92   4.100   7.338   1.454
  713    HG   SER  92           HG       SER  92   5.211   7.823   3.276
  714    H    PHE  93           HN       PHE  93   6.917  10.033   2.267
  715    HA   PHE  93           HA       PHE  93   6.311  12.449   0.876
  716    HB2  PHE  93           2HB      PHE  93   8.032  11.843   3.270
  717    HB3  PHE  93           1HB      PHE  93   7.924  13.463   2.590
  718    HD1  PHE  93           1HD      PHE  93   6.013  10.772   4.237
  719    HD2  PHE  93           2HD      PHE  93   6.019  14.826   2.948
  720    HE1  PHE  93           1HE      PHE  93   3.958  11.182   5.528
  721    HE2  PHE  93           2HE      PHE  93   3.964  15.242   4.240
  722    HZ   PHE  93           HZ       PHE  93   2.933  13.418   5.531
  723    H    ALA  94           HN       ALA  94   8.654  10.122   0.371
  724    HA   ALA  94           HA       ALA  94  10.611  11.973  -0.735
  725    HB1  ALA  94           1HB      ALA  94  11.969   9.990  -1.157
  726    HB2  ALA  94           2HB      ALA  94  10.632   8.955  -0.658
  727    HB3  ALA  94           3HB      ALA  94  11.409  10.017   0.515
  728    H    LEU  95           HN       LEU  95   7.915  10.128  -1.710
  729    HA   LEU  95           HA       LEU  95   8.669   9.878  -4.488
  730    HB2  LEU  95           2HB      LEU  95   5.993   9.472  -3.152
  731    HB3  LEU  95           1HB      LEU  95   6.390   9.029  -4.798
  732    HG   LEU  95           HG       LEU  95   7.579   7.803  -2.313
  733   HD11  LEU  95          1HD1      LEU  95   5.632   6.675  -4.313
  734   HD12  LEU  95          2HD1      LEU  95   5.220   7.244  -2.698
  735   HD13  LEU  95          3HD1      LEU  95   6.280   5.853  -2.895
  736   HD21  LEU  95          3HD2      LEU  95   8.554   6.170  -3.867
  737   HD22  LEU  95          1HD2      LEU  95   9.170   7.798  -4.150
  738   HD23  LEU  95          2HD2      LEU  95   7.951   7.118  -5.227
  739    H    ARG  96           HN       ARG  96   7.565  10.912  -6.204
  740    HA   ARG  96           HA       ARG  96   6.732  13.639  -5.578
  741    HB2  ARG  96           2HB      ARG  96   6.885  13.994  -8.016
  742    HB3  ARG  96           1HB      ARG  96   8.377  13.344  -7.352
  743    HG2  ARG  96           2HG      ARG  96   7.700  11.098  -8.121
  744    HG3  ARG  96           1HG      ARG  96   6.266  11.819  -8.854
  745    HD2  ARG  96           2HD      ARG  96   7.628  13.138 -10.327
  746    HD3  ARG  96           1HD      ARG  96   9.096  12.584  -9.524
  747    HE   ARG  96           HE       ARG  96   7.933  10.278 -10.351
  748   HH11  ARG  96          1HH1      ARG  96   8.781  13.259 -11.986
  749   HH12  ARG  96          2HH1      ARG  96   9.096  12.495 -13.503
  750   HH21  ARG  96          1HH2      ARG  96   8.345   9.252 -12.345
  751   HH22  ARG  96          2HH2      ARG  96   8.843  10.194 -13.709
  752    H    THR  97           HN       THR  97   4.854  14.498  -6.968
  753    HA   THR  97           HA       THR  97   2.528  12.998  -6.389
  754    HB   THR  97           HB       THR  97   2.854  15.399  -8.208
  755    HG1  THR  97           1HG      THR  97   2.004  15.291  -5.474
  756   HG21  THR  97          3HG2      THR  97   0.442  15.758  -7.698
  757   HG22  THR  97          1HG2      THR  97   0.416  14.182  -6.910
  758   HG23  THR  97          2HG2      THR  97   0.745  14.297  -8.637
  759    H    GLY  98           HN       GLY  98   1.664  11.367  -7.497
  760    HA2  GLY  98           2HA      GLY  98   0.921  10.200  -9.378
  761    HA3  GLY  98           1HA      GLY  98   1.873  11.272 -10.399
  762    H    GLU  99           HN       GLU  99   3.043   9.581  -7.571
  763    HA   GLU  99           HA       GLU  99   4.707   7.879  -9.297
  764    HB2  GLU  99           2HB      GLU  99   5.933   9.858  -8.349
  765    HB3  GLU  99           1HB      GLU  99   5.621   9.212  -6.748
  766    HG2  GLU  99           2HG      GLU  99   7.853   8.665  -7.461
  767    HG3  GLU  99           1HG      GLU  99   6.879   7.200  -7.330
  768    H    MET 100           HN       MET 100   5.215   5.842  -8.444
  769    HA   MET 100           HA       MET 100   3.864   5.111  -5.946
  770    HB2  MET 100           2HB      MET 100   2.515   4.441  -7.956
  771    HB3  MET 100           1HB      MET 100   3.856   3.419  -8.447
  772    HG2  MET 100           2HG      MET 100   3.616   2.083  -6.447
  773    HG3  MET 100           1HG      MET 100   2.339   3.146  -5.862
  774    HE1  MET 100           3HE      MET 100   1.975   0.334  -9.496
  775    HE2  MET 100           1HE      MET 100   3.406   0.495  -8.477
  776    HE3  MET 100           2HE      MET 100   2.935   1.812  -9.554
  777    H    SER 101           HN       SER 101   5.046   3.872  -4.623
  778    HA   SER 101           HA       SER 101   7.780   3.306  -5.384
  779    HB2  SER 101           2HB      SER 101   8.013   2.646  -2.995
  780    HB3  SER 101           1HB      SER 101   7.369   4.273  -3.191
  781    HG   SER 101           HG       SER 101   6.079   1.924  -2.348
  782    H    GLY 102           HN       GLY 102   8.464   1.091  -4.061
  783    HA2  GLY 102           2HA      GLY 102   7.045  -0.999  -5.506
  784    HA3  GLY 102           1HA      GLY 102   8.604  -1.157  -4.705
  785    HA   PRO 103           HA       PRO 103   5.441  -3.110  -1.957
  786    HB2  PRO 103           2HB      PRO 103   7.509  -5.165  -1.620
  787    HB3  PRO 103           1HB      PRO 103   5.837  -5.349  -2.151
  788    HG2  PRO 103           2HG      PRO 103   7.915  -5.676  -3.837
  789    HG3  PRO 103           1HG      PRO 103   6.361  -5.009  -4.371
  790    HD2  PRO 103           2HD      PRO 103   8.906  -3.581  -3.698
  791    HD3  PRO 103           1HD      PRO 103   7.780  -3.303  -5.046
  792    H    VAL 104           HN       VAL 104   5.596  -1.764  -0.221
  793    HA   VAL 104           HA       VAL 104   8.063  -1.504   1.257
  794    HB   VAL 104           HB       VAL 104   5.293  -0.423   1.845
  795   HG11  VAL 104          1HG1      VAL 104   7.939   0.250   3.129
  796   HG12  VAL 104          2HG1      VAL 104   6.610  -0.623   3.887
  797   HG13  VAL 104          3HG1      VAL 104   6.412   1.071   3.439
  798   HG21  VAL 104          3HG2      VAL 104   6.205   1.718   1.068
  799   HG22  VAL 104          1HG2      VAL 104   6.246   0.493  -0.200
  800   HG23  VAL 104          2HG2      VAL 104   7.724   0.919   0.664
  801    H    PHE 105           HN       PHE 105   8.671  -2.924   2.700
  802    HA   PHE 105           HA       PHE 105   6.820  -4.934   3.620
  803    HB2  PHE 105           2HB      PHE 105   9.754  -4.627   4.261
  804    HB3  PHE 105           1HB      PHE 105   8.767  -6.066   4.494
  805    HD1  PHE 105           2HD      PHE 105   7.546  -6.891   2.287
  806    HD2  PHE 105           1HD      PHE 105  11.086  -4.532   2.390
  807    HE1  PHE 105           2HE      PHE 105   8.107  -7.643   0.016
  808    HE2  PHE 105           1HE      PHE 105  11.653  -5.277   0.113
  809    HZ   PHE 105           HZ       PHE 105  10.164  -6.836  -1.075
  810    H    THR 106           HN       THR 106   5.817  -4.953   5.482
  811    HA   THR 106           HA       THR 106   6.847  -3.369   7.714
  812    HB   THR 106           HB       THR 106   4.454  -2.694   8.214
  813    HG1  THR 106           1HG      THR 106   4.142  -3.965   5.745
  814   HG21  THR 106          3HG2      THR 106   4.454  -0.801   6.649
  815   HG22  THR 106          1HG2      THR 106   5.672  -1.616   5.666
  816   HG23  THR 106          2HG2      THR 106   6.067  -1.090   7.302
  817    H    ASP 107           HN       ASP 107   4.858  -3.866   9.535
  818    HA   ASP 107           HA       ASP 107   5.398  -6.585  10.225
  819    HB2  ASP 107           2HB      ASP 107   3.558  -4.567  11.522
  820    HB3  ASP 107           1HB      ASP 107   3.980  -6.131  12.209
  821    H    SER 108           HN       SER 108   2.438  -4.814   9.429
  822    HA   SER 108           HA       SER 108   0.736  -7.057   9.578
  823    HB2  SER 108           2HB      SER 108   0.317  -4.488   8.047
  824    HB3  SER 108           1HB      SER 108  -0.933  -5.624   8.559
  825    HG   SER 108           HG       SER 108   0.308  -5.097  10.744
  826    H    GLY 109           HN       GLY 109   2.827  -5.890   7.084
  827    HA2  GLY 109           2HA      GLY 109   3.060  -8.056   5.576
  828    HA3  GLY 109           1HA      GLY 109   1.492  -7.467   5.041
  829    H    ILE 110           HN       ILE 110   1.843  -6.717   3.081
  830    HA   ILE 110           HA       ILE 110   4.155  -4.965   2.665
  831    HB   ILE 110           HB       ILE 110   2.499  -6.495   0.647
  832   HG12  ILE 110          2HG1      ILE 110   5.381  -6.825   1.511
  833   HG13  ILE 110          1HG1      ILE 110   4.052  -7.881   1.972
  834   HG21  ILE 110          1HG2      ILE 110   4.881  -4.702   0.196
  835   HG22  ILE 110          2HG2      ILE 110   3.219  -4.359  -0.281
  836   HG23  ILE 110          3HG2      ILE 110   4.094  -5.695  -1.029
  837   HD11  ILE 110          3HD1      ILE 110   5.398  -8.855   0.198
  838   HD12  ILE 110          1HD1      ILE 110   5.074  -7.455  -0.825
  839   HD13  ILE 110          2HD1      ILE 110   3.754  -8.528  -0.359
  840    H    HIS 111           HN       HIS 111   3.860  -2.895   2.273
  841    HA   HIS 111           HA       HIS 111   1.134  -1.943   1.699
  842    HB2  HIS 111           2HB      HIS 111   3.393  -0.727   3.265
  843    HB3  HIS 111           1HB      HIS 111   2.185   0.306   2.521
  844    HD1  HIS 111           1HD      HIS 111  -0.247   0.154   3.489
  845    HD2  HIS 111           2HD      HIS 111   2.594  -2.025   5.584
  846    HE1  HIS 111           1HE      HIS 111  -1.302  -0.364   5.705
  847    HE2  HIS 111           2HE      HIS 111   0.532  -1.438   7.035
  848    H    ILE 112           HN       ILE 112   0.811  -0.723  -0.080
  849    HA   ILE 112           HA       ILE 112   3.173  -0.094  -1.725
  850    HB   ILE 112           HB       ILE 112   0.313  -0.071  -2.681
  851   HG12  ILE 112          2HG1      ILE 112   2.276  -2.372  -2.869
  852   HG13  ILE 112          1HG1      ILE 112   0.845  -2.338  -1.845
  853   HG21  ILE 112          1HG2      ILE 112   2.951  -0.276  -4.134
  854   HG22  ILE 112          2HG2      ILE 112   1.907   1.143  -4.060
  855   HG23  ILE 112          3HG2      ILE 112   1.363  -0.310  -4.900
  856   HD11  ILE 112          3HD1      ILE 112   0.416  -3.636  -3.829
  857   HD12  ILE 112          1HD1      ILE 112   0.895  -2.284  -4.854
  858   HD13  ILE 112          2HD1      ILE 112  -0.554  -2.166  -3.860
  859    H    ILE 113           HN       ILE 113   3.445   2.024  -2.466
  860    HA   ILE 113           HA       ILE 113   1.680   4.004  -1.191
  861    HB   ILE 113           HB       ILE 113   4.608   4.357  -1.794
  862   HG12  ILE 113          2HG1      ILE 113   3.279   3.805   0.867
  863   HG13  ILE 113          1HG1      ILE 113   4.259   2.656  -0.040
  864   HG21  ILE 113          1HG2      ILE 113   2.670   6.020  -0.184
  865   HG22  ILE 113          2HG2      ILE 113   3.313   6.421  -1.777
  866   HG23  ILE 113          3HG2      ILE 113   4.392   6.348  -0.382
  867   HD11  ILE 113          3HD1      ILE 113   5.513   3.658   1.778
  868   HD12  ILE 113          1HD1      ILE 113   5.214   5.265   1.114
  869   HD13  ILE 113          2HD1      ILE 113   6.196   4.108   0.215
  870    H    LEU 114           HN       LEU 114   0.540   5.058  -2.645
  871    HA   LEU 114           HA       LEU 114   1.833   5.835  -5.173
  872    HB2  LEU 114           2HB      LEU 114   0.135   4.189  -5.660
  873    HB3  LEU 114           1HB      LEU 114  -1.032   5.028  -4.660
  874    HG   LEU 114           HG       LEU 114  -0.995   6.922  -6.276
  875   HD11  LEU 114          1HD1      LEU 114   0.633   5.048  -7.978
  876   HD12  LEU 114          2HD1      LEU 114   1.235   6.519  -7.213
  877   HD13  LEU 114          3HD1      LEU 114  -0.005   6.620  -8.463
  878   HD21  LEU 114          3HD2      LEU 114  -1.700   4.223  -7.416
  879   HD22  LEU 114          1HD2      LEU 114  -2.289   5.776  -8.007
  880   HD23  LEU 114          2HD2      LEU 114  -2.728   5.225  -6.391
  881    H    ARG 115           HN       ARG 115   2.363   7.930  -4.807
  882    HA   ARG 115           HA       ARG 115   0.740   9.595  -3.134
  883    HB2  ARG 115           2HB      ARG 115   3.158   9.947  -3.200
  884    HB3  ARG 115           1HB      ARG 115   3.069  10.344  -4.914
  885    HG2  ARG 115           2HG      ARG 115   1.759  12.320  -4.427
  886    HG3  ARG 115           1HG      ARG 115   1.723  11.906  -2.714
  887    HD2  ARG 115           2HD      ARG 115   4.079  12.260  -2.511
  888    HD3  ARG 115           1HD      ARG 115   4.258  12.423  -4.260
  889    HE   ARG 115           HE       ARG 115   2.435  14.359  -3.367
  890   HH11  ARG 115          1HH1      ARG 115   5.879  13.641  -3.126
  891   HH12  ARG 115          2HH1      ARG 115   6.324  15.307  -2.972
  892   HH21  ARG 115          1HH2      ARG 115   3.050  16.543  -3.138
  893   HH22  ARG 115          2HH2      ARG 115   4.728  16.954  -2.986
  894    H    THR 116           HN       THR 116  -1.146  10.235  -3.767
  895    HA   THR 116           HA       THR 116  -1.909  10.527  -6.496
  896    HB   THR 116           HB       THR 116  -3.405  11.493  -4.055
  897    HG1  THR 116           1HG      THR 116  -3.511   8.901  -5.241
  898   HG21  THR 116          3HG2      THR 116  -4.324  12.185  -6.223
  899   HG22  THR 116          1HG2      THR 116  -5.381  11.014  -5.435
  900   HG23  THR 116          2HG2      THR 116  -4.332  10.505  -6.759
  901    H    GLU 117           HN       GLU 117  -1.467  12.783  -3.773
  902    HA   GLU 117           HA       GLU 117  -0.879  14.921  -5.673
  903    HB2  GLU 117           2HB      GLU 117  -2.912  15.139  -3.437
  904    HB3  GLU 117           1HB      GLU 117  -2.266  16.511  -4.323
  905    HG2  GLU 117           2HG      GLU 117  -3.228  15.694  -6.373
  906    HG3  GLU 117           1HG      GLU 117  -3.792  14.234  -5.565
  Start of MODEL    3
    1    H1   GLY   1           1HT      GLY   1  12.038  25.950  -6.790
    2    H2   GLY   1           2HT      GLY   1  11.842  27.402  -5.958
    3    H3   GLY   1           3HT      GLY   1  11.173  27.218  -7.500
    4    HA2  GLY   1           1HA      GLY   1   9.461  27.040  -5.836
    5    HA3  GLY   1           2HA      GLY   1   9.688  25.508  -6.669
    6    H    SER   2           HN       SER   2   9.285  23.981  -5.208
    7    HA   SER   2           HA       SER   2   9.868  24.321  -2.433
    8    HB2  SER   2           2HB      SER   2   8.933  21.875  -3.947
    9    HB3  SER   2           1HB      SER   2   8.915  22.073  -2.194
   10    HG   SER   2           HG       SER   2   7.126  22.934  -4.035
   11    H    HIS   3           HN       HIS   3  11.415  23.346  -1.203
   12    HA   HIS   3           HA       HIS   3  13.322  21.513  -2.418
   13    HB2  HIS   3           2HB      HIS   3  15.290  22.873  -1.824
   14    HB3  HIS   3           1HB      HIS   3  14.275  23.707  -2.991
   15    HD1  HIS   3           1HD      HIS   3  15.613  23.958   0.471
   16    HD2  HIS   3           2HD      HIS   3  12.960  26.015  -1.979
   17    HE1  HIS   3           1HE      HIS   3  15.221  26.165   1.600
   18    HE2  HIS   3           2HE      HIS   3  13.745  27.447   0.021
   19    H    MET   4           HN       MET   4  11.314  21.620  -0.224
   20    HA   MET   4           HA       MET   4  13.063  20.702   1.950
   21    HB2  MET   4           2HB      MET   4  10.681  22.541   2.163
   22    HB3  MET   4           1HB      MET   4  11.303  21.636   3.533
   23    HG2  MET   4           2HG      MET   4  13.380  22.798   3.450
   24    HG3  MET   4           1HG      MET   4  12.952  23.564   1.921
   25    HE1  MET   4           3HE      MET   4  10.633  24.464   5.814
   26    HE2  MET   4           1HE      MET   4  11.870  23.214   5.710
   27    HE3  MET   4           2HE      MET   4  10.363  23.040   4.810
   28    H    GLU   5           HN       GLU   5  11.775  19.381   3.566
   29    HA   GLU   5           HA       GLU   5  10.195  17.464   2.113
   30    HB2  GLU   5           2HB      GLU   5  11.053  17.570   5.008
   31    HB3  GLU   5           1HB      GLU   5  10.150  16.241   4.294
   32    HG2  GLU   5           2HG      GLU   5  12.002  15.854   2.724
   33    HG3  GLU   5           1HG      GLU   5  12.911  17.145   3.509
   34    HA   PRO   6           HA       PRO   6   6.341  19.464   2.985
   35    HB2  PRO   6           2HB      PRO   6   4.726  17.354   2.315
   36    HB3  PRO   6           1HB      PRO   6   5.476  18.433   1.135
   37    HG2  PRO   6           2HG      PRO   6   6.338  15.716   2.033
   38    HG3  PRO   6           1HG      PRO   6   6.334  16.412   0.405
   39    HD2  PRO   6           2HD      PRO   6   8.577  16.222   1.882
   40    HD3  PRO   6           1HD      PRO   6   8.297  17.565   0.755
   41    H    ALA   7           HN       ALA   7   4.482  19.243   4.356
   42    HA   ALA   7           HA       ALA   7   5.057  17.629   6.739
   43    HB1  ALA   7           1HB      ALA   7   3.610  19.179   7.942
   44    HB2  ALA   7           2HB      ALA   7   3.239  20.019   6.436
   45    HB3  ALA   7           3HB      ALA   7   4.879  20.051   7.081
   46    H    ARG   8           HN       ARG   8   2.665  18.233   4.274
   47    HA   ARG   8           HA       ARG   8   1.176  15.881   5.181
   48    HB2  ARG   8           2HB      ARG   8  -0.071  18.536   4.436
   49    HB3  ARG   8           1HB      ARG   8  -0.967  17.040   4.633
   50    HG2  ARG   8           2HG      ARG   8  -0.248  16.953   6.985
   51    HG3  ARG   8           1HG      ARG   8   0.572  18.501   6.768
   52    HD2  ARG   8           2HD      ARG   8  -1.555  19.555   6.207
   53    HD3  ARG   8           1HD      ARG   8  -2.375  18.003   6.372
   54    HE   ARG   8           HE       ARG   8  -0.926  18.889   8.711
   55   HH11  ARG   8          1HH1      ARG   8  -4.009  18.868   7.034
   56   HH12  ARG   8          2HH1      ARG   8  -4.937  19.145   8.469
   57   HH21  ARG   8          1HH2      ARG   8  -2.154  19.274  10.622
   58   HH22  ARG   8          2HH2      ARG   8  -3.879  19.384  10.510
   59    H    VAL   9           HN       VAL   9   0.755  14.521   3.555
   60    HA   VAL   9           HA       VAL   9   0.662  15.572   0.813
   61    HB   VAL   9           HB       VAL   9   1.978  13.672  -0.039
   62   HG11  VAL   9          1HG1      VAL   9   3.441  15.276   2.048
   63   HG12  VAL   9          2HG1      VAL   9   3.129  15.764   0.382
   64   HG13  VAL   9          3HG1      VAL   9   4.192  14.396   0.717
   65   HG21  VAL   9          3HG2      VAL   9   2.505  13.032   2.864
   66   HG22  VAL   9          1HG2      VAL   9   3.261  12.246   1.477
   67   HG23  VAL   9          2HG2      VAL   9   1.527  12.074   1.753
   68    H    ARG  10           HN       ARG  10  -0.345  14.056  -0.712
   69    HA   ARG  10           HA       ARG  10  -2.346  12.397   0.675
   70    HB2  ARG  10           2HB      ARG  10  -3.331  14.221  -0.607
   71    HB3  ARG  10           1HB      ARG  10  -2.452  13.703  -2.039
   72    HG2  ARG  10           2HG      ARG  10  -3.684  11.593  -2.031
   73    HG3  ARG  10           1HG      ARG  10  -4.587  12.140  -0.621
   74    HD2  ARG  10           2HD      ARG  10  -5.521  13.972  -1.896
   75    HD3  ARG  10           1HD      ARG  10  -4.548  13.523  -3.298
   76    HE   ARG  10           HE       ARG  10  -6.202  11.385  -2.347
   77   HH11  ARG  10          1HH1      ARG  10  -6.150  14.270  -4.370
   78   HH12  ARG  10          2HH1      ARG  10  -7.461  13.730  -5.370
   79   HH21  ARG  10          1HH2      ARG  10  -7.954  10.697  -3.687
   80   HH22  ARG  10          2HH2      ARG  10  -8.480  11.715  -4.984
   81    H    CYS  11           HN       CYS  11  -2.018  10.280   0.543
   82    HA   CYS  11           HA       CYS  11  -0.919   9.195  -1.945
   83    HB2  CYS  11           2HB      CYS  11   0.030   8.377   0.807
   84    HB3  CYS  11           1HB      CYS  11   0.578   7.712  -0.724
   85    HG   CYS  11           HG       CYS  11   1.577  10.439   0.886
   86    H    SER  12           HN       SER  12  -1.555   7.122  -2.461
   87    HA   SER  12           HA       SER  12  -3.841   6.082  -0.971
   88    HB2  SER  12           2HB      SER  12  -2.750   5.302  -3.692
   89    HB3  SER  12           1HB      SER  12  -4.257   4.732  -2.977
   90    HG   SER  12           HG       SER  12  -3.831   7.495  -3.259
   91    H    HIS  13           HN       HIS  13  -3.853   3.945  -0.173
   92    HA   HIS  13           HA       HIS  13  -1.195   2.677  -0.090
   93    HB2  HIS  13           2HB      HIS  13  -1.349   2.244   2.223
   94    HB3  HIS  13           1HB      HIS  13  -1.845   3.918   2.034
   95    HD1  HIS  13           1HD      HIS  13  -2.785   0.958   3.764
   96    HD2  HIS  13           2HD      HIS  13  -4.895   4.030   1.933
   97    HE1  HIS  13           1HE      HIS  13  -5.084   0.865   4.740
   98    HE2  HIS  13           2HE      HIS  13  -6.182   2.945   3.899
   99    H    LEU  14           HN       LEU  14  -1.074   0.511  -0.070
  100    HA   LEU  14           HA       LEU  14  -3.520  -1.109   0.005
  101    HB2  LEU  14           2HB      LEU  14  -2.772  -0.643  -2.391
  102    HB3  LEU  14           1HB      LEU  14  -1.284  -1.481  -2.019
  103    HG   LEU  14           HG       LEU  14  -3.927  -2.887  -1.722
  104   HD11  LEU  14          1HD1      LEU  14  -2.322  -2.603  -4.259
  105   HD12  LEU  14          2HD1      LEU  14  -3.928  -1.937  -3.964
  106   HD13  LEU  14          3HD1      LEU  14  -3.695  -3.683  -4.024
  107   HD21  LEU  14          3HD2      LEU  14  -2.566  -4.862  -2.205
  108   HD22  LEU  14          1HD2      LEU  14  -1.925  -3.974  -0.822
  109   HD23  LEU  14          2HD2      LEU  14  -1.140  -3.839  -2.396
  110    H    LEU  15           HN       LEU  15  -3.148  -3.180   0.922
  111    HA   LEU  15           HA       LEU  15  -0.434  -3.720   1.873
  112    HB2  LEU  15           2HB      LEU  15  -1.331  -2.471   3.687
  113    HB3  LEU  15           1HB      LEU  15  -2.849  -3.342   3.627
  114    HG   LEU  15           HG       LEU  15  -1.675  -5.385   4.409
  115   HD11  LEU  15          1HD1      LEU  15   0.549  -4.893   3.593
  116   HD12  LEU  15          2HD1      LEU  15   0.574  -5.181   5.334
  117   HD13  LEU  15          3HD1      LEU  15   0.678  -3.535   4.711
  118   HD21  LEU  15          3HD2      LEU  15  -1.374  -4.650   6.718
  119   HD22  LEU  15          1HD2      LEU  15  -2.814  -3.928   6.000
  120   HD23  LEU  15          2HD2      LEU  15  -1.343  -2.970   6.185
  121    H    VAL  16           HN       VAL  16   0.046  -5.800   1.670
  122    HA   VAL  16           HA       VAL  16  -2.192  -7.698   1.527
  123    HB   VAL  16           HB       VAL  16   0.559  -7.920   0.267
  124   HG11  VAL  16          1HG1      VAL  16  -1.740  -9.878   0.221
  125   HG12  VAL  16          2HG1      VAL  16  -0.209 -10.100   1.069
  126   HG13  VAL  16          3HG1      VAL  16  -0.240 -10.028  -0.693
  127   HG21  VAL  16          3HG2      VAL  16  -0.676  -7.889  -1.845
  128   HG22  VAL  16          1HG2      VAL  16  -0.966  -6.420  -0.916
  129   HG23  VAL  16          2HG2      VAL  16  -2.188  -7.688  -0.962
  130    H    LYS  17           HN       LYS  17  -2.411  -8.983   3.184
  131    HA   LYS  17           HA       LYS  17  -0.553  -9.094   5.320
  132    HB2  LYS  17           2HB      LYS  17  -3.157 -10.403   4.699
  133    HB3  LYS  17           1HB      LYS  17  -2.155 -11.113   5.953
  134    HG2  LYS  17           2HG      LYS  17  -3.042  -8.233   5.934
  135    HG3  LYS  17           1HG      LYS  17  -3.888  -9.530   6.782
  136    HD2  LYS  17           2HD      LYS  17  -1.730 -10.005   7.990
  137    HD3  LYS  17           1HD      LYS  17  -1.086  -8.526   7.278
  138    HE2  LYS  17           2HE      LYS  17  -3.524  -8.705   9.049
  139    HE3  LYS  17           1HE      LYS  17  -1.925  -8.180   9.563
  140    HZ1  LYS  17           3HZ      LYS  17  -3.280  -6.285   9.137
  141    HZ2  LYS  17           1HZ      LYS  17  -3.696  -6.843   7.595
  142    HZ3  LYS  17           2HZ      LYS  17  -2.104  -6.367   7.921
  143    H    HIS  18           HN       HIS  18   0.329 -11.069   6.226
  144    HA   HIS  18           HA       HIS  18   1.012 -13.090   4.235
  145    HB2  HIS  18           2HB      HIS  18   3.354 -13.182   5.152
  146    HB3  HIS  18           1HB      HIS  18   2.982 -11.700   4.289
  147    HD1  HIS  18           1HD      HIS  18   4.947 -12.596   6.962
  148    HD2  HIS  18           2HD      HIS  18   1.924  -9.765   6.597
  149    HE1  HIS  18           1HE      HIS  18   5.386 -10.901   8.757
  150    HE2  HIS  18           2HE      HIS  18   3.432  -9.322   8.649
  151    H    SER  19           HN       SER  19   1.468 -15.154   5.063
  152    HA   SER  19           HA       SER  19  -0.308 -16.014   6.983
  153    HB2  SER  19           2HB      SER  19   0.854 -17.380   5.180
  154    HB3  SER  19           1HB      SER  19   2.217 -17.512   6.291
  155    HG   SER  19           HG       SER  19  -0.449 -18.371   6.747
  156    H    GLN  20           HN       GLN  20   3.241 -15.730   7.428
  157    HA   GLN  20           HA       GLN  20   2.922 -16.161  10.271
  158    HB2  GLN  20           2HB      GLN  20   5.386 -15.452   8.666
  159    HB3  GLN  20           1HB      GLN  20   5.378 -15.856  10.373
  160    HG2  GLN  20           2HG      GLN  20   4.537 -17.698   8.147
  161    HG3  GLN  20           1HG      GLN  20   6.105 -17.715   8.948
  162   HE21  GLN  20          1HE2      GLN  20   4.922 -17.155  11.584
  163   HE22  GLN  20          2HE2      GLN  20   4.182 -18.630  12.084
  164    H    SER  21           HN       SER  21   1.570 -14.373  10.732
  165    HA   SER  21           HA       SER  21   3.065 -11.910  11.157
  166    HB2  SER  21           2HB      SER  21   1.723 -11.829   8.965
  167    HB3  SER  21           1HB      SER  21   0.285 -11.833   9.984
  168    HG   SER  21           HG       SER  21   2.270  -9.978  10.618
  169    H    ARG  22           HN       ARG  22   1.090 -10.359  12.249
  170    HA   ARG  22           HA       ARG  22   0.661 -11.653  14.766
  171    HB2  ARG  22           2HB      ARG  22  -0.569  -9.048  13.847
  172    HB3  ARG  22           1HB      ARG  22  -0.317  -9.586  15.497
  173    HG2  ARG  22           2HG      ARG  22   1.851  -8.877  13.533
  174    HG3  ARG  22           1HG      ARG  22   1.275  -7.863  14.855
  175    HD2  ARG  22           2HD      ARG  22   1.959  -9.635  16.445
  176    HD3  ARG  22           1HD      ARG  22   2.637 -10.542  15.093
  177    HE   ARG  22           HE       ARG  22   3.714  -7.961  15.072
  178   HH11  ARG  22          1HH1      ARG  22   3.830 -10.864  17.043
  179   HH12  ARG  22          2HH1      ARG  22   5.441 -10.571  17.607
  180   HH21  ARG  22          1HH2      ARG  22   5.845  -7.569  15.837
  181   HH22  ARG  22          2HH2      ARG  22   6.583  -8.692  16.928
  182    H    ARG  23           HN       ARG  23  -1.351 -10.645  12.067
  183    HA   ARG  23           HA       ARG  23  -3.401 -12.547  12.905
  184    HB2  ARG  23           2HB      ARG  23  -4.091 -10.365  13.792
  185    HB3  ARG  23           1HB      ARG  23  -3.937  -9.659  12.191
  186    HG2  ARG  23           2HG      ARG  23  -5.720 -11.173  11.401
  187    HG3  ARG  23           1HG      ARG  23  -5.913 -11.748  13.060
  188    HD2  ARG  23           2HD      ARG  23  -6.494  -9.523  13.801
  189    HD3  ARG  23           1HD      ARG  23  -6.191  -8.879  12.190
  190    HE   ARG  23           HE       ARG  23  -8.252 -10.932  12.527
  191   HH11  ARG  23          1HH1      ARG  23  -7.426  -7.570  11.924
  192   HH12  ARG  23          2HH1      ARG  23  -8.962  -7.180  11.234
  193   HH21  ARG  23          1HH2      ARG  23 -10.291 -10.417  11.622
  194   HH22  ARG  23          2HH2      ARG  23 -10.603  -8.812  11.061
  195    HA   PRO  24           HA       PRO  24  -2.655 -13.008   8.451
  196    HB2  PRO  24           2HB      PRO  24  -3.023 -15.660   8.340
  197    HB3  PRO  24           1HB      PRO  24  -1.541 -14.958   9.000
  198    HG2  PRO  24           2HG      PRO  24  -3.893 -16.110  10.431
  199    HG3  PRO  24           1HG      PRO  24  -2.169 -16.233  10.821
  200    HD2  PRO  24           2HD      PRO  24  -3.958 -14.476  12.016
  201    HD3  PRO  24           1HD      PRO  24  -2.194 -14.290  12.010
  202    H    SER  25           HN       SER  25  -4.973 -11.806   8.919
  203    HA   SER  25           HA       SER  25  -6.797 -13.240   7.187
  204    HB2  SER  25           2HB      SER  25  -8.738 -12.726   8.757
  205    HB3  SER  25           1HB      SER  25  -7.670 -14.040   9.248
  206    HG   SER  25           HG       SER  25  -7.457 -11.359  10.152
  207    H    SER  26           HN       SER  26  -7.773 -11.892   5.800
  208    HA   SER  26           HA       SER  26  -7.573  -9.006   6.339
  209    HB2  SER  26           2HB      SER  26  -7.535  -8.712   3.900
  210    HB3  SER  26           1HB      SER  26  -6.233  -9.786   4.411
  211    H    TRP  27           HN       TRP  27  -9.313  -7.958   4.581
  212    HA   TRP  27           HA       TRP  27 -11.860  -8.837   5.639
  213    HB2  TRP  27           2HB      TRP  27 -12.722  -6.788   4.978
  214    HB3  TRP  27           1HB      TRP  27 -11.035  -6.372   5.218
  215    HD1  TRP  27           1HD      TRP  27  -9.555  -6.579   2.704
  216    HE1  TRP  27           1HE      TRP  27 -10.305  -5.601   0.436
  217    HE3  TRP  27           3HE      TRP  27 -14.551  -6.067   3.641
  218    HZ2  TRP  27           2HZ      TRP  27 -12.685  -4.729  -0.779
  219    HZ3  TRP  27           3HZ      TRP  27 -15.989  -5.149   1.873
  220    HH2  TRP  27           2HH      TRP  27 -15.075  -4.494  -0.288
  221    H    ARG  28           HN       ARG  28  -9.972  -9.785   3.129
  222    HA   ARG  28           HA       ARG  28 -12.273 -10.528   1.453
  223    HB2  ARG  28           2HB      ARG  28  -9.355 -10.260   0.737
  224    HB3  ARG  28           1HB      ARG  28 -10.565 -10.947  -0.335
  225    HG2  ARG  28           2HG      ARG  28 -10.633  -8.137   0.751
  226    HG3  ARG  28           1HG      ARG  28 -10.009  -8.590  -0.833
  227    HD2  ARG  28           2HD      ARG  28 -12.219  -7.833  -1.203
  228    HD3  ARG  28           1HD      ARG  28 -12.293  -9.590  -1.297
  229    HE   ARG  28           HE       ARG  28 -12.879  -8.890   1.330
  230   HH11  ARG  28          1HH1      ARG  28 -14.274  -8.374  -1.847
  231   HH12  ARG  28          2HH1      ARG  28 -15.895  -8.269  -1.255
  232   HH21  ARG  28          1HH2      ARG  28 -15.029  -8.741   2.111
  233   HH22  ARG  28          2HH2      ARG  28 -16.325  -8.488   0.993
  234    H    GLN  29           HN       GLN  29  -9.357 -11.744   3.029
  235    HA   GLN  29           HA       GLN  29 -10.449 -14.448   2.659
  236    HB2  GLN  29           2HB      GLN  29  -8.475 -13.978   1.190
  237    HB3  GLN  29           1HB      GLN  29  -7.517 -13.718   2.638
  238    HG2  GLN  29           2HG      GLN  29  -7.090 -15.917   1.815
  239    HG3  GLN  29           1HG      GLN  29  -7.995 -16.047   3.320
  240   HE21  GLN  29          1HE2      GLN  29  -7.701 -17.949   1.117
  241   HE22  GLN  29          2HE2      GLN  29  -9.306 -18.301   0.580
  242    H    GLU  30           HN       GLU  30 -10.844 -15.454   4.517
  243    HA   GLU  30           HA       GLU  30 -10.074 -14.285   7.025
  244    HB2  GLU  30           2HB      GLU  30 -11.536 -16.842   6.358
  245    HB3  GLU  30           1HB      GLU  30 -11.238 -16.295   7.997
  246    HG2  GLU  30           2HG      GLU  30 -12.763 -14.713   5.946
  247    HG3  GLU  30           1HG      GLU  30 -13.506 -15.787   7.131
  248    H    LYS  31           HN       LYS  31  -8.708 -16.576   4.926
  249    HA   LYS  31           HA       LYS  31  -6.796 -17.337   7.015
  250    HB2  LYS  31           2HB      LYS  31  -6.554 -19.541   5.858
  251    HB3  LYS  31           1HB      LYS  31  -8.115 -19.291   6.619
  252    HG2  LYS  31           2HG      LYS  31  -9.121 -18.802   4.468
  253    HG3  LYS  31           1HG      LYS  31  -7.552 -18.940   3.678
  254    HD2  LYS  31           2HD      LYS  31  -8.950 -21.164   5.163
  255    HD3  LYS  31           1HD      LYS  31  -8.955 -20.959   3.413
  256    HE2  LYS  31           2HE      LYS  31  -6.492 -21.150   3.418
  257    HE3  LYS  31           1HE      LYS  31  -6.539 -21.435   5.156
  258    HZ1  LYS  31           3HZ      LYS  31  -6.381 -23.492   3.914
  259    HZ2  LYS  31           1HZ      LYS  31  -7.813 -23.138   3.096
  260    HZ3  LYS  31           2HZ      LYS  31  -7.841 -23.421   4.763
  261    H    ILE  32           HN       ILE  32  -5.232 -15.876   6.448
  262    HA   ILE  32           HA       ILE  32  -4.343 -15.688   3.714
  263    HB   ILE  32           HB       ILE  32  -3.148 -14.535   6.251
  264   HG12  ILE  32          2HG1      ILE  32  -5.355 -13.610   5.702
  265   HG13  ILE  32          1HG1      ILE  32  -4.092 -12.407   5.475
  266   HG21  ILE  32          1HG2      ILE  32  -2.474 -13.897   3.386
  267   HG22  ILE  32          2HG2      ILE  32  -1.470 -14.852   4.477
  268   HG23  ILE  32          3HG2      ILE  32  -1.771 -13.148   4.819
  269   HD11  ILE  32          3HD1      ILE  32  -4.166 -12.812   3.057
  270   HD12  ILE  32          1HD1      ILE  32  -5.726 -12.296   3.694
  271   HD13  ILE  32          2HD1      ILE  32  -5.451 -13.993   3.305
  272    H    THR  33           HN       THR  33  -3.514 -17.540   3.005
  273    HA   THR  33           HA       THR  33  -1.645 -19.036   4.665
  274    HB   THR  33           HB       THR  33  -2.608 -19.803   1.905
  275    HG1  THR  33           1HG      THR  33  -3.905 -19.998   4.423
  276   HG21  THR  33          3HG2      THR  33  -0.750 -21.109   2.850
  277   HG22  THR  33          1HG2      THR  33  -2.218 -22.081   2.742
  278   HG23  THR  33          2HG2      THR  33  -1.707 -21.424   4.296
  279    H    ARG  34           HN       ARG  34  -1.707 -16.803   2.077
  280    HA   ARG  34           HA       ARG  34   0.669 -17.494   0.726
  281    HB2  ARG  34           2HB      ARG  34   0.583 -15.272  -0.234
  282    HB3  ARG  34           1HB      ARG  34  -1.049 -15.919  -0.160
  283    HG2  ARG  34           2HG      ARG  34  -1.447 -14.610   1.883
  284    HG3  ARG  34           1HG      ARG  34   0.168 -13.919   1.734
  285    HD2  ARG  34           2HD      ARG  34  -1.363 -12.344   0.832
  286    HD3  ARG  34           1HD      ARG  34  -0.506 -13.074  -0.523
  287    HE   ARG  34           HE       ARG  34  -2.505 -14.480  -0.859
  288   HH11  ARG  34          1HH1      ARG  34  -2.841 -11.490   0.954
  289   HH12  ARG  34          2HH1      ARG  34  -4.518 -11.297   0.585
  290   HH21  ARG  34          1HH2      ARG  34  -4.728 -14.229  -1.340
  291   HH22  ARG  34          2HH2      ARG  34  -5.594 -12.861  -0.737
  292    H    THR  35           HN       THR  35   2.763 -17.075   1.149
  293    HA   THR  35           HA       THR  35   3.340 -15.813   3.712
  294    HB   THR  35           HB       THR  35   4.252 -18.067   3.392
  295    HG1  THR  35           1HG      THR  35   6.662 -17.192   3.459
  296   HG21  THR  35          3HG2      THR  35   6.053 -18.460   1.749
  297   HG22  THR  35          1HG2      THR  35   5.761 -16.855   1.075
  298   HG23  THR  35          2HG2      THR  35   4.506 -18.094   0.986
  299    H    LYS  36           HN       LYS  36   5.875 -14.923   3.435
  300    HA   LYS  36           HA       LYS  36   5.583 -12.350   2.453
  301    HB2  LYS  36           2HB      LYS  36   7.296 -12.943   4.068
  302    HB3  LYS  36           1HB      LYS  36   8.128 -13.921   2.870
  303    HG2  LYS  36           2HG      LYS  36   8.497 -11.861   1.527
  304    HG3  LYS  36           1HG      LYS  36   7.802 -10.930   2.855
  305    HD2  LYS  36           2HD      LYS  36   9.547 -11.735   4.351
  306    HD3  LYS  36           1HD      LYS  36  10.229 -12.714   3.051
  307    HE2  LYS  36           2HE      LYS  36  10.634 -10.656   1.753
  308    HE3  LYS  36           1HE      LYS  36  10.011  -9.706   3.100
  309    HZ1  LYS  36           3HZ      LYS  36  12.420  -9.789   3.099
  310    HZ2  LYS  36           1HZ      LYS  36  12.390 -11.473   3.185
  311    HZ3  LYS  36           2HZ      LYS  36  11.804 -10.551   4.476
  312    H    GLU  37           HN       GLU  37   7.485 -14.959   0.914
  313    HA   GLU  37           HA       GLU  37   8.150 -13.510  -1.386
  314    HB2  GLU  37           2HB      GLU  37   7.895 -16.487  -0.985
  315    HB3  GLU  37           1HB      GLU  37   8.584 -15.743  -2.420
  316    HG2  GLU  37           2HG      GLU  37  10.302 -14.682  -1.010
  317    HG3  GLU  37           1HG      GLU  37   9.636 -15.518   0.391
  318    H    GLU  38           HN       GLU  38   5.353 -15.514  -0.687
  319    HA   GLU  38           HA       GLU  38   4.302 -15.556  -3.311
  320    HB2  GLU  38           2HB      GLU  38   2.902 -15.851  -0.655
  321    HB3  GLU  38           1HB      GLU  38   2.183 -16.218  -2.216
  322    HG2  GLU  38           2HG      GLU  38   4.560 -17.576  -0.982
  323    HG3  GLU  38           1HG      GLU  38   2.931 -18.235  -1.129
  324    H    ALA  39           HN       ALA  39   3.635 -13.504  -0.506
  325    HA   ALA  39           HA       ALA  39   1.691 -11.887  -1.735
  326    HB1  ALA  39           1HB      ALA  39   2.124 -10.314   0.090
  327    HB2  ALA  39           2HB      ALA  39   3.591 -11.200   0.510
  328    HB3  ALA  39           3HB      ALA  39   2.014 -11.969   0.690
  329    H    LEU  40           HN       LEU  40   5.190 -11.716  -1.579
  330    HA   LEU  40           HA       LEU  40   5.510  -9.152  -2.671
  331    HB2  LEU  40           2HB      LEU  40   7.271 -10.393  -1.488
  332    HB3  LEU  40           1HB      LEU  40   7.369 -11.518  -2.827
  333    HG   LEU  40           HG       LEU  40   8.170  -9.741  -4.293
  334   HD11  LEU  40          1HD1      LEU  40   7.940  -8.004  -1.841
  335   HD12  LEU  40          2HD1      LEU  40   7.029  -7.842  -3.343
  336   HD13  LEU  40          3HD1      LEU  40   8.766  -7.549  -3.329
  337   HD21  LEU  40          3HD2      LEU  40  10.342  -9.376  -3.223
  338   HD22  LEU  40          1HD2      LEU  40   9.797 -11.044  -3.054
  339   HD23  LEU  40          2HD2      LEU  40   9.673  -9.934  -1.690
  340    H    GLU  41           HN       GLU  41   5.354 -12.345  -4.203
  341    HA   GLU  41           HA       GLU  41   5.842 -11.485  -6.839
  342    HB2  GLU  41           2HB      GLU  41   4.286 -13.847  -5.787
  343    HB3  GLU  41           1HB      GLU  41   4.644 -13.600  -7.490
  344    HG2  GLU  41           2HG      GLU  41   6.730 -13.826  -5.337
  345    HG3  GLU  41           1HG      GLU  41   6.172 -15.170  -6.333
  346    H    LEU  42           HN       LEU  42   2.916 -11.721  -4.920
  347    HA   LEU  42           HA       LEU  42   1.107 -11.042  -6.973
  348    HB2  LEU  42           2HB      LEU  42   0.882 -10.590  -3.998
  349    HB3  LEU  42           1HB      LEU  42  -0.439 -10.450  -5.138
  350    HG   LEU  42           HG       LEU  42   1.061 -12.987  -4.489
  351   HD11  LEU  42          1HD1      LEU  42  -1.019 -13.685  -3.429
  352   HD12  LEU  42          2HD1      LEU  42  -1.729 -12.107  -3.774
  353   HD13  LEU  42          3HD1      LEU  42  -0.365 -12.236  -2.665
  354   HD21  LEU  42          3HD2      LEU  42  -0.685 -14.089  -5.828
  355   HD22  LEU  42          1HD2      LEU  42   0.294 -12.989  -6.796
  356   HD23  LEU  42          2HD2      LEU  42  -1.321 -12.509  -6.280
  357    H    ILE  43           HN       ILE  43   2.713  -9.107  -4.474
  358    HA   ILE  43           HA       ILE  43   1.698  -6.596  -5.075
  359    HB   ILE  43           HB       ILE  43   4.450  -7.349  -4.066
  360   HG12  ILE  43          2HG1      ILE  43   2.556  -7.991  -2.615
  361   HG13  ILE  43          1HG1      ILE  43   3.578  -6.769  -1.871
  362   HG21  ILE  43          1HG2      ILE  43   3.167  -4.621  -4.143
  363   HG22  ILE  43          2HG2      ILE  43   4.593  -5.140  -5.041
  364   HG23  ILE  43          3HG2      ILE  43   4.653  -5.022  -3.283
  365   HD11  ILE  43          3HD1      ILE  43   1.248  -6.296  -1.463
  366   HD12  ILE  43          1HD1      ILE  43   0.917  -6.301  -3.194
  367   HD13  ILE  43          2HD1      ILE  43   1.947  -5.050  -2.497
  368    H    ASN  44           HN       ASN  44   4.702  -8.059  -6.315
  369    HA   ASN  44           HA       ASN  44   5.373  -5.957  -8.039
  370    HB2  ASN  44           2HB      ASN  44   6.120  -8.858  -7.959
  371    HB3  ASN  44           1HB      ASN  44   6.614  -7.863  -9.322
  372   HD21  ASN  44          1HD2      ASN  44   7.034  -8.516  -5.952
  373   HD22  ASN  44          2HD2      ASN  44   8.436  -7.519  -5.732
  374    H    GLY  45           HN       GLY  45   3.390  -8.828  -8.584
  375    HA2  GLY  45           2HA      GLY  45   2.959  -8.497 -11.336
  376    HA3  GLY  45           1HA      GLY  45   1.861  -9.309 -10.227
  377    H    TYR  46           HN       TYR  46   1.215  -7.172  -8.546
  378    HA   TYR  46           HA       TYR  46  -0.771  -5.867 -10.092
  379    HB2  TYR  46           2HB      TYR  46   0.194  -5.297  -7.280
  380    HB3  TYR  46           1HB      TYR  46  -1.217  -4.548  -8.019
  381    HD1  TYR  46           1HD      TYR  46  -2.527  -6.766  -9.372
  382    HD2  TYR  46           2HD      TYR  46  -0.581  -6.686  -5.591
  383    HE1  TYR  46           1HE      TYR  46  -3.906  -8.656  -8.630
  384    HE2  TYR  46           2HE      TYR  46  -1.956  -8.578  -4.838
  385    HH   TYR  46           HH       TYR  46  -3.856 -10.426  -7.002
  386    H    ILE  47           HN       ILE  47   2.326  -4.821  -8.739
  387    HA   ILE  47           HA       ILE  47   2.229  -2.130  -9.441
  388    HB   ILE  47           HB       ILE  47   4.636  -3.973  -9.373
  389   HG12  ILE  47          2HG1      ILE  47   3.567  -2.003  -7.335
  390   HG13  ILE  47          1HG1      ILE  47   3.432  -3.754  -7.232
  391   HG21  ILE  47          1HG2      ILE  47   5.999  -1.939  -9.190
  392   HG22  ILE  47          2HG2      ILE  47   4.555  -0.958  -9.442
  393   HG23  ILE  47          3HG2      ILE  47   5.137  -2.014 -10.728
  394   HD11  ILE  47          3HD1      ILE  47   5.205  -2.918  -5.802
  395   HD12  ILE  47          1HD1      ILE  47   5.993  -2.172  -7.193
  396   HD13  ILE  47          2HD1      ILE  47   5.865  -3.928  -7.090
  397    H    GLN  48           HN       GLN  48   3.214  -4.933 -11.372
  398    HA   GLN  48           HA       GLN  48   4.050  -3.590 -13.676
  399    HB2  GLN  48           2HB      GLN  48   2.625  -6.253 -13.477
  400    HB3  GLN  48           1HB      GLN  48   3.476  -5.671 -14.898
  401    HG2  GLN  48           2HG      GLN  48   4.738  -6.224 -12.222
  402    HG3  GLN  48           1HG      GLN  48   4.766  -7.306 -13.610
  403   HE21  GLN  48          1HE2      GLN  48   6.049  -4.424 -12.200
  404   HE22  GLN  48          2HE2      GLN  48   7.307  -4.186 -13.354
  405    H    LYS  49           HN       LYS  49   0.840  -4.824 -12.808
  406    HA   LYS  49           HA       LYS  49  -0.506  -3.962 -15.116
  407    HB2  LYS  49           2HB      LYS  49  -1.483  -4.567 -12.332
  408    HB3  LYS  49           1HB      LYS  49  -2.565  -4.167 -13.659
  409    HG2  LYS  49           2HG      LYS  49  -1.851  -6.112 -14.887
  410    HG3  LYS  49           1HG      LYS  49  -0.632  -6.478 -13.665
  411    HD2  LYS  49           2HD      LYS  49  -2.307  -6.948 -12.032
  412    HD3  LYS  49           1HD      LYS  49  -3.584  -6.337 -13.084
  413    HE2  LYS  49           2HE      LYS  49  -3.543  -8.786 -13.027
  414    HE3  LYS  49           1HE      LYS  49  -3.206  -8.164 -14.640
  415    HZ1  LYS  49           3HZ      LYS  49  -1.752 -10.000 -13.984
  416    HZ2  LYS  49           1HZ      LYS  49  -1.139  -9.076 -12.713
  417    HZ3  LYS  49           2HZ      LYS  49  -0.881  -8.595 -14.320
  418    H    ILE  50           HN       ILE  50   0.145  -2.349 -12.052
  419    HA   ILE  50           HA       ILE  50  -1.523  -0.110 -12.477
  420    HB   ILE  50           HB       ILE  50   1.012  -0.308 -10.825
  421   HG12  ILE  50          2HG1      ILE  50  -1.888  -0.481  -9.970
  422   HG13  ILE  50          1HG1      ILE  50  -0.828  -1.869 -10.188
  423   HG21  ILE  50          1HG2      ILE  50  -1.170   1.781 -10.772
  424   HG22  ILE  50          2HG2      ILE  50   0.481   2.016 -11.347
  425   HG23  ILE  50          3HG2      ILE  50   0.180   1.677  -9.642
  426   HD11  ILE  50          3HD1      ILE  50  -1.046  -1.257  -7.843
  427   HD12  ILE  50          1HD1      ILE  50  -0.426   0.356  -8.198
  428   HD13  ILE  50          2HD1      ILE  50   0.614  -1.054  -8.402
  429    H    LYS  51           HN       LYS  51   1.965  -0.579 -13.064
  430    HA   LYS  51           HA       LYS  51   2.428   1.979 -14.167
  431    HB2  LYS  51           2HB      LYS  51   3.911  -0.589 -14.729
  432    HB3  LYS  51           1HB      LYS  51   4.489   1.023 -15.111
  433    HG2  LYS  51           2HG      LYS  51   4.428   1.522 -12.655
  434    HG3  LYS  51           1HG      LYS  51   4.081  -0.189 -12.390
  435    HD2  LYS  51           2HD      LYS  51   6.540   0.989 -13.692
  436    HD3  LYS  51           1HD      LYS  51   6.453   0.174 -12.130
  437    HE2  LYS  51           2HE      LYS  51   5.841  -1.910 -13.243
  438    HE3  LYS  51           1HE      LYS  51   5.869  -1.094 -14.804
  439    HZ1  LYS  51           3HZ      LYS  51   7.898  -2.283 -14.500
  440    HZ2  LYS  51           1HZ      LYS  51   8.187  -1.546 -13.008
  441    HZ3  LYS  51           2HZ      LYS  51   8.240  -0.636 -14.429
  442    H    SER  52           HN       SER  52   1.432  -1.067 -15.608
  443    HA   SER  52           HA       SER  52   1.622  -0.124 -18.302
  444    HB2  SER  52           2HB      SER  52   0.159  -2.524 -17.186
  445    HB3  SER  52           1HB      SER  52   0.509  -2.229 -18.890
  446    HG   SER  52           HG       SER  52   2.593  -2.268 -16.988
  447    H    GLY  53           HN       GLY  53  -0.665   0.271 -15.818
  448    HA2  GLY  53           2HA      GLY  53  -2.643   1.435 -15.788
  449    HA3  GLY  53           1HA      GLY  53  -2.378   1.826 -17.482
  450    H    GLU  54           HN       GLU  54  -2.618  -1.355 -16.002
  451    HA   GLU  54           HA       GLU  54  -4.575  -2.129 -17.975
  452    HB2  GLU  54           2HB      GLU  54  -3.277  -3.622 -15.698
  453    HB3  GLU  54           1HB      GLU  54  -4.459  -4.341 -16.782
  454    HG2  GLU  54           2HG      GLU  54  -1.839  -3.152 -17.651
  455    HG3  GLU  54           1HG      GLU  54  -2.124  -4.869 -17.373
  456    H    GLU  55           HN       GLU  55  -4.492  -1.955 -14.430
  457    HA   GLU  55           HA       GLU  55  -7.417  -1.753 -14.481
  458    HB2  GLU  55           2HB      GLU  55  -5.725  -3.358 -12.567
  459    HB3  GLU  55           1HB      GLU  55  -7.444  -3.056 -12.354
  460    HG2  GLU  55           2HG      GLU  55  -7.957  -4.257 -14.371
  461    HG3  GLU  55           1HG      GLU  55  -6.244  -4.450 -14.734
  462    H    ASP  56           HN       ASP  56  -8.338  -0.732 -12.587
  463    HA   ASP  56           HA       ASP  56  -6.836   1.629 -11.896
  464    HB2  ASP  56           2HB      ASP  56  -9.191   1.828 -12.501
  465    HB3  ASP  56           1HB      ASP  56  -9.642   0.772 -11.167
  466    H    PHE  57           HN       PHE  57  -5.990   2.164  -9.967
  467    HA   PHE  57           HA       PHE  57  -5.114   0.150  -8.252
  468    HB2  PHE  57           2HB      PHE  57  -3.973   2.321  -8.562
  469    HB3  PHE  57           1HB      PHE  57  -5.266   3.114  -7.672
  470    HD1  PHE  57           2HD      PHE  57  -2.416   0.809  -7.411
  471    HD2  PHE  57           1HD      PHE  57  -5.360   3.019  -5.276
  472    HE1  PHE  57           2HE      PHE  57  -1.202   0.389  -5.314
  473    HE2  PHE  57           1HE      PHE  57  -4.149   2.603  -3.174
  474    HZ   PHE  57           HZ       PHE  57  -2.071   1.286  -3.192
  475    H    GLU  58           HN       GLU  58  -7.897   2.307  -7.945
  476    HA   GLU  58           HA       GLU  58  -8.427   1.836  -5.230
  477    HB2  GLU  58           2HB      GLU  58 -10.312   2.583  -7.464
  478    HB3  GLU  58           1HB      GLU  58 -10.726   2.623  -5.754
  479    HG2  GLU  58           2HG      GLU  58  -9.016   4.297  -5.356
  480    HG3  GLU  58           1HG      GLU  58  -8.533   4.224  -7.048
  481    H    SER  59           HN       SER  59  -9.260   0.006  -8.092
  482    HA   SER  59           HA       SER  59 -11.118  -1.709  -6.779
  483    HB2  SER  59           2HB      SER  59 -11.060  -1.348  -9.253
  484    HB3  SER  59           1HB      SER  59  -9.546  -2.247  -9.311
  485    HG   SER  59           HG       SER  59 -10.749  -3.945  -9.452
  486    H    LEU  60           HN       LEU  60  -7.685  -1.899  -7.594
  487    HA   LEU  60           HA       LEU  60  -7.269  -4.521  -6.640
  488    HB2  LEU  60           2HB      LEU  60  -5.461  -2.201  -7.202
  489    HB3  LEU  60           1HB      LEU  60  -4.826  -3.612  -6.382
  490    HG   LEU  60           HG       LEU  60  -5.454  -5.014  -8.314
  491   HD11  LEU  60          1HD1      LEU  60  -6.238  -2.416  -9.620
  492   HD12  LEU  60          2HD1      LEU  60  -7.337  -3.709  -9.140
  493   HD13  LEU  60          3HD1      LEU  60  -6.145  -3.992 -10.409
  494   HD21  LEU  60          3HD2      LEU  60  -3.754  -4.174  -9.850
  495   HD22  LEU  60          1HD2      LEU  60  -3.219  -4.067  -8.175
  496   HD23  LEU  60          2HD2      LEU  60  -3.769  -2.618  -9.018
  497    H    ALA  61           HN       ALA  61  -6.969  -1.357  -5.094
  498    HA   ALA  61           HA       ALA  61  -5.941  -2.292  -2.629
  499    HB1  ALA  61           1HB      ALA  61  -6.498  -0.089  -1.766
  500    HB2  ALA  61           2HB      ALA  61  -7.511   0.226  -3.172
  501    HB3  ALA  61           3HB      ALA  61  -5.768   0.044  -3.366
  502    H    SER  62           HN       SER  62  -9.001  -2.623  -3.968
  503    HA   SER  62           HA       SER  62 -10.263  -2.954  -1.351
  504    HB2  SER  62           2HB      SER  62 -11.560  -2.879  -4.088
  505    HB3  SER  62           1HB      SER  62 -12.390  -2.881  -2.533
  506    HG   SER  62           HG       SER  62 -10.818  -0.840  -3.705
  507    H    GLN  63           HN       GLN  63 -10.023  -4.602  -4.515
  508    HA   GLN  63           HA       GLN  63 -11.212  -7.014  -3.604
  509    HB2  GLN  63           2HB      GLN  63  -9.505  -6.511  -6.040
  510    HB3  GLN  63           1HB      GLN  63 -10.448  -7.964  -5.750
  511    HG2  GLN  63           2HG      GLN  63 -12.496  -6.606  -5.749
  512    HG3  GLN  63           1HG      GLN  63 -11.526  -5.177  -6.098
  513   HE21  GLN  63          1HE2      GLN  63  -9.727  -6.694  -7.874
  514   HE22  GLN  63          2HE2      GLN  63 -10.621  -6.943  -9.329
  515    H    PHE  64           HN       PHE  64  -7.840  -5.987  -3.914
  516    HA   PHE  64           HA       PHE  64  -7.099  -8.457  -2.519
  517    HB2  PHE  64           2HB      PHE  64  -5.593  -7.230  -4.837
  518    HB3  PHE  64           1HB      PHE  64  -5.030  -8.586  -3.865
  519    HD1  PHE  64           2HD      PHE  64  -6.343 -10.727  -3.900
  520    HD2  PHE  64           1HD      PHE  64  -7.061  -7.550  -6.640
  521    HE1  PHE  64           2HE      PHE  64  -7.523 -12.283  -5.391
  522    HE2  PHE  64           1HE      PHE  64  -8.245  -9.103  -8.135
  523    HZ   PHE  64           HZ       PHE  64  -8.476 -11.473  -7.509
  524    H    SER  65           HN       SER  65  -7.089  -7.243  -0.620
  525    HA   SER  65           HA       SER  65  -4.576  -6.085  -0.016
  526    HB2  SER  65           2HB      SER  65  -5.733  -4.155  -1.135
  527    HB3  SER  65           1HB      SER  65  -6.977  -4.232   0.109
  528    HG   SER  65           HG       SER  65  -5.675  -2.843   1.034
  529    H    ASP  66           HN       ASP  66  -5.117  -4.834   2.286
  530    HA   ASP  66           HA       ASP  66  -5.721  -6.998   4.024
  531    HB2  ASP  66           2HB      ASP  66  -4.012  -5.429   4.640
  532    HB3  ASP  66           1HB      ASP  66  -5.151  -4.089   4.575
  533    H    ALA  67           HN       ALA  67  -7.127  -3.736   4.281
  534    HA   ALA  67           HA       ALA  67  -9.822  -4.616   4.098
  535    HB1  ALA  67           1HB      ALA  67 -10.470  -4.436   6.433
  536    HB2  ALA  67           2HB      ALA  67  -8.794  -4.108   6.881
  537    HB3  ALA  67           3HB      ALA  67  -9.237  -5.685   6.229
  538    H    SER  68           HN       SER  68  -8.010  -2.334   6.123
  539    HA   SER  68           HA       SER  68  -9.840  -0.260   6.121
  540    HB2  SER  68           2HB      SER  68  -6.868   0.158   6.275
  541    HB3  SER  68           1HB      SER  68  -8.148   1.014   7.137
  542    HG   SER  68           HG       SER  68  -8.416  -0.674   8.478
  543    H    SER  69           HN       SER  69  -7.755  -1.192   3.554
  544    HA   SER  69           HA       SER  69  -7.494   1.387   2.359
  545    HB2  SER  69           2HB      SER  69  -6.677   0.005   0.390
  546    HB3  SER  69           1HB      SER  69  -5.772  -0.164   1.895
  547    HG   SER  69           HG       SER  69  -7.444  -1.974   0.584
  548    H    ALA  70           HN       ALA  70  -9.736  -1.287   2.056
  549    HA   ALA  70           HA       ALA  70 -10.845  -0.714  -0.434
  550    HB1  ALA  70           1HB      ALA  70 -12.703  -2.097   0.239
  551    HB2  ALA  70           2HB      ALA  70 -12.219  -1.966   1.928
  552    HB3  ALA  70           3HB      ALA  70 -11.184  -2.810   0.778
  553    H    LYS  71           HN       LYS  71 -12.132   0.219   2.776
  554    HA   LYS  71           HA       LYS  71 -14.333   1.637   1.801
  555    HB2  LYS  71           2HB      LYS  71 -14.486   2.660   4.011
  556    HB3  LYS  71           1HB      LYS  71 -14.163   0.939   4.128
  557    HG2  LYS  71           2HG      LYS  71 -11.800   1.423   4.575
  558    HG3  LYS  71           1HG      LYS  71 -12.151   3.151   4.483
  559    HD2  LYS  71           2HD      LYS  71 -13.750   2.892   6.343
  560    HD3  LYS  71           1HD      LYS  71 -13.307   1.190   6.459
  561    HE2  LYS  71           2HE      LYS  71 -10.988   1.840   6.936
  562    HE3  LYS  71           1HE      LYS  71 -11.453   3.537   6.844
  563    HZ1  LYS  71           3HZ      LYS  71 -11.375   2.826   9.123
  564    HZ2  LYS  71           1HZ      LYS  71 -12.440   1.551   8.814
  565    HZ3  LYS  71           2HZ      LYS  71 -12.981   3.145   8.704
  566    H    ALA  72           HN       ALA  72 -11.020   2.636   2.117
  567    HA   ALA  72           HA       ALA  72 -11.730   5.417   1.593
  568    HB1  ALA  72           1HB      ALA  72  -9.041   4.173   2.163
  569    HB2  ALA  72           2HB      ALA  72 -10.083   4.966   3.344
  570    HB3  ALA  72           3HB      ALA  72  -9.377   5.899   2.024
  571    H    ARG  73           HN       ARG  73 -11.181   2.676  -0.159
  572    HA   ARG  73           HA       ARG  73 -10.611   2.167  -2.282
  573    HB2  ARG  73           2HB      ARG  73 -11.333   5.066  -2.574
  574    HB3  ARG  73           1HB      ARG  73 -10.715   4.169  -3.947
  575    HG2  ARG  73           2HG      ARG  73 -13.099   4.178  -4.059
  576    HG3  ARG  73           1HG      ARG  73 -12.571   2.546  -3.660
  577    HD2  ARG  73           2HD      ARG  73 -13.079   2.994  -1.286
  578    HD3  ARG  73           1HD      ARG  73 -13.658   4.598  -1.731
  579    HE   ARG  73           HE       ARG  73 -15.000   2.660  -3.262
  580   HH11  ARG  73          1HH1      ARG  73 -14.867   3.849   0.045
  581   HH12  ARG  73          2HH1      ARG  73 -16.502   3.408   0.395
  582   HH21  ARG  73          1HH2      ARG  73 -17.161   2.065  -2.769
  583   HH22  ARG  73          2HH2      ARG  73 -17.802   2.388  -1.198
  584    H    GLY  74           HN       GLY  74  -8.562   2.698  -0.457
  585    HA2  GLY  74           2HA      GLY  74  -6.250   2.513  -0.703
  586    HA3  GLY  74           1HA      GLY  74  -6.396   3.141  -2.338
  587    H    ASP  75           HN       ASP  75  -7.630   5.506  -1.999
  588    HA   ASP  75           HA       ASP  75  -5.510   7.196  -1.288
  589    HB2  ASP  75           2HB      ASP  75  -7.117   7.943  -2.896
  590    HB3  ASP  75           1HB      ASP  75  -8.432   7.793  -1.736
  591    H    LEU  76           HN       LEU  76  -4.836   8.007   0.561
  592    HA   LEU  76           HA       LEU  76  -6.513   7.723   2.945
  593    HB2  LEU  76           2HB      LEU  76  -3.582   8.253   2.535
  594    HB3  LEU  76           1HB      LEU  76  -4.349   8.476   4.093
  595    HG   LEU  76           HG       LEU  76  -4.289   5.866   2.589
  596   HD11  LEU  76          1HD1      LEU  76  -2.603   6.815   4.903
  597   HD12  LEU  76          2HD1      LEU  76  -2.041   6.544   3.254
  598   HD13  LEU  76          3HD1      LEU  76  -2.605   5.186   4.227
  599   HD21  LEU  76          3HD2      LEU  76  -4.989   4.934   4.755
  600   HD22  LEU  76          1HD2      LEU  76  -6.179   6.063   4.110
  601   HD23  LEU  76          2HD2      LEU  76  -5.101   6.568   5.411
  602    H    GLY  77           HN       GLY  77  -5.647  10.015   0.648
  603    HA2  GLY  77           2HA      GLY  77  -6.234  12.247   0.548
  604    HA3  GLY  77           1HA      GLY  77  -6.804  12.142   2.210
  605    H    ALA  78           HN       ALA  78  -5.670  14.296   2.222
  606    HA   ALA  78           HA       ALA  78  -2.795  14.220   2.274
  607    HB1  ALA  78           1HB      ALA  78  -2.942  16.577   2.888
  608    HB2  ALA  78           2HB      ALA  78  -4.684  16.419   3.112
  609    HB3  ALA  78           3HB      ALA  78  -3.982  16.221   1.507
  610    H    PHE  79           HN       PHE  79  -1.815  13.223   3.902
  611    HA   PHE  79           HA       PHE  79  -2.854  13.691   6.612
  612    HB2  PHE  79           2HB      PHE  79  -1.836  11.521   7.269
  613    HB3  PHE  79           1HB      PHE  79  -3.098  11.346   6.062
  614    HD1  PHE  79           1HD      PHE  79  -2.481  10.830   3.709
  615    HD2  PHE  79           2HD      PHE  79   0.398  10.842   6.846
  616    HE1  PHE  79           1HE      PHE  79  -0.946   9.527   2.300
  617    HE2  PHE  79           2HE      PHE  79   1.939   9.539   5.438
  618    HZ   PHE  79           HZ       PHE  79   1.269   8.881   3.162
  619    H    SER  80           HN       SER  80  -1.345  13.923   8.302
  620    HA   SER  80           HA       SER  80   1.026  15.355   7.452
  621    HB2  SER  80           2HB      SER  80  -0.519  16.331   9.136
  622    HB3  SER  80           1HB      SER  80  -0.144  14.995  10.222
  623    HG   SER  80           HG       SER  80   1.274  17.264   9.674
  624    H    ARG  81           HN       ARG  81   3.097  14.956   8.280
  625    HA   ARG  81           HA       ARG  81   3.762  12.189   8.540
  626    HB2  ARG  81           2HB      ARG  81   6.132  13.202   8.962
  627    HB3  ARG  81           1HB      ARG  81   5.410  13.310   7.368
  628    HG2  ARG  81           2HG      ARG  81   6.449  15.402   7.892
  629    HG3  ARG  81           1HG      ARG  81   4.703  15.632   7.892
  630    HD2  ARG  81           2HD      ARG  81   4.725  15.435  10.360
  631    HD3  ARG  81           1HD      ARG  81   6.483  15.311  10.305
  632    HE   ARG  81           HE       ARG  81   6.267  17.591   9.114
  633   HH11  ARG  81          1HH1      ARG  81   4.288  16.459  11.780
  634   HH12  ARG  81          2HH1      ARG  81   3.945  18.044  12.379
  635   HH21  ARG  81          1HH2      ARG  81   5.819  19.713   9.909
  636   HH22  ARG  81          2HH2      ARG  81   4.815  19.904  11.302
  637    H    GLY  82           HN       GLY  82   5.159  11.335  10.270
  638    HA2  GLY  82           2HA      GLY  82   5.690  11.023  12.503
  639    HA3  GLY  82           1HA      GLY  82   4.920  12.562  12.880
  640    H    GLN  83           HN       GLN  83   3.193  10.314  10.941
  641    HA   GLN  83           HA       GLN  83   1.559   9.494  13.251
  642    HB2  GLN  83           2HB      GLN  83   0.503  10.687  10.689
  643    HB3  GLN  83           1HB      GLN  83  -0.493   9.963  11.942
  644    HG2  GLN  83           2HG      GLN  83   0.204  11.674  13.516
  645    HG3  GLN  83           1HG      GLN  83   1.270  12.379  12.303
  646   HE21  GLN  83          1HE2      GLN  83  -0.613  11.961  10.135
  647   HE22  GLN  83          2HE2      GLN  83  -1.872  13.126  10.349
  648    H    MET  84           HN       MET  84   2.851   8.793  10.118
  649    HA   MET  84           HA       MET  84   1.327   6.273   9.982
  650    HB2  MET  84           2HB      MET  84   1.077   7.691   8.024
  651    HB3  MET  84           1HB      MET  84   2.814   7.851   7.866
  652    HG2  MET  84           2HG      MET  84   1.906   6.343   6.199
  653    HG3  MET  84           1HG      MET  84   2.995   5.494   7.292
  654    HE1  MET  84           3HE      MET  84  -1.611   5.166   7.446
  655    HE2  MET  84           1HE      MET  84  -0.727   6.178   6.306
  656    HE3  MET  84           2HE      MET  84  -0.745   6.589   8.021
  657    H    GLN  85           HN       GLN  85   2.561   4.344   9.212
  658    HA   GLN  85           HA       GLN  85   4.803   3.709  10.716
  659    HB2  GLN  85           2HB      GLN  85   4.152   2.612   7.969
  660    HB3  GLN  85           1HB      GLN  85   5.163   1.843   9.179
  661    HG2  GLN  85           2HG      GLN  85   3.211   1.616  10.645
  662    HG3  GLN  85           1HG      GLN  85   2.207   2.355   9.399
  663   HE21  GLN  85          1HE2      GLN  85   3.968  -0.468  10.355
  664   HE22  GLN  85          2HE2      GLN  85   3.337  -1.521   9.147
  665    H    LYS  86           HN       LYS  86   6.883   4.299  10.603
  666    HA   LYS  86           HA       LYS  86   7.754   6.398   9.093
  667    HB2  LYS  86           2HB      LYS  86   8.854   5.499  11.138
  668    HB3  LYS  86           1HB      LYS  86   9.583   4.249  10.139
  669    HG2  LYS  86           2HG      LYS  86  11.149   6.054  10.541
  670    HG3  LYS  86           1HG      LYS  86  10.732   5.970   8.827
  671    HD2  LYS  86           2HD      LYS  86   9.186   7.822   9.081
  672    HD3  LYS  86           1HD      LYS  86   9.476   7.861  10.819
  673    HE2  LYS  86           2HE      LYS  86  11.823   8.423  10.400
  674    HE3  LYS  86           1HE      LYS  86  11.515   8.402   8.665
  675    HZ1  LYS  86           3HZ      LYS  86  10.193  10.218  10.604
  676    HZ2  LYS  86           1HZ      LYS  86   9.999  10.237   8.927
  677    HZ3  LYS  86           2HZ      LYS  86  11.486  10.645   9.611
  678    HA   PRO  87           HA       PRO  87  10.030   3.366   5.923
  679    HB2  PRO  87           2HB      PRO  87   8.466   1.099   5.481
  680    HB3  PRO  87           1HB      PRO  87   9.974   1.135   6.400
  681    HG2  PRO  87           2HG      PRO  87   7.152   1.240   7.382
  682    HG3  PRO  87           1HG      PRO  87   8.543   0.377   8.060
  683    HD2  PRO  87           2HD      PRO  87   7.687   2.641   9.161
  684    HD3  PRO  87           1HD      PRO  87   9.428   2.310   9.018
  685    H    PHE  88           HN       PHE  88   6.537   3.433   6.358
  686    HA   PHE  88           HA       PHE  88   5.970   3.619   3.527
  687    HB2  PHE  88           2HB      PHE  88   4.452   2.454   5.139
  688    HB3  PHE  88           1HB      PHE  88   4.144   3.995   5.924
  689    HD1  PHE  88           1HD      PHE  88   3.095   5.854   4.434
  690    HD2  PHE  88           2HD      PHE  88   3.082   1.718   3.434
  691    HE1  PHE  88           1HE      PHE  88   1.195   6.233   2.919
  692    HE2  PHE  88           2HE      PHE  88   1.185   2.091   1.912
  693    HZ   PHE  88           HZ       PHE  88   0.241   4.349   1.654
  694    H    GLU  89           HN       GLU  89   5.792   5.691   6.366
  695    HA   GLU  89           HA       GLU  89   4.763   7.994   5.150
  696    HB2  GLU  89           2HB      GLU  89   4.784   7.503   7.574
  697    HB3  GLU  89           1HB      GLU  89   6.518   7.761   7.586
  698    HG2  GLU  89           2HG      GLU  89   6.207  10.072   6.957
  699    HG3  GLU  89           1HG      GLU  89   4.462   9.825   6.867
  700    H    ASP  90           HN       ASP  90   8.119   7.192   6.042
  701    HA   ASP  90           HA       ASP  90   9.238   9.561   5.010
  702    HB2  ASP  90           2HB      ASP  90  10.383   8.074   6.637
  703    HB3  ASP  90           1HB      ASP  90  10.604   6.889   5.358
  704    H    ALA  91           HN       ALA  91   8.280   6.611   3.497
  705    HA   ALA  91           HA       ALA  91   9.806   7.023   1.103
  706    HB1  ALA  91           1HB      ALA  91   8.500   5.171   0.188
  707    HB2  ALA  91           2HB      ALA  91   7.442   5.217   1.599
  708    HB3  ALA  91           3HB      ALA  91   9.139   4.773   1.783
  709    H    SER  92           HN       SER  92   6.373   7.328   1.959
  710    HA   SER  92           HA       SER  92   5.503   8.279  -0.523
  711    HB2  SER  92           2HB      SER  92   3.545   9.196   0.855
  712    HB3  SER  92           1HB      SER  92   3.842   7.462   0.937
  713    HG   SER  92           HG       SER  92   4.715   7.695   2.937
  714    H    PHE  93           HN       PHE  93   6.532  10.081   2.367
  715    HA   PHE  93           HA       PHE  93   6.038  12.635   1.234
  716    HB2  PHE  93           2HB      PHE  93   7.626  11.702   3.609
  717    HB3  PHE  93           1HB      PHE  93   7.665  13.388   3.106
  718    HD1  PHE  93           2HD      PHE  93   5.364  10.669   4.155
  719    HD2  PHE  93           1HD      PHE  93   5.976  14.855   3.751
  720    HE1  PHE  93           2HE      PHE  93   3.291  11.091   5.407
  721    HE2  PHE  93           1HE      PHE  93   3.904  15.284   4.999
  722    HZ   PHE  93           HZ       PHE  93   2.558  13.400   5.829
  723    H    ALA  94           HN       ALA  94   8.645  10.404   0.895
  724    HA   ALA  94           HA       ALA  94  10.526  12.396  -0.049
  725    HB1  ALA  94           1HB      ALA  94  12.053  10.549  -0.388
  726    HB2  ALA  94           2HB      ALA  94  10.754   9.390  -0.111
  727    HB3  ALA  94           3HB      ALA  94  11.308  10.424   1.204
  728    H    LEU  95           HN       LEU  95   8.014  10.542  -1.363
  729    HA   LEU  95           HA       LEU  95   9.054  10.354  -4.038
  730    HB2  LEU  95           2HB      LEU  95   6.227  10.049  -3.013
  731    HB3  LEU  95           1HB      LEU  95   6.765   9.648  -4.628
  732    HG   LEU  95           HG       LEU  95   7.611   8.267  -2.084
  733   HD11  LEU  95          1HD1      LEU  95   5.310   7.791  -2.747
  734   HD12  LEU  95          2HD1      LEU  95   6.348   6.382  -2.955
  735   HD13  LEU  95          3HD1      LEU  95   5.866   7.336  -4.358
  736   HD21  LEU  95          3HD2      LEU  95   8.720   6.663  -3.579
  737   HD22  LEU  95          1HD2      LEU  95   9.423   8.274  -3.705
  738   HD23  LEU  95          2HD2      LEU  95   8.329   7.690  -4.959
  739    H    ARG  96           HN       ARG  96   7.011  11.168  -5.631
  740    HA   ARG  96           HA       ARG  96   6.689  14.034  -5.073
  741    HB2  ARG  96           2HB      ARG  96   6.980  14.497  -7.468
  742    HB3  ARG  96           1HB      ARG  96   8.418  13.745  -6.796
  743    HG2  ARG  96           2HG      ARG  96   7.833  11.630  -7.782
  744    HG3  ARG  96           1HG      ARG  96   6.291  12.281  -8.341
  745    HD2  ARG  96           2HD      ARG  96   7.930  12.180 -10.150
  746    HD3  ARG  96           1HD      ARG  96   7.460  13.842  -9.796
  747    HE   ARG  96           HE       ARG  96   9.739  13.310  -8.306
  748   HH11  ARG  96          1HH1      ARG  96   8.854  13.449 -11.693
  749   HH12  ARG  96          2HH1      ARG  96  10.419  13.958 -12.216
  750   HH21  ARG  96          1HH2      ARG  96  11.811  13.982  -8.985
  751   HH22  ARG  96          2HH2      ARG  96  12.113  14.267 -10.667
  752    H    THR  97           HN       THR  97   4.925  14.936  -6.600
  753    HA   THR  97           HA       THR  97   2.537  13.529  -6.103
  754    HB   THR  97           HB       THR  97   3.144  15.869  -7.914
  755    HG1  THR  97           1HG      THR  97   2.192  15.547  -5.252
  756   HG21  THR  97          3HG2      THR  97   0.683  16.280  -7.864
  757   HG22  THR  97          1HG2      THR  97   0.474  14.697  -7.119
  758   HG23  THR  97          2HG2      THR  97   1.131  14.822  -8.749
  759    H    GLY  98           HN       GLY  98   1.794  11.794  -7.128
  760    HA2  GLY  98           2HA      GLY  98   1.116  10.504  -8.928
  761    HA3  GLY  98           1HA      GLY  98   1.978  11.590 -10.012
  762    H    GLU  99           HN       GLU  99   3.155   9.857  -7.173
  763    HA   GLU  99           HA       GLU  99   4.945   8.352  -8.947
  764    HB2  GLU  99           2HB      GLU  99   6.104  10.281  -7.877
  765    HB3  GLU  99           1HB      GLU  99   5.742   9.580  -6.310
  766    HG2  GLU  99           2HG      GLU  99   8.034   9.126  -7.047
  767    HG3  GLU  99           1HG      GLU  99   7.093   7.652  -6.816
  768    H    MET 100           HN       MET 100   5.576   6.316  -8.220
  769    HA   MET 100           HA       MET 100   4.091   5.283  -5.902
  770    HB2  MET 100           2HB      MET 100   2.982   4.555  -7.970
  771    HB3  MET 100           1HB      MET 100   4.501   3.898  -8.560
  772    HG2  MET 100           2HG      MET 100   4.516   2.240  -6.813
  773    HG3  MET 100           1HG      MET 100   3.073   2.943  -6.089
  774    HE1  MET 100           3HE      MET 100   3.102   0.872 -10.217
  775    HE2  MET 100           1HE      MET 100   4.545   1.150  -9.242
  776    HE3  MET 100           2HE      MET 100   3.699   2.512  -9.974
  777    H    SER 101           HN       SER 101   5.217   3.988  -4.553
  778    HA   SER 101           HA       SER 101   8.090   3.843  -4.961
  779    HB2  SER 101           2HB      SER 101   8.110   3.063  -2.613
  780    HB3  SER 101           1HB      SER 101   7.233   4.583  -2.792
  781    HG   SER 101           HG       SER 101   6.183   1.972  -2.445
  782    H    GLY 102           HN       GLY 102   8.953   1.672  -3.789
  783    HA2  GLY 102           2HA      GLY 102   7.929  -0.527  -5.404
  784    HA3  GLY 102           1HA      GLY 102   9.419  -0.522  -4.462
  785    HA   PRO 103           HA       PRO 103   6.196  -2.887  -2.074
  786    HB2  PRO 103           2HB      PRO 103   7.728  -5.072  -1.577
  787    HB3  PRO 103           1HB      PRO 103   6.762  -4.899  -3.047
  788    HG2  PRO 103           2HG      PRO 103   9.690  -4.446  -2.639
  789    HG3  PRO 103           1HG      PRO 103   8.855  -5.223  -3.996
  790    HD2  PRO 103           2HD      PRO 103   9.764  -2.659  -4.075
  791    HD3  PRO 103           1HD      PRO 103   8.354  -3.217  -4.997
  792    H    VAL 104           HN       VAL 104   6.092  -1.968  -0.115
  793    HA   VAL 104           HA       VAL 104   8.514  -1.665   1.497
  794    HB   VAL 104           HB       VAL 104   5.704  -0.684   2.059
  795   HG11  VAL 104          1HG1      VAL 104   8.331   0.023   3.364
  796   HG12  VAL 104          2HG1      VAL 104   7.037  -0.934   4.083
  797   HG13  VAL 104          3HG1      VAL 104   6.772   0.771   3.717
  798   HG21  VAL 104          3HG2      VAL 104   6.534   1.524   1.380
  799   HG22  VAL 104          1HG2      VAL 104   6.610   0.363   0.054
  800   HG23  VAL 104          2HG2      VAL 104   8.078   0.799   0.928
  801    H    PHE 105           HN       PHE 105   9.048  -3.240   2.853
  802    HA   PHE 105           HA       PHE 105   7.070  -5.233   3.615
  803    HB2  PHE 105           2HB      PHE 105  10.054  -5.139   4.094
  804    HB3  PHE 105           1HB      PHE 105   9.004  -6.493   4.487
  805    HD1  PHE 105           2HD      PHE 105   8.103  -7.914   2.739
  806    HD2  PHE 105           1HD      PHE 105  10.691  -4.666   1.820
  807    HE1  PHE 105           2HE      PHE 105   8.468  -8.841   0.492
  808    HE2  PHE 105           1HE      PHE 105  11.058  -5.590  -0.427
  809    HZ   PHE 105           HZ       PHE 105   9.949  -7.677  -1.093
  810    H    THR 106           HN       THR 106   5.923  -4.938   5.398
  811    HA   THR 106           HA       THR 106   7.310  -3.932   7.788
  812    HB   THR 106           HB       THR 106   5.181  -2.898   8.545
  813    HG1  THR 106           1HG      THR 106   4.285  -4.028   6.150
  814   HG21  THR 106          3HG2      THR 106   6.834  -1.495   7.407
  815   HG22  THR 106          1HG2      THR 106   5.195  -0.967   7.025
  816   HG23  THR 106          2HG2      THR 106   6.117  -1.902   5.848
  817    H    ASP 107           HN       ASP 107   5.896  -4.518   9.802
  818    HA   ASP 107           HA       ASP 107   5.768  -7.331   9.930
  819    HB2  ASP 107           2HB      ASP 107   4.868  -7.019  12.196
  820    HB3  ASP 107           1HB      ASP 107   6.251  -5.971  11.912
  821    H    SER 108           HN       SER 108   3.366  -4.895   9.304
  822    HA   SER 108           HA       SER 108   1.130  -6.668   9.621
  823    HB2  SER 108           2HB      SER 108   1.192  -3.974   8.265
  824    HB3  SER 108           1HB      SER 108  -0.207  -4.794   8.963
  825    HG   SER 108           HG       SER 108   1.520  -4.675  10.899
  826    H    GLY 109           HN       GLY 109   3.452  -6.379   7.262
  827    HA2  GLY 109           2HA      GLY 109   3.092  -8.086   5.457
  828    HA3  GLY 109           1HA      GLY 109   1.585  -7.236   5.145
  829    H    ILE 110           HN       ILE 110   2.439  -7.024   2.969
  830    HA   ILE 110           HA       ILE 110   4.611  -5.078   2.701
  831    HB   ILE 110           HB       ILE 110   3.243  -6.673   0.520
  832   HG12  ILE 110          2HG1      ILE 110   5.887  -7.202   1.902
  833   HG13  ILE 110          1HG1      ILE 110   4.409  -8.117   2.172
  834   HG21  ILE 110          1HG2      ILE 110   5.795  -5.057   0.541
  835   HG22  ILE 110          2HG2      ILE 110   4.303  -4.653  -0.309
  836   HG23  ILE 110          3HG2      ILE 110   5.245  -6.060  -0.799
  837   HD11  ILE 110          3HD1      ILE 110   5.920  -9.296   0.687
  838   HD12  ILE 110          1HD1      ILE 110   5.922  -7.925  -0.422
  839   HD13  ILE 110          2HD1      ILE 110   4.439  -8.844  -0.159
  840    H    HIS 111           HN       HIS 111   4.260  -3.049   2.057
  841    HA   HIS 111           HA       HIS 111   1.492  -2.285   1.379
  842    HB2  HIS 111           2HB      HIS 111   3.709  -0.689   2.663
  843    HB3  HIS 111           1HB      HIS 111   2.226   0.033   2.064
  844    HD1  HIS 111           1HD      HIS 111   0.108  -0.279   3.490
  845    HD2  HIS 111           2HD      HIS 111   3.482  -2.123   5.047
  846    HE1  HIS 111           1HE      HIS 111  -0.473  -0.843   5.860
  847    HE2  HIS 111           2HE      HIS 111   1.706  -1.603   6.841
  848    H    ILE 112           HN       ILE 112   1.092  -0.949  -0.324
  849    HA   ILE 112           HA       ILE 112   3.359  -0.260  -2.080
  850    HB   ILE 112           HB       ILE 112   0.459  -0.505  -2.903
  851   HG12  ILE 112          2HG1      ILE 112   2.693  -2.510  -3.304
  852   HG13  ILE 112          1HG1      ILE 112   1.311  -2.719  -2.237
  853   HG21  ILE 112          1HG2      ILE 112   2.987  -0.281  -4.534
  854   HG22  ILE 112          2HG2      ILE 112   1.776   0.980  -4.302
  855   HG23  ILE 112          3HG2      ILE 112   1.362  -0.487  -5.191
  856   HD11  ILE 112          3HD1      ILE 112   1.018  -3.967  -4.294
  857   HD12  ILE 112          1HD1      ILE 112   1.214  -2.491  -5.239
  858   HD13  ILE 112          2HD1      ILE 112  -0.180  -2.680  -4.178
  859    H    ILE 113           HN       ILE 113   3.531   1.887  -2.670
  860    HA   ILE 113           HA       ILE 113   1.612   3.706  -1.375
  861    HB   ILE 113           HB       ILE 113   4.542   4.175  -1.871
  862   HG12  ILE 113          2HG1      ILE 113   3.121   3.647   0.741
  863   HG13  ILE 113          1HG1      ILE 113   4.093   2.467  -0.129
  864   HG21  ILE 113          1HG2      ILE 113   2.531   5.816  -0.326
  865   HG22  ILE 113          2HG2      ILE 113   3.173   6.215  -1.918
  866   HG23  ILE 113          3HG2      ILE 113   4.246   6.182  -0.520
  867   HD11  ILE 113          3HD1      ILE 113   5.342   3.436   1.687
  868   HD12  ILE 113          1HD1      ILE 113   5.064   5.056   1.049
  869   HD13  ILE 113          2HD1      ILE 113   6.050   3.907   0.143
  870    H    LEU 114           HN       LEU 114   0.444   4.755  -2.812
  871    HA   LEU 114           HA       LEU 114   1.754   5.659  -5.286
  872    HB2  LEU 114           2HB      LEU 114  -0.010   4.010  -5.739
  873    HB3  LEU 114           1HB      LEU 114  -1.158   4.975  -4.837
  874    HG   LEU 114           HG       LEU 114  -0.918   6.782  -6.521
  875   HD11  LEU 114          1HD1      LEU 114   0.746   4.748  -7.992
  876   HD12  LEU 114          2HD1      LEU 114   1.312   6.280  -7.326
  877   HD13  LEU 114          3HD1      LEU 114   0.160   6.271  -8.659
  878   HD21  LEU 114          3HD2      LEU 114  -2.743   5.178  -6.685
  879   HD22  LEU 114          1HD2      LEU 114  -1.717   4.086  -7.616
  880   HD23  LEU 114          2HD2      LEU 114  -2.181   5.650  -8.288
  881    H    ARG 115           HN       ARG 115   2.352   7.677  -4.751
  882    HA   ARG 115           HA       ARG 115   0.722   9.320  -3.050
  883    HB2  ARG 115           2HB      ARG 115   3.126   9.496  -2.875
  884    HB3  ARG 115           1HB      ARG 115   3.254   9.936  -4.571
  885    HG2  ARG 115           2HG      ARG 115   2.195  12.038  -4.182
  886    HG3  ARG 115           1HG      ARG 115   1.782  11.584  -2.526
  887    HD2  ARG 115           2HD      ARG 115   4.068  11.601  -1.873
  888    HD3  ARG 115           1HD      ARG 115   4.607  11.756  -3.544
  889    HE   ARG 115           HE       ARG 115   3.044  13.965  -3.107
  890   HH11  ARG 115          1HH1      ARG 115   5.819  12.574  -1.463
  891   HH12  ARG 115          2HH1      ARG 115   6.541  14.104  -1.095
  892   HH21  ARG 115          1HH2      ARG 115   3.983  15.999  -2.595
  893   HH22  ARG 115          2HH2      ARG 115   5.487  16.063  -1.739
  894    H    THR 116           HN       THR 116  -1.009  10.263  -3.741
  895    HA   THR 116           HA       THR 116  -1.511  10.755  -6.508
  896    HB   THR 116           HB       THR 116  -3.153  11.744  -4.179
  897    HG1  THR 116           1HG      THR 116  -3.185   9.152  -5.389
  898   HG21  THR 116          3HG2      THR 116  -5.014  11.405  -5.750
  899   HG22  THR 116          1HG2      THR 116  -3.877  10.842  -6.977
  900   HG23  THR 116          2HG2      THR 116  -3.814  12.514  -6.417
  901    H    GLU 117           HN       GLU 117  -1.050  12.783  -3.603
  902    HA   GLU 117           HA       GLU 117  -0.236  14.999  -5.342
  903    HB2  GLU 117           2HB      GLU 117  -2.161  15.252  -3.016
  904    HB3  GLU 117           1HB      GLU 117  -1.452  16.594  -3.888
  905    HG2  GLU 117           2HG      GLU 117  -2.615  15.990  -5.895
  906    HG3  GLU 117           1HG      GLU 117  -3.219  14.512  -5.146
  Start of MODEL    4
    1    H1   GLY   1           1HT      GLY   1  12.078  26.249  -8.401
    2    H2   GLY   1           2HT      GLY   1  10.678  27.175  -8.225
    3    H3   GLY   1           3HT      GLY   1  11.050  26.475  -9.720
    4    HA2  GLY   1           1HA      GLY   1   9.303  25.253  -8.582
    5    HA3  GLY   1           2HA      GLY   1  10.747  24.281  -8.834
    6    H    SER   2           HN       SER   2   8.980  23.496  -6.950
    7    HA   SER   2           HA       SER   2   9.461  24.541  -4.372
    8    HB2  SER   2           2HB      SER   2   8.499  21.774  -5.120
    9    HB3  SER   2           1HB      SER   2   8.246  22.603  -3.585
   10    HG   SER   2           HG       SER   2   6.440  23.144  -4.548
   11    H    HIS   3           HN       HIS   3  11.403  24.491  -3.413
   12    HA   HIS   3           HA       HIS   3  13.243  22.305  -3.965
   13    HB2  HIS   3           2HB      HIS   3  14.082  24.648  -3.885
   14    HB3  HIS   3           1HB      HIS   3  13.635  24.726  -2.186
   15    HD1  HIS   3           1HD      HIS   3  15.748  22.315  -4.278
   16    HD2  HIS   3           2HD      HIS   3  15.833  24.359  -0.665
   17    HE1  HIS   3           1HE      HIS   3  17.925  21.693  -3.206
   18    HE2  HIS   3           2HE      HIS   3  18.039  23.087  -1.119
   19    H    MET   4           HN       MET   4  11.143  23.452  -1.458
   20    HA   MET   4           HA       MET   4  12.107  21.478   0.453
   21    HB2  MET   4           2HB      MET   4   9.931  23.564   0.598
   22    HB3  MET   4           1HB      MET   4  10.217  22.390   1.871
   23    HG2  MET   4           2HG      MET   4  12.488  23.278   2.146
   24    HG3  MET   4           1HG      MET   4  12.142  24.486   0.909
   25    HE1  MET   4           3HE      MET   4  13.178  25.134   3.871
   26    HE2  MET   4           1HE      MET   4  12.176  26.525   4.286
   27    HE3  MET   4           2HE      MET   4  12.874  26.390   2.672
   28    H    GLU   5           HN       GLU   5  10.425  20.102   1.537
   29    HA   GLU   5           HA       GLU   5   8.679  18.975  -0.505
   30    HB2  GLU   5           2HB      GLU   5   8.492  17.010   1.011
   31    HB3  GLU   5           1HB      GLU   5  10.145  17.342   0.529
   32    HG2  GLU   5           2HG      GLU   5   9.016  18.272   3.152
   33    HG3  GLU   5           1HG      GLU   5   9.747  16.685   2.943
   34    HA   PRO   6           HA       PRO   6   5.038  20.749   1.242
   35    HB2  PRO   6           2HB      PRO   6   3.726  18.142   0.695
   36    HB3  PRO   6           1HB      PRO   6   3.292  19.760   0.132
   37    HG2  PRO   6           2HG      PRO   6   4.407  18.001  -1.521
   38    HG3  PRO   6           1HG      PRO   6   4.836  19.720  -1.593
   39    HD2  PRO   6           2HD      PRO   6   6.357  17.434  -0.404
   40    HD3  PRO   6           1HD      PRO   6   6.949  18.826  -1.335
   41    H    ALA   7           HN       ALA   7   3.799  20.714   3.096
   42    HA   ALA   7           HA       ALA   7   4.790  19.059   5.229
   43    HB1  ALA   7           1HB      ALA   7   3.327  20.387   6.658
   44    HB2  ALA   7           2HB      ALA   7   2.568  21.104   5.235
   45    HB3  ALA   7           3HB      ALA   7   4.263  21.433   5.591
   46    H    ARG   8           HN       ARG   8   2.072  19.162   3.115
   47    HA   ARG   8           HA       ARG   8   0.981  16.769   4.428
   48    HB2  ARG   8           2HB      ARG   8  -0.520  19.045   3.140
   49    HB3  ARG   8           1HB      ARG   8  -1.249  17.499   3.533
   50    HG2  ARG   8           2HG      ARG   8  -0.750  17.875   5.900
   51    HG3  ARG   8           1HG      ARG   8  -0.054  19.447   5.488
   52    HD2  ARG   8           2HD      ARG   8  -2.170  20.211   4.630
   53    HD3  ARG   8           1HD      ARG   8  -2.881  18.617   4.867
   54    HE   ARG   8           HE       ARG   8  -1.892  19.611   7.316
   55   HH11  ARG   8          1HH1      ARG   8  -4.498  20.100   5.021
   56   HH12  ARG   8          2HH1      ARG   8  -5.607  20.690   6.208
   57   HH21  ARG   8          1HH2      ARG   8  -3.364  20.401   8.896
   58   HH22  ARG   8          2HH2      ARG   8  -4.966  20.857   8.414
   59    H    VAL   9           HN       VAL   9   0.874  15.056   3.158
   60    HA   VAL   9           HA       VAL   9   0.817  15.482   0.251
   61    HB   VAL   9           HB       VAL   9   2.120  13.401  -0.044
   62   HG11  VAL   9          1HG1      VAL   9   3.497  15.476   1.655
   63   HG12  VAL   9          2HG1      VAL   9   3.290  15.523  -0.096
   64   HG13  VAL   9          3HG1      VAL   9   4.307  14.283   0.639
   65   HG21  VAL   9          3HG2      VAL   9   3.301  12.398   1.853
   66   HG22  VAL   9          1HG2      VAL   9   1.553  12.294   2.059
   67   HG23  VAL   9          2HG2      VAL   9   2.476  13.502   2.953
   68    H    ARG  10           HN       ARG  10  -0.499  14.119  -0.937
   69    HA   ARG  10           HA       ARG  10  -2.392  12.583   0.695
   70    HB2  ARG  10           2HB      ARG  10  -3.314  14.372  -0.774
   71    HB3  ARG  10           1HB      ARG  10  -2.665  13.503  -2.160
   72    HG2  ARG  10           2HG      ARG  10  -4.082  11.606  -1.673
   73    HG3  ARG  10           1HG      ARG  10  -4.720  12.434  -0.252
   74    HD2  ARG  10           2HD      ARG  10  -5.633  14.189  -1.679
   75    HD3  ARG  10           1HD      ARG  10  -4.975  13.381  -3.103
   76    HE   ARG  10           HE       ARG  10  -6.578  11.575  -1.666
   77   HH11  ARG  10          1HH1      ARG  10  -6.908  14.466  -3.650
   78   HH12  ARG  10          2HH1      ARG  10  -8.489  14.054  -4.212
   79   HH21  ARG  10          1HH2      ARG  10  -8.686  11.046  -2.418
   80   HH22  ARG  10          2HH2      ARG  10  -9.502  12.110  -3.512
   81    H    CYS  11           HN       CYS  11  -1.783  10.537   0.855
   82    HA   CYS  11           HA       CYS  11  -0.809   9.231  -1.580
   83    HB2  CYS  11           2HB      CYS  11   0.107   8.683   1.241
   84    HB3  CYS  11           1HB      CYS  11   0.662   7.851  -0.207
   85    HG   CYS  11           HG       CYS  11   1.783  10.623   1.152
   86    H    SER  12           HN       SER  12  -1.587   7.301  -2.092
   87    HA   SER  12           HA       SER  12  -3.750   6.235  -0.448
   88    HB2  SER  12           2HB      SER  12  -2.940   5.532  -3.283
   89    HB3  SER  12           1HB      SER  12  -4.416   5.033  -2.453
   90    HG   SER  12           HG       SER  12  -3.902   7.760  -2.583
   91    H    HIS  13           HN       HIS  13  -3.644   4.160   0.379
   92    HA   HIS  13           HA       HIS  13  -1.047   2.814   0.042
   93    HB2  HIS  13           2HB      HIS  13  -0.977   2.229   2.369
   94    HB3  HIS  13           1HB      HIS  13  -1.255   3.959   2.254
   95    HD1  HIS  13           1HD      HIS  13  -2.159   1.461   4.410
   96    HD2  HIS  13           2HD      HIS  13  -4.456   4.147   2.228
   97    HE1  HIS  13           1HE      HIS  13  -4.364   1.580   5.592
   98    HE2  HIS  13           2HE      HIS  13  -5.635   3.381   4.394
   99    H    LEU  14           HN       LEU  14  -1.024   0.714  -0.316
  100    HA   LEU  14           HA       LEU  14  -3.538  -0.804  -0.036
  101    HB2  LEU  14           2HB      LEU  14  -2.687  -0.351  -2.415
  102    HB3  LEU  14           1HB      LEU  14  -1.322  -1.370  -2.022
  103    HG   LEU  14           HG       LEU  14  -4.162  -2.382  -1.887
  104   HD11  LEU  14          1HD1      LEU  14  -2.266  -2.487  -4.230
  105   HD12  LEU  14          2HD1      LEU  14  -3.763  -1.561  -4.144
  106   HD13  LEU  14          3HD1      LEU  14  -3.814  -3.324  -4.117
  107   HD21  LEU  14          3HD2      LEU  14  -3.090  -4.569  -2.138
  108   HD22  LEU  14          1HD2      LEU  14  -2.479  -3.723  -0.717
  109   HD23  LEU  14          2HD2      LEU  14  -1.507  -3.793  -2.187
  110    H    LEU  15           HN       LEU  15  -3.384  -2.427   1.416
  111    HA   LEU  15           HA       LEU  15  -0.675  -3.310   2.148
  112    HB2  LEU  15           2HB      LEU  15  -1.566  -2.054   3.972
  113    HB3  LEU  15           1HB      LEU  15  -3.092  -2.909   3.898
  114    HG   LEU  15           HG       LEU  15  -1.998  -4.957   4.700
  115   HD11  LEU  15          1HD1      LEU  15   0.484  -3.260   4.880
  116   HD12  LEU  15          2HD1      LEU  15   0.221  -4.612   3.778
  117   HD13  LEU  15          3HD1      LEU  15   0.303  -4.894   5.516
  118   HD21  LEU  15          3HD2      LEU  15  -1.550  -4.226   6.979
  119   HD22  LEU  15          1HD2      LEU  15  -2.959  -3.398   6.318
  120   HD23  LEU  15          2HD2      LEU  15  -1.413  -2.558   6.425
  121    H    VAL  16           HN       VAL  16  -0.232  -5.336   1.844
  122    HA   VAL  16           HA       VAL  16  -2.441  -7.268   1.643
  123    HB   VAL  16           HB       VAL  16  -1.130  -6.904  -0.474
  124   HG11  VAL  16          1HG1      VAL  16   1.122  -8.083   1.133
  125   HG12  VAL  16          2HG1      VAL  16   1.044  -6.472   0.421
  126   HG13  VAL  16          3HG1      VAL  16   1.127  -7.893  -0.620
  127   HG21  VAL  16          3HG2      VAL  16  -0.808  -9.284  -0.985
  128   HG22  VAL  16          1HG2      VAL  16  -2.322  -8.988  -0.130
  129   HG23  VAL  16          2HG2      VAL  16  -0.939  -9.659   0.734
  130    H    LYS  17           HN       LYS  17  -2.326  -9.099   2.860
  131    HA   LYS  17           HA       LYS  17  -0.197  -9.132   4.878
  132    HB2  LYS  17           2HB      LYS  17  -2.945 -10.382   4.885
  133    HB3  LYS  17           1HB      LYS  17  -1.763 -10.572   6.173
  134    HG2  LYS  17           2HG      LYS  17  -1.804  -8.193   6.611
  135    HG3  LYS  17           1HG      LYS  17  -2.915  -7.942   5.265
  136    HD2  LYS  17           2HD      LYS  17  -4.591  -9.328   6.402
  137    HD3  LYS  17           1HD      LYS  17  -3.473  -9.565   7.748
  138    HE2  LYS  17           2HE      LYS  17  -4.559  -6.907   6.817
  139    HE3  LYS  17           1HE      LYS  17  -5.142  -7.817   8.211
  140    HZ1  LYS  17           3HZ      LYS  17  -3.585  -6.047   8.814
  141    HZ2  LYS  17           1HZ      LYS  17  -2.368  -6.791   7.908
  142    HZ3  LYS  17           2HZ      LYS  17  -3.015  -7.564   9.266
  143    H    HIS  18           HN       HIS  18  -0.079 -11.566   5.803
  144    HA   HIS  18           HA       HIS  18   0.431 -13.368   3.526
  145    HB2  HIS  18           2HB      HIS  18   2.327 -12.954   5.860
  146    HB3  HIS  18           1HB      HIS  18   2.561 -14.049   4.510
  147    HD1  HIS  18           1HD      HIS  18   3.272 -10.662   5.662
  148    HD2  HIS  18           2HD      HIS  18   3.100 -12.639   2.012
  149    HE1  HIS  18           1HE      HIS  18   4.558  -9.243   4.078
  150    HE2  HIS  18           2HE      HIS  18   4.683 -10.592   1.966
  151    H    SER  19           HN       SER  19   0.954 -15.625   4.474
  152    HA   SER  19           HA       SER  19  -0.988 -16.262   6.508
  153    HB2  SER  19           2HB      SER  19  -0.536 -17.738   4.507
  154    HB3  SER  19           1HB      SER  19   1.056 -18.079   5.184
  155    HG   SER  19           HG       SER  19  -0.108 -18.843   7.083
  156    H    GLN  20           HN       GLN  20   1.795 -14.785   6.694
  157    HA   GLN  20           HA       GLN  20   2.718 -16.138   9.134
  158    HB2  GLN  20           2HB      GLN  20   4.314 -14.604   7.086
  159    HB3  GLN  20           1HB      GLN  20   4.955 -15.171   8.620
  160    HG2  GLN  20           2HG      GLN  20   4.657 -17.450   7.980
  161    HG3  GLN  20           1HG      GLN  20   3.783 -16.976   6.524
  162   HE21  GLN  20          1HE2      GLN  20   6.886 -17.136   8.076
  163   HE22  GLN  20          2HE2      GLN  20   7.826 -16.905   6.645
  164    H    SER  21           HN       SER  21   1.146 -13.437   8.003
  165    HA   SER  21           HA       SER  21   2.394 -11.521   9.751
  166    HB2  SER  21           2HB      SER  21   0.327 -10.129   9.031
  167    HB3  SER  21           1HB      SER  21   1.550 -10.507   7.819
  168    HG   SER  21           HG       SER  21  -0.866 -11.950   8.238
  169    H    ARG  22           HN       ARG  22   1.126 -10.334  11.378
  170    HA   ARG  22           HA       ARG  22   0.268 -11.951  13.436
  171    HB2  ARG  22           2HB      ARG  22  -0.516  -9.086  12.902
  172    HB3  ARG  22           1HB      ARG  22  -0.755  -9.918  14.429
  173    HG2  ARG  22           2HG      ARG  22   1.878  -9.283  13.118
  174    HG3  ARG  22           1HG      ARG  22   1.194  -8.517  14.552
  175    HD2  ARG  22           2HD      ARG  22   2.051 -11.396  14.283
  176    HD3  ARG  22           1HD      ARG  22   2.883 -10.133  15.182
  177    HE   ARG  22           HE       ARG  22   0.307 -10.287  16.208
  178   HH11  ARG  22          1HH1      ARG  22   3.107 -12.364  15.926
  179   HH12  ARG  22          2HH1      ARG  22   2.792 -13.237  17.383
  180   HH21  ARG  22          1HH2      ARG  22  -0.139 -11.443  18.154
  181   HH22  ARG  22          2HH2      ARG  22   0.930 -12.708  18.656
  182    H    ARG  23           HN       ARG  23  -1.739 -10.351  11.003
  183    HA   ARG  23           HA       ARG  23  -3.987 -11.973  11.967
  184    HB2  ARG  23           2HB      ARG  23  -4.308  -9.492  12.027
  185    HB3  ARG  23           1HB      ARG  23  -4.122  -9.468  10.279
  186    HG2  ARG  23           2HG      ARG  23  -6.466  -9.376  10.903
  187    HG3  ARG  23           1HG      ARG  23  -6.111 -10.880  10.050
  188    HD2  ARG  23           2HD      ARG  23  -7.569 -11.230  12.006
  189    HD3  ARG  23           1HD      ARG  23  -6.036 -12.088  12.144
  190    HE   ARG  23           HE       ARG  23  -6.472  -9.494  13.466
  191   HH11  ARG  23          1HH1      ARG  23  -5.636 -12.902  13.639
  192   HH12  ARG  23          2HH1      ARG  23  -5.039 -12.807  15.256
  193   HH21  ARG  23          1HH2      ARG  23  -5.720  -9.378  15.639
  194   HH22  ARG  23          2HH2      ARG  23  -5.099 -10.798  16.402
  195    HA   PRO  24           HA       PRO  24  -3.114 -13.876   7.928
  196    HB2  PRO  24           2HB      PRO  24  -3.627 -16.394   8.641
  197    HB3  PRO  24           1HB      PRO  24  -2.130 -15.598   9.149
  198    HG2  PRO  24           2HG      PRO  24  -4.636 -16.094  10.705
  199    HG3  PRO  24           1HG      PRO  24  -2.947 -16.231  11.226
  200    HD2  PRO  24           2HD      PRO  24  -4.588 -14.054  11.722
  201    HD3  PRO  24           1HD      PRO  24  -2.815 -14.015  11.746
  202    H    SER  25           HN       SER  25  -5.538 -12.498   8.576
  203    HA   SER  25           HA       SER  25  -7.448 -14.113   7.091
  204    HB2  SER  25           2HB      SER  25  -7.918 -14.513   9.517
  205    HB3  SER  25           1HB      SER  25  -8.157 -12.780   9.722
  206    HG   SER  25           HG       SER  25  -9.744 -14.678   8.409
  207    H    SER  26           HN       SER  26  -8.764 -12.854   5.774
  208    HA   SER  26           HA       SER  26  -8.334  -9.945   5.941
  209    HB2  SER  26           2HB      SER  26  -8.529  -9.866   3.523
  210    HB3  SER  26           1HB      SER  26  -7.282 -11.032   3.955
  211    H    TRP  27           HN       TRP  27 -10.178  -9.016   4.286
  212    HA   TRP  27           HA       TRP  27 -12.708  -9.845   5.474
  213    HB2  TRP  27           2HB      TRP  27 -13.589  -7.741   4.718
  214    HB3  TRP  27           1HB      TRP  27 -12.009  -7.406   5.414
  215    HD1  TRP  27           1HD      TRP  27  -9.954  -7.358   3.362
  216    HE1  TRP  27           1HE      TRP  27 -10.081  -6.122   1.122
  217    HE3  TRP  27           3HE      TRP  27 -15.027  -6.842   3.028
  218    HZ2  TRP  27           2HZ      TRP  27 -12.084  -5.057  -0.575
  219    HZ3  TRP  27           3HZ      TRP  27 -15.966  -5.696   1.066
  220    HH2  TRP  27           2HH      TRP  27 -14.523  -4.821  -0.695
  221    H    ARG  28           HN       ARG  28 -10.831 -10.611   2.924
  222    HA   ARG  28           HA       ARG  28 -12.993 -10.950   0.975
  223    HB2  ARG  28           2HB      ARG  28  -9.991 -11.223   0.729
  224    HB3  ARG  28           1HB      ARG  28 -11.123 -11.554  -0.573
  225    HG2  ARG  28           2HG      ARG  28 -10.905  -8.888   0.798
  226    HG3  ARG  28           1HG      ARG  28 -10.007  -9.318  -0.659
  227    HD2  ARG  28           2HD      ARG  28 -13.011  -9.328  -0.384
  228    HD3  ARG  28           1HD      ARG  28 -12.062  -8.065  -1.165
  229    HE   ARG  28           HE       ARG  28 -11.397 -10.488  -2.370
  230   HH11  ARG  28          1HH1      ARG  28 -14.199  -8.402  -2.080
  231   HH12  ARG  28          2HH1      ARG  28 -14.874  -8.875  -3.601
  232   HH21  ARG  28          1HH2      ARG  28 -12.294 -11.126  -4.384
  233   HH22  ARG  28          2HH2      ARG  28 -13.789 -10.434  -4.912
  234    H    GLN  29           HN       GLN  29 -10.558 -12.697   2.820
  235    HA   GLN  29           HA       GLN  29 -12.100 -15.143   2.391
  236    HB2  GLN  29           2HB      GLN  29 -10.143 -15.074   0.834
  237    HB3  GLN  29           1HB      GLN  29  -9.086 -14.988   2.231
  238    HG2  GLN  29           2HG      GLN  29  -9.226 -17.238   1.282
  239    HG3  GLN  29           1HG      GLN  29  -9.786 -17.173   2.951
  240   HE21  GLN  29          1HE2      GLN  29 -10.941 -19.069   2.685
  241   HE22  GLN  29          2HE2      GLN  29 -12.432 -19.127   1.807
  242    H    GLU  30           HN       GLU  30 -12.026 -16.594   4.121
  243    HA   GLU  30           HA       GLU  30 -11.869 -15.470   6.668
  244    HB2  GLU  30           2HB      GLU  30 -12.168 -17.764   7.515
  245    HB3  GLU  30           1HB      GLU  30 -13.290 -17.369   6.222
  246    HG2  GLU  30           2HG      GLU  30 -11.965 -18.633   4.642
  247    HG3  GLU  30           1HG      GLU  30 -10.759 -18.961   5.885
  248    H    LYS  31           HN       LYS  31  -9.388 -16.968   4.765
  249    HA   LYS  31           HA       LYS  31  -7.473 -16.297   6.810
  250    HB2  LYS  31           2HB      LYS  31  -6.426 -18.481   6.902
  251    HB3  LYS  31           1HB      LYS  31  -8.095 -18.580   7.438
  252    HG2  LYS  31           2HG      LYS  31  -8.716 -19.461   5.207
  253    HG3  LYS  31           1HG      LYS  31  -7.007 -19.451   4.768
  254    HD2  LYS  31           2HD      LYS  31  -8.223 -20.998   7.059
  255    HD3  LYS  31           1HD      LYS  31  -7.758 -21.676   5.500
  256    HE2  LYS  31           2HE      LYS  31  -5.443 -21.172   5.907
  257    HE3  LYS  31           1HE      LYS  31  -5.848 -20.283   7.374
  258    HZ1  LYS  31           3HZ      LYS  31  -5.015 -22.492   7.868
  259    HZ2  LYS  31           1HZ      LYS  31  -6.261 -23.190   6.963
  260    HZ3  LYS  31           2HZ      LYS  31  -6.620 -22.329   8.369
  261    H    ILE  32           HN       ILE  32  -5.372 -16.145   6.070
  262    HA   ILE  32           HA       ILE  32  -5.143 -15.789   3.191
  263    HB   ILE  32           HB       ILE  32  -3.146 -15.169   5.384
  264   HG12  ILE  32          2HG1      ILE  32  -5.155 -13.811   5.646
  265   HG13  ILE  32          1HG1      ILE  32  -3.821 -12.818   5.072
  266   HG21  ILE  32          1HG2      ILE  32  -3.210 -14.326   2.493
  267   HG22  ILE  32          2HG2      ILE  32  -2.099 -15.491   3.213
  268   HG23  ILE  32          3HG2      ILE  32  -2.033 -13.795   3.695
  269   HD11  ILE  32          3HD1      ILE  32  -5.817 -12.200   3.925
  270   HD12  ILE  32          1HD1      ILE  32  -6.119 -13.870   3.445
  271   HD13  ILE  32          2HD1      ILE  32  -4.737 -12.997   2.784
  272    H    THR  33           HN       THR  33  -4.262 -17.310   1.942
  273    HA   THR  33           HA       THR  33  -2.779 -19.464   3.253
  274    HB   THR  33           HB       THR  33  -3.212 -20.689   1.070
  275    HG1  THR  33           1HG      THR  33  -3.783 -18.986  -0.272
  276   HG21  THR  33          3HG2      THR  33  -5.585 -19.820   2.729
  277   HG22  THR  33          1HG2      THR  33  -4.490 -21.149   3.106
  278   HG23  THR  33          2HG2      THR  33  -5.531 -21.239   1.686
  279    H    ARG  34           HN       ARG  34  -2.303 -16.738   1.355
  280    HA   ARG  34           HA       ARG  34  -0.120 -17.733  -0.212
  281    HB2  ARG  34           2HB      ARG  34   0.119 -15.527  -1.048
  282    HB3  ARG  34           1HB      ARG  34  -1.606 -15.754  -0.820
  283    HG2  ARG  34           2HG      ARG  34  -1.351 -14.570   1.390
  284    HG3  ARG  34           1HG      ARG  34   0.288 -14.164   0.882
  285    HD2  ARG  34           2HD      ARG  34  -0.907 -12.295   0.239
  286    HD3  ARG  34           1HD      ARG  34  -0.867 -13.248  -1.243
  287    HE   ARG  34           HE       ARG  34  -3.150 -13.868  -0.855
  288   HH11  ARG  34          1HH1      ARG  34  -1.917 -11.405   1.318
  289   HH12  ARG  34          2HH1      ARG  34  -3.479 -10.742   1.671
  290   HH21  ARG  34          1HH2      ARG  34  -5.259 -12.998  -0.317
  291   HH22  ARG  34          2HH2      ARG  34  -5.354 -11.656   0.788
  292    H    THR  35           HN       THR  35   1.960 -17.882   0.335
  293    HA   THR  35           HA       THR  35   2.719 -17.180   3.019
  294    HB   THR  35           HB       THR  35   3.493 -19.313   1.998
  295    HG1  THR  35           1HG      THR  35   5.954 -18.446   2.337
  296   HG21  THR  35          3HG2      THR  35   5.372 -19.228   0.373
  297   HG22  THR  35          1HG2      THR  35   5.094 -17.496   0.201
  298   HG23  THR  35          2HG2      THR  35   3.842 -18.645  -0.277
  299    H    LYS  36           HN       LYS  36   5.278 -16.368   2.913
  300    HA   LYS  36           HA       LYS  36   5.098 -13.617   2.624
  301    HB2  LYS  36           2HB      LYS  36   6.767 -14.823   3.992
  302    HB3  LYS  36           1HB      LYS  36   7.609 -15.285   2.523
  303    HG2  LYS  36           2HG      LYS  36   7.942 -12.876   2.030
  304    HG3  LYS  36           1HG      LYS  36   7.244 -12.505   3.608
  305    HD2  LYS  36           2HD      LYS  36   9.719 -14.154   3.089
  306    HD3  LYS  36           1HD      LYS  36   9.676 -12.507   3.720
  307    HE2  LYS  36           2HE      LYS  36   8.433 -13.315   5.682
  308    HE3  LYS  36           1HE      LYS  36   8.529 -14.957   5.050
  309    HZ1  LYS  36           3HZ      LYS  36  10.227 -14.525   6.710
  310    HZ2  LYS  36           1HZ      LYS  36  10.854 -13.267   5.774
  311    HZ3  LYS  36           2HZ      LYS  36  10.921 -14.856   5.207
  312    H    GLU  37           HN       GLU  37   7.002 -15.779   0.521
  313    HA   GLU  37           HA       GLU  37   7.720 -13.796  -1.324
  314    HB2  GLU  37           2HB      GLU  37   7.536 -16.773  -1.769
  315    HB3  GLU  37           1HB      GLU  37   8.439 -15.632  -2.759
  316    HG2  GLU  37           2HG      GLU  37   8.963 -16.221   0.145
  317    HG3  GLU  37           1HG      GLU  37   9.880 -16.860  -1.215
  318    H    GLU  38           HN       GLU  38   4.885 -15.828  -1.180
  319    HA   GLU  38           HA       GLU  38   4.001 -15.552  -3.826
  320    HB2  GLU  38           2HB      GLU  38   2.483 -15.971  -1.264
  321    HB3  GLU  38           1HB      GLU  38   1.725 -16.001  -2.850
  322    HG2  GLU  38           2HG      GLU  38   3.959 -17.800  -1.974
  323    HG3  GLU  38           1HG      GLU  38   2.247 -18.237  -1.983
  324    H    ALA  39           HN       ALA  39   3.174 -13.659  -0.942
  325    HA   ALA  39           HA       ALA  39   1.460 -11.862  -2.262
  326    HB1  ALA  39           1HB      ALA  39   1.643 -10.467  -0.294
  327    HB2  ALA  39           2HB      ALA  39   3.066 -11.363   0.234
  328    HB3  ALA  39           3HB      ALA  39   1.495 -12.161   0.175
  329    H    LEU  40           HN       LEU  40   4.929 -11.896  -1.823
  330    HA   LEU  40           HA       LEU  40   5.432  -9.231  -2.589
  331    HB2  LEU  40           2HB      LEU  40   7.061 -10.733  -1.445
  332    HB3  LEU  40           1HB      LEU  40   7.219 -11.652  -2.924
  333    HG   LEU  40           HG       LEU  40   9.066  -9.970  -2.336
  334   HD11  LEU  40          1HD1      LEU  40   9.446  -9.380  -4.663
  335   HD12  LEU  40          2HD1      LEU  40   7.786  -9.835  -5.051
  336   HD13  LEU  40          3HD1      LEU  40   8.929 -11.056  -4.494
  337   HD21  LEU  40          3HD2      LEU  40   8.707  -7.672  -3.041
  338   HD22  LEU  40          1HD2      LEU  40   7.603  -8.104  -1.737
  339   HD23  LEU  40          2HD2      LEU  40   7.019  -8.030  -3.401
  340    H    GLU  41           HN       GLU  41   5.352 -12.256  -4.440
  341    HA   GLU  41           HA       GLU  41   5.890 -11.059  -6.940
  342    HB2  GLU  41           2HB      GLU  41   4.626 -13.673  -6.158
  343    HB3  GLU  41           1HB      GLU  41   4.839 -13.202  -7.840
  344    HG2  GLU  41           2HG      GLU  41   7.098 -13.320  -5.865
  345    HG3  GLU  41           1HG      GLU  41   6.627 -14.679  -6.884
  346    H    LEU  42           HN       LEU  42   2.953 -11.554  -5.110
  347    HA   LEU  42           HA       LEU  42   1.150 -10.874  -7.184
  348    HB2  LEU  42           2HB      LEU  42   0.884 -10.610  -4.188
  349    HB3  LEU  42           1HB      LEU  42  -0.424 -10.316  -5.315
  350    HG   LEU  42           HG       LEU  42   0.971 -12.957  -4.874
  351   HD11  LEU  42          1HD1      LEU  42  -1.816 -12.052  -4.174
  352   HD12  LEU  42          2HD1      LEU  42  -0.493 -12.291  -3.034
  353   HD13  LEU  42          3HD1      LEU  42  -1.151 -13.666  -3.924
  354   HD21  LEU  42          3HD2      LEU  42  -0.777 -13.866  -6.349
  355   HD22  LEU  42          1HD2      LEU  42   0.278 -12.732  -7.190
  356   HD23  LEU  42          2HD2      LEU  42  -1.334 -12.227  -6.683
  357    H    ILE  43           HN       ILE  43   2.797  -8.985  -4.691
  358    HA   ILE  43           HA       ILE  43   1.698  -6.483  -5.286
  359    HB   ILE  43           HB       ILE  43   4.441  -7.180  -4.218
  360   HG12  ILE  43          2HG1      ILE  43   2.541  -7.857  -2.805
  361   HG13  ILE  43          1HG1      ILE  43   3.498  -6.592  -2.049
  362   HG21  ILE  43          1HG2      ILE  43   3.097  -4.479  -4.312
  363   HG22  ILE  43          2HG2      ILE  43   4.523  -4.968  -5.228
  364   HG23  ILE  43          3HG2      ILE  43   4.603  -4.848  -3.469
  365   HD11  ILE  43          3HD1      ILE  43   1.836  -4.938  -2.714
  366   HD12  ILE  43          1HD1      ILE  43   1.126  -6.210  -1.728
  367   HD13  ILE  43          2HD1      ILE  43   0.873  -6.207  -3.470
  368    H    ASN  44           HN       ASN  44   4.670  -8.012  -6.495
  369    HA   ASN  44           HA       ASN  44   5.426  -6.043  -8.313
  370    HB2  ASN  44           2HB      ASN  44   5.736  -9.047  -8.470
  371    HB3  ASN  44           1HB      ASN  44   6.492  -7.935  -9.605
  372   HD21  ASN  44          1HD2      ASN  44   7.730  -9.809  -7.777
  373   HD22  ASN  44          2HD2      ASN  44   8.750  -8.865  -6.749
  374    H    GLY  45           HN       GLY  45   3.206  -8.763  -8.709
  375    HA2  GLY  45           2HA      GLY  45   2.586  -8.416 -11.411
  376    HA3  GLY  45           1HA      GLY  45   1.528  -9.150 -10.213
  377    H    TYR  46           HN       TYR  46   0.932  -7.108  -8.531
  378    HA   TYR  46           HA       TYR  46  -1.074  -5.679  -9.833
  379    HB2  TYR  46           2HB      TYR  46   0.381  -4.797  -7.323
  380    HB3  TYR  46           1HB      TYR  46  -1.206  -4.256  -7.843
  381    HD1  TYR  46           2HD      TYR  46  -2.284  -7.021  -8.644
  382    HD2  TYR  46           1HD      TYR  46  -0.175  -5.649  -5.215
  383    HE1  TYR  46           2HE      TYR  46  -3.290  -8.826  -7.305
  384    HE2  TYR  46           1HE      TYR  46  -1.170  -7.447  -3.871
  385    HH   TYR  46           HH       TYR  46  -3.107  -8.905  -3.892
  386    H    ILE  47           HN       ILE  47   2.145  -4.587  -8.822
  387    HA   ILE  47           HA       ILE  47   2.006  -1.978  -9.795
  388    HB   ILE  47           HB       ILE  47   4.441  -3.760  -9.558
  389   HG12  ILE  47          2HG1      ILE  47   3.339  -1.670  -7.664
  390   HG13  ILE  47          1HG1      ILE  47   3.177  -3.409  -7.453
  391   HG21  ILE  47          1HG2      ILE  47   5.725  -1.648  -9.489
  392   HG22  ILE  47          2HG2      ILE  47   4.249  -0.764  -9.876
  393   HG23  ILE  47          3HG2      ILE  47   4.923  -1.905 -11.038
  394   HD11  ILE  47          3HD1      ILE  47   4.946  -2.526  -6.059
  395   HD12  ILE  47          1HD1      ILE  47   5.756  -1.860  -7.478
  396   HD13  ILE  47          2HD1      ILE  47   5.607  -3.607  -7.287
  397    H    GLN  48           HN       GLN  48   3.211  -4.920 -11.398
  398    HA   GLN  48           HA       GLN  48   3.978  -3.698 -13.802
  399    HB2  GLN  48           2HB      GLN  48   3.024  -6.520 -13.294
  400    HB3  GLN  48           1HB      GLN  48   3.708  -5.977 -14.818
  401    HG2  GLN  48           2HG      GLN  48   5.094  -6.095 -12.147
  402    HG3  GLN  48           1HG      GLN  48   5.389  -7.122 -13.549
  403   HE21  GLN  48          1HE2      GLN  48   5.943  -4.036 -12.088
  404   HE22  GLN  48          2HE2      GLN  48   7.094  -3.460 -13.238
  405    H    LYS  49           HN       LYS  49   0.874  -5.119 -12.836
  406    HA   LYS  49           HA       LYS  49  -0.381  -4.719 -15.331
  407    HB2  LYS  49           2HB      LYS  49  -1.559  -5.032 -12.569
  408    HB3  LYS  49           1HB      LYS  49  -2.510  -5.012 -14.047
  409    HG2  LYS  49           2HG      LYS  49  -1.264  -6.984 -14.843
  410    HG3  LYS  49           1HG      LYS  49  -0.392  -7.020 -13.311
  411    HD2  LYS  49           2HD      LYS  49  -2.532  -7.310 -12.128
  412    HD3  LYS  49           1HD      LYS  49  -3.371  -7.324 -13.682
  413    HE2  LYS  49           2HE      LYS  49  -1.286  -9.302 -12.759
  414    HE3  LYS  49           1HE      LYS  49  -3.020  -9.594 -12.868
  415    HZ1  LYS  49           3HZ      LYS  49  -2.852  -9.203 -15.276
  416    HZ2  LYS  49           1HZ      LYS  49  -1.918 -10.517 -14.768
  417    HZ3  LYS  49           2HZ      LYS  49  -1.175  -9.048 -15.126
  418    H    ILE  50           HN       ILE  50  -0.193  -2.716 -12.424
  419    HA   ILE  50           HA       ILE  50  -1.950  -0.686 -13.302
  420    HB   ILE  50           HB       ILE  50   0.376  -0.533 -11.365
  421   HG12  ILE  50          2HG1      ILE  50  -2.603  -0.711 -10.853
  422   HG13  ILE  50          1HG1      ILE  50  -1.484  -2.065 -10.745
  423   HG21  ILE  50          1HG2      ILE  50  -1.828   1.474 -11.849
  424   HG22  ILE  50          2HG2      ILE  50  -0.118   1.690 -12.224
  425   HG23  ILE  50          3HG2      ILE  50  -0.643   1.549 -10.546
  426   HD11  ILE  50          3HD1      ILE  50  -2.006  -1.163  -8.551
  427   HD12  ILE  50          1HD1      ILE  50  -1.413   0.420  -9.052
  428   HD13  ILE  50          2HD1      ILE  50  -0.300  -0.942  -8.934
  429    H    LYS  51           HN       LYS  51   1.586  -0.989 -13.516
  430    HA   LYS  51           HA       LYS  51   2.005   1.473 -14.857
  431    HB2  LYS  51           2HB      LYS  51   3.699  -1.021 -14.723
  432    HB3  LYS  51           1HB      LYS  51   4.234   0.487 -15.444
  433    HG2  LYS  51           2HG      LYS  51   3.403   0.163 -12.562
  434    HG3  LYS  51           1HG      LYS  51   5.068   0.128 -13.141
  435    HD2  LYS  51           2HD      LYS  51   3.163   2.458 -13.440
  436    HD3  LYS  51           1HD      LYS  51   4.434   2.331 -12.226
  437    HE2  LYS  51           2HE      LYS  51   6.116   2.213 -14.022
  438    HE3  LYS  51           1HE      LYS  51   4.833   2.381 -15.218
  439    HZ1  LYS  51           3HZ      LYS  51   4.287   4.535 -14.173
  440    HZ2  LYS  51           1HZ      LYS  51   5.823   4.496 -14.870
  441    HZ3  LYS  51           2HZ      LYS  51   5.653   4.386 -13.195
  442    H    SER  52           HN       SER  52   1.362  -1.789 -15.995
  443    HA   SER  52           HA       SER  52   1.859  -1.205 -18.746
  444    HB2  SER  52           2HB      SER  52   2.009  -3.495 -17.816
  445    HB3  SER  52           1HB      SER  52   0.274  -3.474 -17.515
  446    HG   SER  52           HG       SER  52   0.737  -2.806 -20.076
  447    H    GLY  53           HN       GLY  53  -0.806  -0.752 -16.612
  448    HA2  GLY  53           2HA      GLY  53  -2.622   0.666 -17.101
  449    HA3  GLY  53           1HA      GLY  53  -2.327   0.414 -18.816
  450    H    GLU  54           HN       GLU  54  -2.352  -2.353 -16.792
  451    HA   GLU  54           HA       GLU  54  -4.706  -3.377 -18.141
  452    HB2  GLU  54           2HB      GLU  54  -2.918  -4.611 -16.045
  453    HB3  GLU  54           1HB      GLU  54  -4.236  -5.443 -16.849
  454    HG2  GLU  54           2HG      GLU  54  -3.060  -5.082 -19.000
  455    HG3  GLU  54           1HG      GLU  54  -1.703  -4.417 -18.090
  456    H    GLU  55           HN       GLU  55  -3.695  -3.113 -14.751
  457    HA   GLU  55           HA       GLU  55  -6.522  -3.046 -13.993
  458    HB2  GLU  55           2HB      GLU  55  -4.086  -3.853 -12.409
  459    HB3  GLU  55           1HB      GLU  55  -5.707  -3.734 -11.740
  460    HG2  GLU  55           2HG      GLU  55  -4.834  -5.591 -13.942
  461    HG3  GLU  55           1HG      GLU  55  -5.126  -6.034 -12.261
  462    H    ASP  56           HN       ASP  56  -6.913  -1.847 -11.924
  463    HA   ASP  56           HA       ASP  56  -5.505   0.739 -11.996
  464    HB2  ASP  56           2HB      ASP  56  -7.833   0.919 -12.679
  465    HB3  ASP  56           1HB      ASP  56  -8.354   0.080 -11.225
  466    H    PHE  57           HN       PHE  57  -4.853   1.669 -10.057
  467    HA   PHE  57           HA       PHE  57  -4.027  -0.059  -8.028
  468    HB2  PHE  57           2HB      PHE  57  -2.952   2.106  -8.478
  469    HB3  PHE  57           1HB      PHE  57  -4.378   2.941  -7.871
  470    HD1  PHE  57           2HD      PHE  57  -1.552   0.765  -6.916
  471    HD2  PHE  57           1HD      PHE  57  -4.711   3.264  -5.543
  472    HE1  PHE  57           2HE      PHE  57  -0.607   0.708  -4.648
  473    HE2  PHE  57           1HE      PHE  57  -3.770   3.209  -3.272
  474    HZ   PHE  57           HZ       PHE  57  -1.717   1.930  -2.822
  475    H    GLU  58           HN       GLU  58  -6.773   2.203  -8.054
  476    HA   GLU  58           HA       GLU  58  -7.588   1.644  -5.393
  477    HB2  GLU  58           2HB      GLU  58  -9.214   2.717  -7.699
  478    HB3  GLU  58           1HB      GLU  58  -9.667   2.792  -6.004
  479    HG2  GLU  58           2HG      GLU  58  -7.842   4.275  -5.528
  480    HG3  GLU  58           1HG      GLU  58  -7.224   4.103  -7.170
  481    H    SER  59           HN       SER  59  -8.530   0.410  -8.551
  482    HA   SER  59           HA       SER  59 -10.651  -1.226  -7.708
  483    HB2  SER  59           2HB      SER  59 -10.134  -0.582 -10.085
  484    HB3  SER  59           1HB      SER  59  -8.807  -1.742 -10.053
  485    HG   SER  59           HG       SER  59 -10.204  -3.384 -10.012
  486    H    LEU  60           HN       LEU  60  -7.176  -1.765  -7.821
  487    HA   LEU  60           HA       LEU  60  -7.380  -4.539  -7.127
  488    HB2  LEU  60           2HB      LEU  60  -5.029  -2.650  -7.087
  489    HB3  LEU  60           1HB      LEU  60  -4.921  -4.368  -6.757
  490    HG   LEU  60           HG       LEU  60  -5.774  -3.137  -9.378
  491   HD11  LEU  60          1HD1      LEU  60  -3.650  -4.002 -10.215
  492   HD12  LEU  60          2HD1      LEU  60  -3.229  -4.541  -8.590
  493   HD13  LEU  60          3HD1      LEU  60  -3.407  -2.820  -8.931
  494   HD21  LEU  60          3HD2      LEU  60  -5.627  -5.440 -10.232
  495   HD22  LEU  60          1HD2      LEU  60  -6.878  -5.267  -9.002
  496   HD23  LEU  60          2HD2      LEU  60  -5.336  -6.017  -8.590
  497    H    ALA  61           HN       ALA  61  -6.819  -1.522  -5.409
  498    HA   ALA  61           HA       ALA  61  -6.123  -2.635  -2.922
  499    HB1  ALA  61           1HB      ALA  61  -7.483   0.002  -3.467
  500    HB2  ALA  61           2HB      ALA  61  -5.743  -0.281  -3.496
  501    HB3  ALA  61           3HB      ALA  61  -6.640  -0.447  -1.985
  502    H    SER  62           HN       SER  62  -9.240  -1.817  -4.321
  503    HA   SER  62           HA       SER  62 -10.698  -2.359  -1.932
  504    HB2  SER  62           2HB      SER  62 -12.688  -2.192  -3.527
  505    HB3  SER  62           1HB      SER  62 -11.670  -0.761  -3.361
  506    HG   SER  62           HG       SER  62 -10.958  -0.999  -5.354
  507    H    GLN  63           HN       GLN  63  -9.090  -4.519  -3.723
  508    HA   GLN  63           HA       GLN  63 -11.065  -6.621  -3.152
  509    HB2  GLN  63           2HB      GLN  63  -9.518  -6.398  -5.736
  510    HB3  GLN  63           1HB      GLN  63 -10.517  -7.763  -5.270
  511    HG2  GLN  63           2HG      GLN  63 -12.487  -6.304  -5.263
  512    HG3  GLN  63           1HG      GLN  63 -11.470  -4.953  -5.764
  513   HE21  GLN  63          1HE2      GLN  63 -12.571  -4.661  -7.677
  514   HE22  GLN  63          2HE2      GLN  63 -12.445  -5.764  -9.003
  515    H    PHE  64           HN       PHE  64  -7.694  -5.994  -4.107
  516    HA   PHE  64           HA       PHE  64  -6.925  -8.572  -2.973
  517    HB2  PHE  64           2HB      PHE  64  -5.409  -6.631  -4.711
  518    HB3  PHE  64           1HB      PHE  64  -4.749  -8.141  -4.095
  519    HD1  PHE  64           1HD      PHE  64  -5.783 -10.303  -4.813
  520    HD2  PHE  64           2HD      PHE  64  -6.777  -6.584  -6.620
  521    HE1  PHE  64           1HE      PHE  64  -6.699 -11.498  -6.758
  522    HE2  PHE  64           2HE      PHE  64  -7.696  -7.769  -8.566
  523    HZ   PHE  64           HZ       PHE  64  -7.660 -10.231  -8.638
  524    H    SER  65           HN       SER  65  -7.460  -5.881  -1.510
  525    HA   SER  65           HA       SER  65  -4.944  -5.923   0.005
  526    HB2  SER  65           2HB      SER  65  -5.645  -3.699  -0.966
  527    HB3  SER  65           1HB      SER  65  -7.065  -3.759   0.076
  528    HG   SER  65           HG       SER  65  -4.625  -4.187   1.325
  529    H    ASP  66           HN       ASP  66  -4.994  -6.840   1.927
  530    HA   ASP  66           HA       ASP  66  -7.509  -7.871   2.939
  531    HB2  ASP  66           2HB      ASP  66  -4.824  -8.187   4.263
  532    HB3  ASP  66           1HB      ASP  66  -6.217  -9.254   4.356
  533    H    ALA  67           HN       ALA  67  -6.397  -4.945   3.149
  534    HA   ALA  67           HA       ALA  67  -6.818  -4.660   6.045
  535    HB1  ALA  67           1HB      ALA  67  -5.496  -2.634   5.954
  536    HB2  ALA  67           2HB      ALA  67  -5.334  -2.790   4.205
  537    HB3  ALA  67           3HB      ALA  67  -4.587  -3.982   5.270
  538    H    SER  68           HN       SER  68  -7.435  -2.168   6.423
  539    HA   SER  68           HA       SER  68 -10.104  -1.923   5.476
  540    HB2  SER  68           2HB      SER  68  -9.230  -1.214   7.753
  541    HB3  SER  68           1HB      SER  68  -8.488   0.168   6.952
  542    HG   SER  68           HG       SER  68 -11.121  -0.322   7.582
  543    H    SER  69           HN       SER  69  -7.182  -1.127   4.092
  544    HA   SER  69           HA       SER  69  -7.609   1.360   2.916
  545    HB2  SER  69           2HB      SER  69  -6.033   0.148   1.111
  546    HB3  SER  69           1HB      SER  69  -5.437   0.728   2.668
  547    HG   SER  69           HG       SER  69  -5.766  -1.863   1.754
  548    H    ALA  70           HN       ALA  70  -8.802  -1.800   2.102
  549    HA   ALA  70           HA       ALA  70  -9.541  -1.433  -0.550
  550    HB1  ALA  70           1HB      ALA  70 -10.876  -3.087   1.584
  551    HB2  ALA  70           2HB      ALA  70  -9.539  -3.597   0.553
  552    HB3  ALA  70           3HB      ALA  70 -11.120  -3.262  -0.153
  553    H    LYS  71           HN       LYS  71 -11.419  -0.854   2.418
  554    HA   LYS  71           HA       LYS  71 -13.655   0.172   0.912
  555    HB2  LYS  71           2HB      LYS  71 -14.699   0.541   3.114
  556    HB3  LYS  71           1HB      LYS  71 -14.125  -1.106   2.909
  557    HG2  LYS  71           2HG      LYS  71 -12.164  -0.606   4.266
  558    HG3  LYS  71           1HG      LYS  71 -12.709   1.061   4.450
  559    HD2  LYS  71           2HD      LYS  71 -14.194  -1.392   5.400
  560    HD3  LYS  71           1HD      LYS  71 -13.254  -0.300   6.420
  561    HE2  LYS  71           2HE      LYS  71 -14.757   1.550   5.730
  562    HE3  LYS  71           1HE      LYS  71 -15.730   0.384   4.839
  563    HZ1  LYS  71           3HZ      LYS  71 -16.674   0.827   6.994
  564    HZ2  LYS  71           1HZ      LYS  71 -15.240   0.368   7.760
  565    HZ3  LYS  71           2HZ      LYS  71 -16.153  -0.778   6.920
  566    H    ALA  72           HN       ALA  72 -10.783   1.442   2.052
  567    HA   ALA  72           HA       ALA  72 -11.868   4.153   2.253
  568    HB1  ALA  72           1HB      ALA  72  -9.686   4.766   3.152
  569    HB2  ALA  72           2HB      ALA  72  -9.104   3.123   2.882
  570    HB3  ALA  72           3HB      ALA  72 -10.385   3.423   4.056
  571    H    ARG  73           HN       ARG  73 -10.874   2.156  -0.087
  572    HA   ARG  73           HA       ARG  73 -10.139   2.370  -2.220
  573    HB2  ARG  73           2HB      ARG  73 -10.793   5.268  -1.698
  574    HB3  ARG  73           1HB      ARG  73 -10.318   4.649  -3.272
  575    HG2  ARG  73           2HG      ARG  73 -12.267   3.188  -3.299
  576    HG3  ARG  73           1HG      ARG  73 -12.738   3.783  -1.704
  577    HD2  ARG  73           2HD      ARG  73 -13.969   4.867  -3.566
  578    HD3  ARG  73           1HD      ARG  73 -13.060   6.003  -2.568
  579    HE   ARG  73           HE       ARG  73 -11.378   5.331  -4.638
  580   HH11  ARG  73          1HH1      ARG  73 -14.557   6.780  -4.372
  581   HH12  ARG  73          2HH1      ARG  73 -14.381   7.735  -5.800
  582   HH21  ARG  73          1HH2      ARG  73 -11.122   6.577  -6.502
  583   HH22  ARG  73          2HH2      ARG  73 -12.412   7.614  -7.037
  584    H    GLY  74           HN       GLY  74  -8.308   2.811   0.148
  585    HA2  GLY  74           2HA      GLY  74  -5.994   2.816   0.242
  586    HA3  GLY  74           1HA      GLY  74  -5.953   3.344  -1.430
  587    H    ASP  75           HN       ASP  75  -7.644   5.648  -1.003
  588    HA   ASP  75           HA       ASP  75  -5.634   7.541  -0.513
  589    HB2  ASP  75           2HB      ASP  75  -7.457   8.101  -1.959
  590    HB3  ASP  75           1HB      ASP  75  -8.628   7.867  -0.667
  591    H    LEU  76           HN       LEU  76  -4.895   8.505   1.214
  592    HA   LEU  76           HA       LEU  76  -6.340   8.217   3.763
  593    HB2  LEU  76           2HB      LEU  76  -3.430   8.749   3.167
  594    HB3  LEU  76           1HB      LEU  76  -4.118   8.833   4.774
  595    HG   LEU  76           HG       LEU  76  -4.046   6.352   3.059
  596   HD11  LEU  76          1HD1      LEU  76  -2.362   7.147   5.429
  597   HD12  LEU  76          2HD1      LEU  76  -1.812   7.030   3.757
  598   HD13  LEU  76          3HD1      LEU  76  -2.331   5.582   4.619
  599   HD21  LEU  76          3HD2      LEU  76  -4.687   5.226   5.153
  600   HD22  LEU  76          1HD2      LEU  76  -5.919   6.357   4.592
  601   HD23  LEU  76          2HD2      LEU  76  -4.858   6.802   5.927
  602    H    GLY  77           HN       GLY  77  -5.921  10.347   1.313
  603    HA2  GLY  77           2HA      GLY  77  -6.458  12.572   1.157
  604    HA3  GLY  77           1HA      GLY  77  -6.758  12.584   2.891
  605    H    ALA  78           HN       ALA  78  -5.644  14.751   2.401
  606    HA   ALA  78           HA       ALA  78  -2.784  14.615   2.127
  607    HB1  ALA  78           1HB      ALA  78  -2.844  17.033   2.408
  608    HB2  ALA  78           2HB      ALA  78  -4.536  16.953   2.896
  609    HB3  ALA  78           3HB      ALA  78  -4.071  16.521   1.250
  610    H    PHE  79           HN       PHE  79  -1.657  13.774   3.763
  611    HA   PHE  79           HA       PHE  79  -2.370  14.634   6.484
  612    HB2  PHE  79           2HB      PHE  79  -1.367  12.521   7.312
  613    HB3  PHE  79           1HB      PHE  79  -2.749  12.247   6.262
  614    HD1  PHE  79           1HD      PHE  79   0.881  11.918   6.616
  615    HD2  PHE  79           2HD      PHE  79  -2.474  11.202   4.098
  616    HE1  PHE  79           1HE      PHE  79   2.239  10.392   5.245
  617    HE2  PHE  79           2HE      PHE  79  -1.122   9.680   2.722
  618    HZ   PHE  79           HZ       PHE  79   1.238   9.271   3.295
  619    H    SER  80           HN       SER  80  -0.558  14.790   8.001
  620    HA   SER  80           HA       SER  80   1.786  15.855   6.607
  621    HB2  SER  80           2HB      SER  80   0.390  17.372   8.103
  622    HB3  SER  80           1HB      SER  80   0.999  16.434   9.465
  623    HG   SER  80           HG       SER  80   2.614  17.759   7.542
  624    H    ARG  81           HN       ARG  81   3.808  15.764   8.043
  625    HA   ARG  81           HA       ARG  81   4.337  12.974   8.514
  626    HB2  ARG  81           2HB      ARG  81   6.659  13.659   8.759
  627    HB3  ARG  81           1HB      ARG  81   5.959  14.378   7.319
  628    HG2  ARG  81           2HG      ARG  81   5.673  16.494   8.516
  629    HG3  ARG  81           1HG      ARG  81   6.391  15.768   9.955
  630    HD2  ARG  81           2HD      ARG  81   8.453  15.341   8.654
  631    HD3  ARG  81           1HD      ARG  81   7.727  16.181   7.287
  632    HE   ARG  81           HE       ARG  81   7.802  17.707   9.731
  633   HH11  ARG  81          1HH1      ARG  81   9.498  16.895   6.783
  634   HH12  ARG  81          2HH1      ARG  81  10.486  18.312   6.796
  635   HH21  ARG  81          1HH2      ARG  81   9.111  19.588   9.773
  636   HH22  ARG  81          2HH2      ARG  81  10.262  19.864   8.516
  637    H    GLY  82           HN       GLY  82   5.058  12.053  10.424
  638    HA2  GLY  82           2HA      GLY  82   5.692  12.142  12.717
  639    HA3  GLY  82           1HA      GLY  82   4.851  13.682  12.859
  640    H    GLN  83           HN       GLN  83   3.599  10.796  11.283
  641    HA   GLN  83           HA       GLN  83   1.747  10.379  13.516
  642    HB2  GLN  83           2HB      GLN  83   0.883  10.945  10.682
  643    HB3  GLN  83           1HB      GLN  83  -0.176  10.261  11.904
  644    HG2  GLN  83           2HG      GLN  83   0.153  12.277  13.279
  645    HG3  GLN  83           1HG      GLN  83   1.148  12.961  11.996
  646   HE21  GLN  83          1HE2      GLN  83  -0.496  11.884   9.864
  647   HE22  GLN  83          2HE2      GLN  83  -1.941  12.832   9.840
  648    H    MET  84           HN       MET  84   2.827   9.241  10.334
  649    HA   MET  84           HA       MET  84   1.803   6.579  10.951
  650    HB2  MET  84           2HB      MET  84   2.910   7.811   8.434
  651    HB3  MET  84           1HB      MET  84   2.622   6.085   8.575
  652    HG2  MET  84           2HG      MET  84   0.764   7.078   7.456
  653    HG3  MET  84           1HG      MET  84   0.239   6.571   9.059
  654    HE1  MET  84           3HE      MET  84  -1.925   9.769   8.347
  655    HE2  MET  84           1HE      MET  84  -1.954   8.054   8.760
  656    HE3  MET  84           2HE      MET  84  -1.399   8.568   7.167
  657    H    GLN  85           HN       GLN  85   3.314   4.773   9.999
  658    HA   GLN  85           HA       GLN  85   5.628   4.688  11.652
  659    HB2  GLN  85           2HB      GLN  85   4.831   2.859   9.372
  660    HB3  GLN  85           1HB      GLN  85   6.026   2.502  10.610
  661    HG2  GLN  85           2HG      GLN  85   3.091   2.951  11.109
  662    HG3  GLN  85           1HG      GLN  85   3.875   1.378  10.996
  663   HE21  GLN  85          1HE2      GLN  85   6.265   2.198  12.409
  664   HE22  GLN  85          2HE2      GLN  85   5.819   2.361  14.069
  665    H    LYS  86           HN       LYS  86   7.778   4.861  11.070
  666    HA   LYS  86           HA       LYS  86   8.400   6.806   9.224
  667    HB2  LYS  86           2HB      LYS  86   9.932   5.029  10.943
  668    HB3  LYS  86           1HB      LYS  86  10.800   5.507   9.489
  669    HG2  LYS  86           2HG      LYS  86  11.227   7.018  11.373
  670    HG3  LYS  86           1HG      LYS  86  10.472   7.842  10.012
  671    HD2  LYS  86           2HD      LYS  86   8.269   7.562  11.177
  672    HD3  LYS  86           1HD      LYS  86   9.154   6.949  12.574
  673    HE2  LYS  86           2HE      LYS  86   8.701   9.289  12.909
  674    HE3  LYS  86           1HE      LYS  86  10.428   9.079  12.635
  675    HZ1  LYS  86           3HZ      LYS  86   9.664  10.947  11.374
  676    HZ2  LYS  86           1HZ      LYS  86   8.424  10.044  10.656
  677    HZ3  LYS  86           2HZ      LYS  86  10.042   9.712  10.296
  678    HA   PRO  87           HA       PRO  87  10.066   3.431   6.056
  679    HB2  PRO  87           2HB      PRO  87   8.429   1.179   6.066
  680    HB3  PRO  87           1HB      PRO  87  10.051   1.258   6.761
  681    HG2  PRO  87           2HG      PRO  87   7.397   1.524   8.108
  682    HG3  PRO  87           1HG      PRO  87   8.861   0.694   8.667
  683    HD2  PRO  87           2HD      PRO  87   8.172   3.080   9.640
  684    HD3  PRO  87           1HD      PRO  87   9.876   2.679   9.333
  685    H    PHE  88           HN       PHE  88   6.763   3.912   7.040
  686    HA   PHE  88           HA       PHE  88   5.767   3.841   4.300
  687    HB2  PHE  88           2HB      PHE  88   4.413   2.779   6.048
  688    HB3  PHE  88           1HB      PHE  88   4.365   4.285   6.952
  689    HD1  PHE  88           2HD      PHE  88   2.953   6.133   6.212
  690    HD2  PHE  88           1HD      PHE  88   3.024   2.428   4.122
  691    HE1  PHE  88           2HE      PHE  88   0.880   6.756   5.049
  692    HE2  PHE  88           1HE      PHE  88   0.950   3.043   2.956
  693    HZ   PHE  88           HZ       PHE  88  -0.124   5.213   3.420
  694    H    GLU  89           HN       GLU  89   5.915   6.049   7.045
  695    HA   GLU  89           HA       GLU  89   4.815   8.316   5.857
  696    HB2  GLU  89           2HB      GLU  89   5.094   7.991   8.270
  697    HB3  GLU  89           1HB      GLU  89   6.835   8.103   8.088
  698    HG2  GLU  89           2HG      GLU  89   6.665  10.408   7.437
  699    HG3  GLU  89           1HG      GLU  89   4.901  10.312   7.449
  700    H    ASP  90           HN       ASP  90   8.253   7.502   6.348
  701    HA   ASP  90           HA       ASP  90   9.300   9.781   5.103
  702    HB2  ASP  90           2HB      ASP  90  10.684   8.341   6.492
  703    HB3  ASP  90           1HB      ASP  90  10.496   7.017   5.350
  704    H    ALA  91           HN       ALA  91   8.434   6.625   3.811
  705    HA   ALA  91           HA       ALA  91   9.437   7.061   1.211
  706    HB1  ALA  91           1HB      ALA  91   8.126   5.115   0.568
  707    HB2  ALA  91           2HB      ALA  91   7.246   5.190   2.094
  708    HB3  ALA  91           3HB      ALA  91   8.971   4.828   2.089
  709    H    SER  92           HN       SER  92   6.205   7.519   2.626
  710    HA   SER  92           HA       SER  92   4.933   8.202   0.221
  711    HB2  SER  92           2HB      SER  92   3.159   9.204   1.655
  712    HB3  SER  92           1HB      SER  92   3.614   7.578   2.154
  713    HG   SER  92           HG       SER  92   5.174   9.067   3.559
  714    H    PHE  93           HN       PHE  93   6.729  10.176   2.522
  715    HA   PHE  93           HA       PHE  93   6.080  12.616   1.125
  716    HB2  PHE  93           2HB      PHE  93   7.851  11.973   3.468
  717    HB3  PHE  93           1HB      PHE  93   7.902  13.555   2.699
  718    HD1  PHE  93           2HD      PHE  93   5.833  11.223   4.641
  719    HD2  PHE  93           1HD      PHE  93   6.118  15.119   2.961
  720    HE1  PHE  93           2HE      PHE  93   3.898  11.937   5.977
  721    HE2  PHE  93           1HE      PHE  93   4.184  15.841   4.294
  722    HZ   PHE  93           HZ       PHE  93   3.071  14.248   5.803
  723    H    ALA  94           HN       ALA  94   8.409  10.148   0.817
  724    HA   ALA  94           HA       ALA  94  10.412  11.772  -0.472
  725    HB1  ALA  94           1HB      ALA  94  11.545   9.659  -0.925
  726    HB2  ALA  94           2HB      ALA  94  10.126   8.768  -0.377
  727    HB3  ALA  94           3HB      ALA  94  11.046   9.750   0.763
  728    H    LEU  95           HN       LEU  95   7.540  10.173  -1.359
  729    HA   LEU  95           HA       LEU  95   8.160   9.858  -4.150
  730    HB2  LEU  95           2HB      LEU  95   5.492   9.805  -2.740
  731    HB3  LEU  95           1HB      LEU  95   5.788   9.293  -4.387
  732    HG   LEU  95           HG       LEU  95   6.840   7.965  -1.894
  733   HD11  LEU  95          1HD1      LEU  95   4.467   7.608  -2.266
  734   HD12  LEU  95          2HD1      LEU  95   5.381   6.130  -2.559
  735   HD13  LEU  95          3HD1      LEU  95   4.792   7.087  -3.918
  736   HD21  LEU  95          3HD2      LEU  95   7.688   6.236  -3.413
  737   HD22  LEU  95          1HD2      LEU  95   8.460   7.793  -3.708
  738   HD23  LEU  95          2HD2      LEU  95   7.199   7.213  -4.795
  739    H    ARG  96           HN       ARG  96   6.808  10.935  -5.815
  740    HA   ARG  96           HA       ARG  96   6.498  13.783  -5.153
  741    HB2  ARG  96           2HB      ARG  96   6.822  12.569  -7.911
  742    HB3  ARG  96           1HB      ARG  96   6.881  14.273  -7.498
  743    HG2  ARG  96           2HG      ARG  96   9.108  13.801  -7.749
  744    HG3  ARG  96           1HG      ARG  96   8.911  13.531  -6.015
  745    HD2  ARG  96           2HD      ARG  96   8.476  11.096  -6.598
  746    HD3  ARG  96           1HD      ARG  96   9.059  11.484  -8.215
  747    HE   ARG  96           HE       ARG  96  10.971  12.380  -6.422
  748   HH11  ARG  96          1HH1      ARG  96   9.602   9.325  -7.507
  749   HH12  ARG  96          2HH1      ARG  96  10.970   8.398  -7.002
  750   HH21  ARG  96          1HH2      ARG  96  12.781  11.160  -5.796
  751   HH22  ARG  96          2HH2      ARG  96  12.800   9.448  -6.046
  752    H    THR  97           HN       THR  97   4.841  14.843  -6.748
  753    HA   THR  97           HA       THR  97   2.307  13.747  -6.214
  754    HB   THR  97           HB       THR  97   3.121  15.888  -8.203
  755    HG1  THR  97           1HG      THR  97   2.136  16.046  -5.520
  756   HG21  THR  97          3HG2      THR  97   0.784  16.641  -8.029
  757   HG22  THR  97          1HG2      THR  97   0.418  15.246  -7.014
  758   HG23  THR  97          2HG2      THR  97   0.890  15.011  -8.695
  759    H    GLY  98           HN       GLY  98   1.645  11.876  -7.090
  760    HA2  GLY  98           2HA      GLY  98   0.754  10.607  -8.852
  761    HA3  GLY  98           1HA      GLY  98   1.659  11.592  -9.996
  762    H    GLU  99           HN       GLU  99   2.958  10.042  -7.123
  763    HA   GLU  99           HA       GLU  99   4.611   8.328  -8.864
  764    HB2  GLU  99           2HB      GLU  99   5.896  10.210  -7.939
  765    HB3  GLU  99           1HB      GLU  99   5.429   9.733  -6.316
  766    HG2  GLU  99           2HG      GLU  99   7.634   8.972  -6.643
  767    HG3  GLU  99           1HG      GLU  99   6.593   7.551  -6.740
  768    H    MET 100           HN       MET 100   5.162   6.283  -8.050
  769    HA   MET 100           HA       MET 100   3.684   5.417  -5.656
  770    HB2  MET 100           2HB      MET 100   2.559   4.605  -7.688
  771    HB3  MET 100           1HB      MET 100   4.058   3.870  -8.228
  772    HG2  MET 100           2HG      MET 100   4.016   2.330  -6.365
  773    HG3  MET 100           1HG      MET 100   2.571   3.110  -5.724
  774    HE1  MET 100           3HE      MET 100   2.645   0.789  -9.715
  775    HE2  MET 100           1HE      MET 100   4.073   1.082  -8.723
  776    HE3  MET 100           2HE      MET 100   3.281   2.424  -9.552
  777    H    SER 101           HN       SER 101   4.790   4.174  -4.225
  778    HA   SER 101           HA       SER 101   7.644   4.074  -4.501
  779    HB2  SER 101           2HB      SER 101   7.538   3.027  -2.222
  780    HB3  SER 101           1HB      SER 101   6.725   4.587  -2.335
  781    HG   SER 101           HG       SER 101   5.681   2.458  -1.385
  782    H    GLY 102           HN       GLY 102   5.320   1.521  -3.722
  783    HA2  GLY 102           2HA      GLY 102   5.404  -0.448  -5.306
  784    HA3  GLY 102           1HA      GLY 102   7.139  -0.404  -5.003
  785    HA   PRO 103           HA       PRO 103   5.584  -3.256  -1.812
  786    HB2  PRO 103           2HB      PRO 103   8.176  -4.543  -1.960
  787    HB3  PRO 103           1HB      PRO 103   6.602  -5.190  -2.422
  788    HG2  PRO 103           2HG      PRO 103   8.585  -4.591  -4.214
  789    HG3  PRO 103           1HG      PRO 103   6.859  -4.589  -4.615
  790    HD2  PRO 103           2HD      PRO 103   8.669  -2.288  -3.995
  791    HD3  PRO 103           1HD      PRO 103   7.377  -2.416  -5.208
  792    H    VAL 104           HN       VAL 104   5.638  -1.788  -0.092
  793    HA   VAL 104           HA       VAL 104   8.251  -1.346   1.177
  794    HB   VAL 104           HB       VAL 104   5.610   0.035   1.727
  795   HG11  VAL 104          1HG1      VAL 104   8.385   0.635   2.753
  796   HG12  VAL 104          2HG1      VAL 104   7.046  -0.022   3.694
  797   HG13  VAL 104          3HG1      VAL 104   6.948   1.615   3.044
  798   HG21  VAL 104          3HG2      VAL 104   6.621   1.983   0.631
  799   HG22  VAL 104          1HG2      VAL 104   6.481   0.614  -0.473
  800   HG23  VAL 104          2HG2      VAL 104   8.042   1.017   0.238
  801    H    PHE 105           HN       PHE 105   8.744  -2.746   2.714
  802    HA   PHE 105           HA       PHE 105   6.693  -4.297   4.057
  803    HB2  PHE 105           2HB      PHE 105   9.703  -4.315   4.373
  804    HB3  PHE 105           1HB      PHE 105   8.595  -5.473   5.094
  805    HD1  PHE 105           1HD      PHE 105   7.533  -7.184   3.746
  806    HD2  PHE 105           2HD      PHE 105  10.222  -4.382   2.010
  807    HE1  PHE 105           1HE      PHE 105   7.714  -8.598   1.745
  808    HE2  PHE 105           2HE      PHE 105  10.403  -5.790   0.003
  809    HZ   PHE 105           HZ       PHE 105   9.148  -7.903  -0.130
  810    H    THR 106           HN       THR 106   6.343  -4.315   6.332
  811    HA   THR 106           HA       THR 106   7.687  -2.342   7.967
  812    HB   THR 106           HB       THR 106   4.686  -2.087   7.641
  813    HG1  THR 106           1HG      THR 106   6.756  -1.049   6.176
  814   HG21  THR 106          3HG2      THR 106   5.021   0.003   8.911
  815   HG22  THR 106          1HG2      THR 106   6.736  -0.376   9.064
  816   HG23  THR 106          2HG2      THR 106   5.535  -1.409   9.836
  817    H    ASP 107           HN       ASP 107   4.468  -3.908   8.296
  818    HA   ASP 107           HA       ASP 107   5.550  -5.353  10.631
  819    HB2  ASP 107           2HB      ASP 107   2.790  -4.142  10.325
  820    HB3  ASP 107           1HB      ASP 107   3.258  -5.217  11.636
  821    H    SER 108           HN       SER 108   5.997  -7.088   9.213
  822    HA   SER 108           HA       SER 108   5.654  -9.022   8.107
  823    HB2  SER 108           2HB      SER 108   3.941 -10.534   9.062
  824    HB3  SER 108           1HB      SER 108   4.903  -9.747  10.305
  825    HG   SER 108           HG       SER 108   2.917  -8.144   9.990
  826    H    GLY 109           HN       GLY 109   4.472  -6.661   6.876
  827    HA2  GLY 109           2HA      GLY 109   2.772  -8.017   4.960
  828    HA3  GLY 109           1HA      GLY 109   1.997  -6.715   5.856
  829    H    ILE 110           HN       ILE 110   2.392  -6.751   3.048
  830    HA   ILE 110           HA       ILE 110   4.563  -4.816   2.650
  831    HB   ILE 110           HB       ILE 110   2.959  -6.270   0.536
  832   HG12  ILE 110          2HG1      ILE 110   5.748  -6.853   1.551
  833   HG13  ILE 110          1HG1      ILE 110   4.320  -7.817   1.913
  834   HG21  ILE 110          1HG2      ILE 110   5.466  -4.605   0.381
  835   HG22  ILE 110          2HG2      ILE 110   3.881  -4.194  -0.275
  836   HG23  ILE 110          3HG2      ILE 110   4.795  -5.540  -0.953
  837   HD11  ILE 110          3HD1      ILE 110   5.691  -8.810   0.154
  838   HD12  ILE 110          1HD1      ILE 110   5.469  -7.367  -0.831
  839   HD13  ILE 110          2HD1      ILE 110   4.085  -8.383  -0.431
  840    H    HIS 111           HN       HIS 111   4.169  -2.770   2.176
  841    HA   HIS 111           HA       HIS 111   1.370  -1.938   1.759
  842    HB2  HIS 111           2HB      HIS 111   3.668  -0.310   2.882
  843    HB3  HIS 111           1HB      HIS 111   1.998   0.212   2.737
  844    HD1  HIS 111           1HD      HIS 111   0.629  -0.059   4.798
  845    HD2  HIS 111           2HD      HIS 111   3.955  -2.548   4.799
  846    HE1  HIS 111           1HE      HIS 111   0.661  -1.139   7.050
  847    HE2  HIS 111           2HE      HIS 111   2.626  -2.685   7.013
  848    H    ILE 112           HN       ILE 112   0.930  -0.936  -0.116
  849    HA   ILE 112           HA       ILE 112   3.195   0.022  -1.738
  850    HB   ILE 112           HB       ILE 112   0.347  -0.316  -2.671
  851   HG12  ILE 112          2HG1      ILE 112   2.632  -2.283  -2.986
  852   HG13  ILE 112          1HG1      ILE 112   1.218  -2.518  -1.963
  853   HG21  ILE 112          1HG2      ILE 112   2.950  -0.032  -4.166
  854   HG22  ILE 112          2HG2      ILE 112   1.686   1.188  -4.014
  855   HG23  ILE 112          3HG2      ILE 112   1.375  -0.298  -4.913
  856   HD11  ILE 112          3HD1      ILE 112   1.017  -3.757  -4.048
  857   HD12  ILE 112          1HD1      ILE 112   1.205  -2.263  -4.963
  858   HD13  ILE 112          2HD1      ILE 112  -0.213  -2.500  -3.943
  859    H    ILE 113           HN       ILE 113   3.407   2.159  -2.039
  860    HA   ILE 113           HA       ILE 113   1.247   3.868  -1.012
  861    HB   ILE 113           HB       ILE 113   4.187   4.513  -1.154
  862   HG12  ILE 113          2HG1      ILE 113   2.562   3.768   1.285
  863   HG13  ILE 113          1HG1      ILE 113   3.665   2.677   0.455
  864   HG21  ILE 113          1HG2      ILE 113   1.895   5.920   0.228
  865   HG22  ILE 113          2HG2      ILE 113   2.714   6.466  -1.235
  866   HG23  ILE 113          3HG2      ILE 113   3.589   6.406   0.296
  867   HD11  ILE 113          3HD1      ILE 113   4.690   3.628   2.432
  868   HD12  ILE 113          1HD1      ILE 113   4.410   5.256   1.814
  869   HD13  ILE 113          2HD1      ILE 113   5.523   4.175   0.976
  870    H    LEU 114           HN       LEU 114   0.262   5.006  -2.518
  871    HA   LEU 114           HA       LEU 114   1.827   5.906  -4.839
  872    HB2  LEU 114           2HB      LEU 114   0.061   4.104  -5.289
  873    HB3  LEU 114           1HB      LEU 114  -1.137   5.317  -4.892
  874    HG   LEU 114           HG       LEU 114   0.867   5.735  -7.110
  875   HD11  LEU 114          1HD1      LEU 114  -0.843   4.960  -8.671
  876   HD12  LEU 114          2HD1      LEU 114  -1.869   4.490  -7.317
  877   HD13  LEU 114          3HD1      LEU 114  -0.330   3.671  -7.582
  878   HD21  LEU 114          3HD2      LEU 114  -0.819   7.297  -7.947
  879   HD22  LEU 114          1HD2      LEU 114  -0.318   7.724  -6.310
  880   HD23  LEU 114          2HD2      LEU 114  -1.861   6.914  -6.577
  881    H    ARG 115           HN       ARG 115   2.182   7.987  -4.555
  882    HA   ARG 115           HA       ARG 115   0.327   9.595  -3.021
  883    HB2  ARG 115           2HB      ARG 115   2.706   9.909  -2.614
  884    HB3  ARG 115           1HB      ARG 115   2.967  10.305  -4.309
  885    HG2  ARG 115           2HG      ARG 115   1.547  12.279  -4.062
  886    HG3  ARG 115           1HG      ARG 115   1.315  11.890  -2.358
  887    HD2  ARG 115           2HD      ARG 115   3.632  12.244  -1.896
  888    HD3  ARG 115           1HD      ARG 115   4.003  12.393  -3.616
  889    HE   ARG 115           HE       ARG 115   2.057  14.291  -2.736
  890   HH11  ARG 115          1HH1      ARG 115   5.524  13.689  -2.866
  891   HH12  ARG 115          2HH1      ARG 115   5.921  15.370  -2.915
  892   HH21  ARG 115          1HH2      ARG 115   2.599  16.475  -2.794
  893   HH22  ARG 115          2HH2      ARG 115   4.260  16.959  -2.885
  894    H    THR 116           HN       THR 116  -1.308  10.594  -3.922
  895    HA   THR 116           HA       THR 116  -1.376  10.926  -6.794
  896    HB   THR 116           HB       THR 116  -3.735  11.801  -6.242
  897    HG1  THR 116           1HG      THR 116  -4.487  11.237  -4.190
  898   HG21  THR 116          3HG2      THR 116  -4.606   9.517  -5.966
  899   HG22  THR 116          1HG2      THR 116  -2.988   8.957  -5.541
  900   HG23  THR 116          2HG2      THR 116  -3.311   9.569  -7.163
  901    H    GLU 117           HN       GLU 117  -1.509  12.927  -3.873
  902    HA   GLU 117           HA       GLU 117  -0.974  15.277  -5.557
  903    HB2  GLU 117           2HB      GLU 117  -2.586  15.154  -3.005
  904    HB3  GLU 117           1HB      GLU 117  -2.116  16.634  -3.816
  905    HG2  GLU 117           2HG      GLU 117  -3.792  14.492  -5.093
  906    HG3  GLU 117           1HG      GLU 117  -4.448  15.895  -4.255
  Start of MODEL    5
    1    H1   GLY   1           1HT      GLY   1  14.596  20.914  -6.573
    2    H2   GLY   1           2HT      GLY   1  13.128  21.399  -7.245
    3    H3   GLY   1           3HT      GLY   1  14.092  20.268  -8.053
    4    HA2  GLY   1           1HA      GLY   1  12.235  19.180  -6.993
    5    HA3  GLY   1           2HA      GLY   1  13.762  18.679  -6.282
    6    H    SER   2           HN       SER   2  11.445  18.319  -4.885
    7    HA   SER   2           HA       SER   2  10.882  20.486  -3.131
    8    HB2  SER   2           2HB      SER   2  10.310  17.543  -2.718
    9    HB3  SER   2           1HB      SER   2   9.492  18.904  -1.950
   10    HG   SER   2           HG       SER   2   8.724  19.517  -4.021
   11    H    HIS   3           HN       HIS   3  12.451  21.228  -1.839
   12    HA   HIS   3           HA       HIS   3  14.491  19.504  -0.766
   13    HB2  HIS   3           2HB      HIS   3  13.902  22.422  -0.216
   14    HB3  HIS   3           1HB      HIS   3  15.318  21.555   0.360
   15    HD1  HIS   3           1HD      HIS   3  15.170  24.062  -1.675
   16    HD2  HIS   3           2HD      HIS   3  15.967  20.098  -2.605
   17    HE1  HIS   3           1HE      HIS   3  16.446  24.120  -3.838
   18    HE2  HIS   3           2HE      HIS   3  16.684  21.702  -4.487
   19    H    MET   4           HN       MET   4  11.568  21.027   0.365
   20    HA   MET   4           HA       MET   4  11.856  19.549   2.892
   21    HB2  MET   4           2HB      MET   4  10.501  22.201   2.382
   22    HB3  MET   4           1HB      MET   4  10.225  21.255   3.832
   23    HG2  MET   4           2HG      MET   4  11.804  22.861   4.440
   24    HG3  MET   4           1HG      MET   4  12.725  21.377   4.220
   25    HE1  MET   4           3HE      MET   4  11.825  24.895   2.814
   26    HE2  MET   4           1HE      MET   4  11.300  23.879   1.473
   27    HE3  MET   4           2HE      MET   4  12.693  24.942   1.281
   28    H    GLU   5           HN       GLU   5  10.115  18.348   3.579
   29    HA   GLU   5           HA       GLU   5   8.334  17.426   1.582
   30    HB2  GLU   5           2HB      GLU   5   8.223  17.044   4.582
   31    HB3  GLU   5           1HB      GLU   5   7.218  16.187   3.431
   32    HG2  GLU   5           2HG      GLU   5   8.892  14.674   3.949
   33    HG3  GLU   5           1HG      GLU   5   9.424  15.364   2.417
   34    HA   PRO   6           HA       PRO   6   5.152  20.563   1.804
   35    HB2  PRO   6           2HB      PRO   6   3.387  18.304   1.000
   36    HB3  PRO   6           1HB      PRO   6   3.608  19.881   0.234
   37    HG2  PRO   6           2HG      PRO   6   4.643  17.687  -0.859
   38    HG3  PRO   6           1HG      PRO   6   5.534  19.221  -0.875
   39    HD2  PRO   6           2HD      PRO   6   5.929  16.818   0.860
   40    HD3  PRO   6           1HD      PRO   6   7.134  17.893   0.121
   41    H    ALA   7           HN       ALA   7   3.172  20.972   2.989
   42    HA   ALA   7           HA       ALA   7   3.209  19.988   5.607
   43    HB1  ALA   7           1HB      ALA   7   1.079  21.166   5.905
   44    HB2  ALA   7           2HB      ALA   7   0.954  21.370   4.156
   45    HB3  ALA   7           3HB      ALA   7   2.258  22.157   5.044
   46    H    ARG   8           HN       ARG   8   0.923  19.282   2.968
   47    HA   ARG   8           HA       ARG   8   0.389  16.716   4.286
   48    HB2  ARG   8           2HB      ARG   8  -1.673  18.502   2.983
   49    HB3  ARG   8           1HB      ARG   8  -1.967  16.863   3.538
   50    HG2  ARG   8           2HG      ARG   8  -1.393  17.602   5.838
   51    HG3  ARG   8           1HG      ARG   8  -1.283  19.255   5.226
   52    HD2  ARG   8           2HD      ARG   8  -3.625  19.072   4.440
   53    HD3  ARG   8           1HD      ARG   8  -3.714  17.469   5.169
   54    HE   ARG   8           HE       ARG   8  -3.037  19.774   6.845
   55   HH11  ARG   8          1HH1      ARG   8  -5.295  17.207   6.009
   56   HH12  ARG   8          2HH1      ARG   8  -6.289  17.449   7.398
   57   HH21  ARG   8          1HH2      ARG   8  -4.346  20.081   8.701
   58   HH22  ARG   8          2HH2      ARG   8  -5.747  19.098   8.938
   59    H    VAL   9           HN       VAL   9   0.508  15.000   2.987
   60    HA   VAL   9           HA       VAL   9   0.567  15.487   0.084
   61    HB   VAL   9           HB       VAL   9   2.068  13.565  -0.174
   62   HG11  VAL   9          1HG1      VAL   9   3.110  15.602   1.787
   63   HG12  VAL   9          2HG1      VAL   9   3.085  15.751   0.030
   64   HG13  VAL   9          3HG1      VAL   9   4.105  14.534   0.798
   65   HG21  VAL   9          3HG2      VAL   9   3.132  12.515   1.777
   66   HG22  VAL   9          1HG2      VAL   9   1.387  12.258   1.767
   67   HG23  VAL   9          2HG2      VAL   9   2.096  13.461   2.845
   68    H    ARG  10           HN       ARG  10  -0.533  14.046  -1.230
   69    HA   ARG  10           HA       ARG  10  -2.357  12.301   0.271
   70    HB2  ARG  10           2HB      ARG  10  -3.463  14.111  -1.014
   71    HB3  ARG  10           1HB      ARG  10  -2.776  13.446  -2.490
   72    HG2  ARG  10           2HG      ARG  10  -4.058  11.466  -2.310
   73    HG3  ARG  10           1HG      ARG  10  -4.563  11.865  -0.668
   74    HD2  ARG  10           2HD      ARG  10  -5.764  13.824  -1.551
   75    HD3  ARG  10           1HD      ARG  10  -5.305  13.345  -3.185
   76    HE   ARG  10           HE       ARG  10  -6.585  11.174  -1.958
   77   HH11  ARG  10          1HH1      ARG  10  -7.349  14.412  -3.042
   78   HH12  ARG  10          2HH1      ARG  10  -8.988  14.043  -3.446
   79   HH21  ARG  10          1HH2      ARG  10  -8.740  10.656  -2.498
   80   HH22  ARG  10          2HH2      ARG  10  -9.793  11.874  -3.136
   81    H    CYS  11           HN       CYS  11  -2.083  10.240   0.106
   82    HA   CYS  11           HA       CYS  11  -0.993   9.113  -2.351
   83    HB2  CYS  11           2HB      CYS  11   0.058   8.447   0.408
   84    HB3  CYS  11           1HB      CYS  11   0.583   7.726  -1.108
   85    HG   CYS  11           HG       CYS  11   0.900  10.980  -1.307
   86    H    SER  12           HN       SER  12  -1.558   6.966  -2.688
   87    HA   SER  12           HA       SER  12  -3.648   5.931  -0.910
   88    HB2  SER  12           2HB      SER  12  -3.178   5.266  -3.830
   89    HB3  SER  12           1HB      SER  12  -4.556   4.774  -2.844
   90    HG   SER  12           HG       SER  12  -4.580   7.342  -2.616
   91    H    HIS  13           HN       HIS  13  -3.540   3.707  -0.324
   92    HA   HIS  13           HA       HIS  13  -0.955   2.464  -0.944
   93    HB2  HIS  13           2HB      HIS  13  -0.681   1.688   1.340
   94    HB3  HIS  13           1HB      HIS  13  -0.839   3.435   1.314
   95    HD1  HIS  13           1HD      HIS  13  -1.861   3.931   3.547
   96    HD2  HIS  13           2HD      HIS  13  -3.807   0.796   1.644
   97    HE1  HIS  13           1HE      HIS  13  -3.817   3.359   5.012
   98    HE2  HIS  13           2HE      HIS  13  -4.795   1.287   3.970
   99    H    LEU  14           HN       LEU  14  -0.833   0.260  -0.936
  100    HA   LEU  14           HA       LEU  14  -3.376  -1.222  -0.808
  101    HB2  LEU  14           2HB      LEU  14  -2.418  -0.910  -3.144
  102    HB3  LEU  14           1HB      LEU  14  -1.021  -1.823  -2.624
  103    HG   LEU  14           HG       LEU  14  -3.774  -3.036  -2.499
  104   HD11  LEU  14          1HD1      LEU  14  -1.916  -3.008  -4.874
  105   HD12  LEU  14          2HD1      LEU  14  -3.489  -2.216  -4.774
  106   HD13  LEU  14          3HD1      LEU  14  -3.382  -3.977  -4.723
  107   HD21  LEU  14          3HD2      LEU  14  -2.525  -5.123  -2.736
  108   HD22  LEU  14          1HD2      LEU  14  -1.950  -4.200  -1.348
  109   HD23  LEU  14          2HD2      LEU  14  -1.016  -4.217  -2.843
  110    H    LEU  15           HN       LEU  15  -3.284  -3.094   0.448
  111    HA   LEU  15           HA       LEU  15  -0.644  -3.737   1.569
  112    HB2  LEU  15           2HB      LEU  15  -1.671  -2.447   3.252
  113    HB3  LEU  15           1HB      LEU  15  -3.210  -3.251   3.046
  114    HG   LEU  15           HG       LEU  15  -2.322  -5.280   4.078
  115   HD11  LEU  15          1HD1      LEU  15   0.239  -3.724   4.386
  116   HD12  LEU  15          2HD1      LEU  15  -0.012  -5.127   3.347
  117   HD13  LEU  15          3HD1      LEU  15  -0.102  -5.300   5.100
  118   HD21  LEU  15          3HD2      LEU  15  -2.018  -4.427   6.346
  119   HD22  LEU  15          1HD2      LEU  15  -3.323  -3.580   5.517
  120   HD23  LEU  15          2HD2      LEU  15  -1.751  -2.807   5.705
  121    H    VAL  16           HN       VAL  16  -0.097  -5.761   1.442
  122    HA   VAL  16           HA       VAL  16  -2.204  -7.793   1.197
  123    HB   VAL  16           HB       VAL  16   0.627  -7.806   0.100
  124   HG11  VAL  16          1HG1      VAL  16  -1.418 -10.031   0.057
  125   HG12  VAL  16          2HG1      VAL  16   0.083 -10.023   0.982
  126   HG13  VAL  16          3HG1      VAL  16   0.135 -10.041  -0.781
  127   HG21  VAL  16          3HG2      VAL  16  -0.498  -8.040  -2.066
  128   HG22  VAL  16          1HG2      VAL  16  -0.981  -6.558  -1.240
  129   HG23  VAL  16          2HG2      VAL  16  -2.064  -7.950  -1.259
  130    H    LYS  17           HN       LYS  17  -2.365  -9.190   2.780
  131    HA   LYS  17           HA       LYS  17  -0.449  -9.094   4.966
  132    HB2  LYS  17           2HB      LYS  17  -3.215 -10.145   4.624
  133    HB3  LYS  17           1HB      LYS  17  -2.206 -10.875   5.861
  134    HG2  LYS  17           2HG      LYS  17  -2.766  -7.923   5.670
  135    HG3  LYS  17           1HG      LYS  17  -3.680  -9.048   6.678
  136    HD2  LYS  17           2HD      LYS  17  -1.528  -9.672   7.794
  137    HD3  LYS  17           1HD      LYS  17  -0.742  -8.382   6.885
  138    HE2  LYS  17           2HE      LYS  17  -3.060  -7.992   8.778
  139    HE3  LYS  17           1HE      LYS  17  -1.369  -7.728   9.194
  140    HZ1  LYS  17           3HZ      LYS  17  -2.436  -5.661   8.621
  141    HZ2  LYS  17           1HZ      LYS  17  -2.905  -6.268   7.113
  142    HZ3  LYS  17           2HZ      LYS  17  -1.263  -6.032   7.465
  143    H    HIS  18           HN       HIS  18   0.485 -10.990   5.870
  144    HA   HIS  18           HA       HIS  18   0.455 -13.365   4.250
  145    HB2  HIS  18           2HB      HIS  18   2.946 -13.464   4.038
  146    HB3  HIS  18           1HB      HIS  18   2.193 -12.202   3.084
  147    HD1  HIS  18           1HD      HIS  18   5.215 -12.519   4.366
  148    HD2  HIS  18           2HD      HIS  18   2.238  -9.796   5.355
  149    HE1  HIS  18           1HE      HIS  18   6.408 -10.542   5.367
  150    HE2  HIS  18           2HE      HIS  18   4.595  -8.939   6.017
  151    H    SER  19           HN       SER  19   1.951 -15.093   5.263
  152    HA   SER  19           HA       SER  19   0.916 -15.532   7.841
  153    HB2  SER  19           2HB      SER  19   2.382 -17.537   7.829
  154    HB3  SER  19           1HB      SER  19   1.419 -17.370   6.361
  155    HG   SER  19           HG       SER  19   4.020 -17.604   6.555
  156    H    GLN  20           HN       GLN  20   3.753 -13.926   6.814
  157    HA   GLN  20           HA       GLN  20   5.235 -14.283   9.243
  158    HB2  GLN  20           2HB      GLN  20   5.625 -12.404   6.916
  159    HB3  GLN  20           1HB      GLN  20   6.738 -12.538   8.270
  160    HG2  GLN  20           2HG      GLN  20   7.186 -14.849   7.719
  161    HG3  GLN  20           1HG      GLN  20   5.997 -14.794   6.418
  162   HE21  GLN  20          1HE2      GLN  20   8.862 -15.388   6.375
  163   HE22  GLN  20          2HE2      GLN  20   9.558 -14.274   5.253
  164    H    SER  21           HN       SER  21   2.535 -12.518   8.568
  165    HA   SER  21           HA       SER  21   3.185 -10.268  10.299
  166    HB2  SER  21           2HB      SER  21   0.574 -10.980   8.930
  167    HB3  SER  21           1HB      SER  21   0.964  -9.444   9.705
  168    HG   SER  21           HG       SER  21   2.663  -9.231   8.149
  169    H    ARG  22           HN       ARG  22   1.510  -9.788  12.072
  170    HA   ARG  22           HA       ARG  22   1.296 -12.111  13.730
  171    HB2  ARG  22           2HB      ARG  22   0.345  -9.278  14.123
  172    HB3  ARG  22           1HB      ARG  22   0.116 -10.546  15.316
  173    HG2  ARG  22           2HG      ARG  22   2.592 -10.849  15.358
  174    HG3  ARG  22           1HG      ARG  22   2.722  -9.422  14.329
  175    HD2  ARG  22           2HD      ARG  22   3.037  -8.832  16.669
  176    HD3  ARG  22           1HD      ARG  22   1.571  -8.093  16.028
  177    HE   ARG  22           HE       ARG  22   0.804 -10.495  17.179
  178   HH11  ARG  22          1HH1      ARG  22   2.246  -7.485  18.243
  179   HH12  ARG  22          2HH1      ARG  22   1.606  -7.586  19.845
  180   HH21  ARG  22          1HH2      ARG  22  -0.055 -10.632  19.309
  181   HH22  ARG  22          2HH2      ARG  22   0.299  -9.385  20.456
  182    H    ARG  23           HN       ARG  23  -0.915 -10.162  11.836
  183    HA   ARG  23           HA       ARG  23  -3.016 -12.133  12.438
  184    HB2  ARG  23           2HB      ARG  23  -3.329  -9.229  11.674
  185    HB3  ARG  23           1HB      ARG  23  -4.654 -10.366  11.863
  186    HG2  ARG  23           2HG      ARG  23  -4.042 -10.650  14.231
  187    HG3  ARG  23           1HG      ARG  23  -2.762  -9.452  14.016
  188    HD2  ARG  23           2HD      ARG  23  -4.744  -8.425  14.993
  189    HD3  ARG  23           1HD      ARG  23  -4.437  -7.782  13.378
  190    HE   ARG  23           HE       ARG  23  -6.296 -10.002  13.516
  191   HH11  ARG  23          1HH1      ARG  23  -5.908  -6.509  13.391
  192   HH12  ARG  23          2HH1      ARG  23  -7.541  -6.229  12.890
  193   HH21  ARG  23          1HH2      ARG  23  -8.453  -9.613  12.835
  194   HH22  ARG  23          2HH2      ARG  23  -8.986  -7.987  12.574
  195    HA   PRO  24           HA       PRO  24  -2.327 -12.597   7.942
  196    HB2  PRO  24           2HB      PRO  24  -2.609 -15.442   8.324
  197    HB3  PRO  24           1HB      PRO  24  -1.161 -14.552   7.849
  198    HG2  PRO  24           2HG      PRO  24  -1.453 -15.856  10.259
  199    HG3  PRO  24           1HG      PRO  24  -0.345 -14.502   9.983
  200    HD2  PRO  24           2HD      PRO  24  -3.058 -14.507  11.246
  201    HD3  PRO  24           1HD      PRO  24  -1.600 -13.600  11.707
  202    H    SER  25           HN       SER  25  -4.499 -11.596   8.128
  203    HA   SER  25           HA       SER  25  -6.571 -13.532   7.443
  204    HB2  SER  25           2HB      SER  25  -6.973 -11.315   9.464
  205    HB3  SER  25           1HB      SER  25  -8.178 -12.490   8.942
  206    HG   SER  25           HG       SER  25  -6.115 -13.887   9.741
  207    H    SER  26           HN       SER  26  -8.284 -12.607   6.191
  208    HA   SER  26           HA       SER  26  -7.926  -9.861   5.278
  209    HB2  SER  26           2HB      SER  26  -7.898 -10.499   2.950
  210    HB3  SER  26           1HB      SER  26  -6.601 -11.370   3.770
  211    H    TRP  27           HN       TRP  27  -9.770  -9.411   3.623
  212    HA   TRP  27           HA       TRP  27 -12.216 -10.650   4.667
  213    HB2  TRP  27           2HB      TRP  27 -13.392  -8.652   4.033
  214    HB3  TRP  27           1HB      TRP  27 -11.960  -8.164   4.922
  215    HD1  TRP  27           1HD      TRP  27  -9.837  -7.297   3.262
  216    HE1  TRP  27           1HE      TRP  27  -9.990  -5.876   1.122
  217    HE3  TRP  27           3HE      TRP  27 -14.757  -8.089   2.117
  218    HZ2  TRP  27           2HZ      TRP  27 -11.950  -5.179  -0.792
  219    HZ3  TRP  27           3HZ      TRP  27 -15.691  -7.006   0.118
  220    HH2  TRP  27           2HH      TRP  27 -14.316  -5.581  -1.305
  221    H    ARG  28           HN       ARG  28 -10.152 -11.008   2.248
  222    HA   ARG  28           HA       ARG  28 -12.194 -11.474   0.187
  223    HB2  ARG  28           2HB      ARG  28  -9.221 -11.001  -0.056
  224    HB3  ARG  28           1HB      ARG  28 -10.256 -11.459  -1.399
  225    HG2  ARG  28           2HG      ARG  28 -10.672  -8.979   0.253
  226    HG3  ARG  28           1HG      ARG  28  -9.745  -9.021  -1.247
  227    HD2  ARG  28           2HD      ARG  28 -12.632  -9.869  -1.000
  228    HD3  ARG  28           1HD      ARG  28 -12.107  -8.274  -1.534
  229    HE   ARG  28           HE       ARG  28 -10.787 -10.056  -3.151
  230   HH11  ARG  28          1HH1      ARG  28 -14.157  -9.365  -2.442
  231   HH12  ARG  28          2HH1      ARG  28 -14.707  -9.809  -4.024
  232   HH21  ARG  28          1HH2      ARG  28 -11.520 -10.637  -5.244
  233   HH22  ARG  28          2HH2      ARG  28 -13.205 -10.516  -5.625
  234    H    GLN  29           HN       GLN  29  -9.779 -12.948   2.179
  235    HA   GLN  29           HA       GLN  29 -10.465 -15.547   1.010
  236    HB2  GLN  29           2HB      GLN  29  -7.709 -14.709   1.954
  237    HB3  GLN  29           1HB      GLN  29  -8.154 -16.305   1.372
  238    HG2  GLN  29           2HG      GLN  29  -7.570 -15.663  -0.663
  239    HG3  GLN  29           1HG      GLN  29  -8.930 -14.545  -0.648
  240   HE21  GLN  29          1HE2      GLN  29  -7.637 -12.982   1.560
  241   HE22  GLN  29          2HE2      GLN  29  -6.407 -12.048   0.781
  242    H    GLU  30           HN       GLU  30  -9.756 -17.329   2.607
  243    HA   GLU  30           HA       GLU  30 -10.735 -16.508   5.239
  244    HB2  GLU  30           2HB      GLU  30 -10.461 -19.269   4.055
  245    HB3  GLU  30           1HB      GLU  30 -11.159 -18.891   5.622
  246    HG2  GLU  30           2HG      GLU  30 -12.889 -17.544   4.444
  247    HG3  GLU  30           1HG      GLU  30 -12.236 -18.144   2.919
  248    H    LYS  31           HN       LYS  31  -8.129 -18.298   3.682
  249    HA   LYS  31           HA       LYS  31  -6.602 -18.061   6.177
  250    HB2  LYS  31           2HB      LYS  31  -5.414 -20.169   5.404
  251    HB3  LYS  31           1HB      LYS  31  -7.058 -20.363   5.991
  252    HG2  LYS  31           2HG      LYS  31  -7.881 -20.486   3.705
  253    HG3  LYS  31           1HG      LYS  31  -6.246 -20.237   3.093
  254    HD2  LYS  31           2HD      LYS  31  -6.996 -22.531   4.894
  255    HD3  LYS  31           1HD      LYS  31  -7.072 -22.628   3.134
  256    HE2  LYS  31           2HE      LYS  31  -4.594 -21.908   4.692
  257    HE3  LYS  31           1HE      LYS  31  -4.970 -23.530   4.124
  258    HZ1  LYS  31           3HZ      LYS  31  -4.961 -22.702   1.859
  259    HZ2  LYS  31           1HZ      LYS  31  -3.483 -22.380   2.605
  260    HZ3  LYS  31           2HZ      LYS  31  -4.607 -21.141   2.393
  261    H    ILE  32           HN       ILE  32  -4.645 -17.194   6.053
  262    HA   ILE  32           HA       ILE  32  -3.647 -16.483   3.387
  263    HB   ILE  32           HB       ILE  32  -3.038 -15.175   6.054
  264   HG12  ILE  32          2HG1      ILE  32  -5.326 -14.710   5.291
  265   HG13  ILE  32          1HG1      ILE  32  -4.327 -13.266   5.195
  266   HG21  ILE  32          1HG2      ILE  32  -2.202 -14.375   3.271
  267   HG22  ILE  32          2HG2      ILE  32  -1.152 -15.052   4.514
  268   HG23  ILE  32          3HG2      ILE  32  -1.883 -13.464   4.747
  269   HD11  ILE  32          3HD1      ILE  32  -5.765 -13.451   3.258
  270   HD12  ILE  32          1HD1      ILE  32  -5.108 -15.046   2.894
  271   HD13  ILE  32          2HD1      ILE  32  -4.076 -13.621   2.780
  272    H    THR  33           HN       THR  33  -2.393 -18.187   2.866
  273    HA   THR  33           HA       THR  33  -0.452 -19.142   4.831
  274    HB   THR  33           HB       THR  33  -0.195 -20.977   2.963
  275    HG1  THR  33           1HG      THR  33  -1.542 -20.132   1.403
  276   HG21  THR  33          3HG2      THR  33  -1.970 -22.265   4.065
  277   HG22  THR  33          1HG2      THR  33  -2.602 -20.782   4.778
  278   HG23  THR  33          2HG2      THR  33  -1.005 -21.370   5.238
  279    H    ARG  34           HN       ARG  34  -0.540 -16.970   2.387
  280    HA   ARG  34           HA       ARG  34   1.856 -17.566   1.000
  281    HB2  ARG  34           2HB      ARG  34   1.774 -15.228   0.237
  282    HB3  ARG  34           1HB      ARG  34   0.206 -16.004   0.088
  283    HG2  ARG  34           2HG      ARG  34  -0.479 -14.919   2.201
  284    HG3  ARG  34           1HG      ARG  34   1.064 -14.064   2.215
  285    HD2  ARG  34           2HD      ARG  34  -0.557 -12.596   1.290
  286    HD3  ARG  34           1HD      ARG  34   0.473 -13.141  -0.028
  287    HE   ARG  34           HE       ARG  34  -1.337 -14.731  -0.587
  288   HH11  ARG  34          1HH1      ARG  34  -2.088 -11.850   1.291
  289   HH12  ARG  34          2HH1      ARG  34  -3.725 -11.757   0.765
  290   HH21  ARG  34          1HH2      ARG  34  -3.512 -14.635  -1.277
  291   HH22  ARG  34          2HH2      ARG  34  -4.549 -13.375  -0.706
  292    H    THR  35           HN       THR  35   3.918 -17.410   1.664
  293    HA   THR  35           HA       THR  35   4.386 -16.412   4.325
  294    HB   THR  35           HB       THR  35   6.711 -17.358   3.965
  295    HG1  THR  35           1HG      THR  35   6.464 -19.008   2.080
  296   HG21  THR  35          3HG2      THR  35   5.960 -19.689   4.160
  297   HG22  THR  35          1HG2      THR  35   4.362 -19.222   3.577
  298   HG23  THR  35          2HG2      THR  35   4.951 -18.612   5.124
  299    H    LYS  36           HN       LYS  36   7.115 -16.175   2.262
  300    HA   LYS  36           HA       LYS  36   7.153 -13.294   2.753
  301    HB2  LYS  36           2HB      LYS  36   9.110 -14.710   3.391
  302    HB3  LYS  36           1HB      LYS  36   9.372 -15.050   1.687
  303    HG2  LYS  36           2HG      LYS  36   9.759 -12.682   1.264
  304    HG3  LYS  36           1HG      LYS  36   9.480 -12.328   2.970
  305    HD2  LYS  36           2HD      LYS  36  11.380 -13.851   3.518
  306    HD3  LYS  36           1HD      LYS  36  11.702 -13.987   1.788
  307    HE2  LYS  36           2HE      LYS  36  11.732 -11.437   3.401
  308    HE3  LYS  36           1HE      LYS  36  13.150 -12.320   2.845
  309    HZ1  LYS  36           3HZ      LYS  36  12.608 -10.422   1.436
  310    HZ2  LYS  36           1HZ      LYS  36  11.108 -11.100   1.071
  311    HZ3  LYS  36           2HZ      LYS  36  12.524 -11.871   0.573
  312    H    GLU  37           HN       GLU  37   8.323 -15.273   0.051
  313    HA   GLU  37           HA       GLU  37   7.992 -13.149  -1.827
  314    HB2  GLU  37           2HB      GLU  37   8.572 -16.080  -2.272
  315    HB3  GLU  37           1HB      GLU  37   8.717 -14.815  -3.484
  316    HG2  GLU  37           2HG      GLU  37  10.455 -13.740  -2.170
  317    HG3  GLU  37           1HG      GLU  37  10.302 -14.989  -0.936
  318    H    GLU  38           HN       GLU  38   6.073 -15.757  -0.720
  319    HA   GLU  38           HA       GLU  38   4.351 -16.118  -2.904
  320    HB2  GLU  38           2HB      GLU  38   3.624 -16.419   0.005
  321    HB3  GLU  38           1HB      GLU  38   2.896 -17.242  -1.367
  322    HG2  GLU  38           2HG      GLU  38   5.704 -17.611  -0.347
  323    HG3  GLU  38           1HG      GLU  38   4.358 -18.730  -0.145
  324    H    ALA  39           HN       ALA  39   4.560 -13.634  -0.533
  325    HA   ALA  39           HA       ALA  39   1.942 -12.553  -1.263
  326    HB1  ALA  39           1HB      ALA  39   2.311 -10.957   0.550
  327    HB2  ALA  39           2HB      ALA  39   3.935 -11.604   0.797
  328    HB3  ALA  39           3HB      ALA  39   2.524 -12.614   1.115
  329    H    LEU  40           HN       LEU  40   5.334 -12.075  -1.669
  330    HA   LEU  40           HA       LEU  40   5.293  -9.402  -2.578
  331    HB2  LEU  40           2HB      LEU  40   7.305 -10.547  -1.742
  332    HB3  LEU  40           1HB      LEU  40   7.284 -11.594  -3.146
  333    HG   LEU  40           HG       LEU  40   7.668  -9.628  -4.593
  334   HD11  LEU  40          1HD1      LEU  40   7.914  -8.156  -1.975
  335   HD12  LEU  40          2HD1      LEU  40   6.689  -7.898  -3.218
  336   HD13  LEU  40          3HD1      LEU  40   8.379  -7.517  -3.550
  337   HD21  LEU  40          3HD2      LEU  40   9.677 -10.010  -2.377
  338   HD22  LEU  40          1HD2      LEU  40  10.006  -9.283  -3.952
  339   HD23  LEU  40          2HD2      LEU  40   9.543 -10.982  -3.844
  340    H    GLU  41           HN       GLU  41   4.907 -12.513  -4.182
  341    HA   GLU  41           HA       GLU  41   5.149 -11.595  -6.825
  342    HB2  GLU  41           2HB      GLU  41   3.912 -13.650  -7.464
  343    HB3  GLU  41           1HB      GLU  41   5.257 -13.956  -6.376
  344    HG2  GLU  41           2HG      GLU  41   3.743 -14.205  -4.517
  345    HG3  GLU  41           1HG      GLU  41   2.376 -13.778  -5.544
  346    H    LEU  42           HN       LEU  42   2.449 -11.520  -4.594
  347    HA   LEU  42           HA       LEU  42   0.476 -10.763  -6.497
  348    HB2  LEU  42           2HB      LEU  42   0.686 -10.582  -3.514
  349    HB3  LEU  42           1HB      LEU  42  -0.570  -9.684  -4.332
  350    HG   LEU  42           HG       LEU  42  -1.412 -11.831  -5.286
  351   HD11  LEU  42          1HD1      LEU  42   0.578 -13.163  -5.198
  352   HD12  LEU  42          2HD1      LEU  42  -0.680 -13.927  -4.229
  353   HD13  LEU  42          3HD1      LEU  42   0.629 -13.047  -3.440
  354   HD21  LEU  42          3HD2      LEU  42  -2.435 -12.611  -3.204
  355   HD22  LEU  42          1HD2      LEU  42  -2.433 -10.851  -3.313
  356   HD23  LEU  42          2HD2      LEU  42  -1.261 -11.671  -2.282
  357    H    ILE  43           HN       ILE  43   2.467  -8.955  -4.215
  358    HA   ILE  43           HA       ILE  43   1.670  -6.368  -4.821
  359    HB   ILE  43           HB       ILE  43   4.398  -7.373  -3.989
  360   HG12  ILE  43          2HG1      ILE  43   2.544  -7.887  -2.427
  361   HG13  ILE  43          1HG1      ILE  43   3.723  -6.782  -1.735
  362   HG21  ILE  43          1HG2      ILE  43   3.317  -4.563  -4.017
  363   HG22  ILE  43          2HG2      ILE  43   4.690  -5.189  -4.928
  364   HG23  ILE  43          3HG2      ILE  43   4.781  -5.058  -3.172
  365   HD11  ILE  43          3HD1      ILE  43   1.483  -6.102  -1.154
  366   HD12  ILE  43          1HD1      ILE  43   1.030  -6.041  -2.856
  367   HD13  ILE  43          2HD1      ILE  43   2.218  -4.905  -2.218
  368    H    ASN  44           HN       ASN  44   4.427  -8.166  -6.165
  369    HA   ASN  44           HA       ASN  44   5.214  -6.215  -8.016
  370    HB2  ASN  44           2HB      ASN  44   5.601  -9.209  -8.031
  371    HB3  ASN  44           1HB      ASN  44   6.349  -8.130  -9.203
  372   HD21  ASN  44          1HD2      ASN  44   7.557  -9.879  -7.203
  373   HD22  ASN  44          2HD2      ASN  44   8.549  -8.856  -6.226
  374    H    GLY  45           HN       GLY  45   2.893  -8.844  -8.245
  375    HA2  GLY  45           2HA      GLY  45   2.377  -8.743 -10.993
  376    HA3  GLY  45           1HA      GLY  45   1.237  -9.277  -9.767
  377    H    TYR  46           HN       TYR  46   0.916  -6.922  -8.318
  378    HA   TYR  46           HA       TYR  46  -0.940  -5.514  -9.918
  379    HB2  TYR  46           2HB      TYR  46   0.333  -4.648  -7.307
  380    HB3  TYR  46           1HB      TYR  46  -1.096  -3.928  -8.035
  381    HD1  TYR  46           2HD      TYR  46  -2.685  -6.222  -8.840
  382    HD2  TYR  46           1HD      TYR  46  -0.326  -5.673  -5.343
  383    HE1  TYR  46           2HE      TYR  46  -4.090  -7.841  -7.645
  384    HE2  TYR  46           1HE      TYR  46  -1.725  -7.296  -4.138
  385    HH   TYR  46           HH       TYR  46  -4.052  -8.201  -4.304
  386    H    ILE  47           HN       ILE  47   2.321  -4.748  -8.797
  387    HA   ILE  47           HA       ILE  47   2.611  -2.192  -9.835
  388    HB   ILE  47           HB       ILE  47   4.711  -4.363  -9.569
  389   HG12  ILE  47          2HG1      ILE  47   3.978  -2.062  -7.741
  390   HG13  ILE  47          1HG1      ILE  47   3.577  -3.753  -7.467
  391   HG21  ILE  47          1HG2      ILE  47   5.485  -2.645 -11.117
  392   HG22  ILE  47          2HG2      ILE  47   6.373  -2.558  -9.596
  393   HG23  ILE  47          3HG2      ILE  47   5.097  -1.391  -9.939
  394   HD11  ILE  47          3HD1      ILE  47   5.470  -3.063  -6.118
  395   HD12  ILE  47          1HD1      ILE  47   6.351  -2.588  -7.571
  396   HD13  ILE  47          2HD1      ILE  47   5.956  -4.283  -7.296
  397    H    GLN  48           HN       GLN  48   2.829  -5.293 -11.484
  398    HA   GLN  48           HA       GLN  48   4.014  -4.413 -13.882
  399    HB2  GLN  48           2HB      GLN  48   1.984  -6.640 -13.591
  400    HB3  GLN  48           1HB      GLN  48   3.115  -6.431 -14.916
  401    HG2  GLN  48           2HG      GLN  48   3.742  -7.171 -12.068
  402    HG3  GLN  48           1HG      GLN  48   3.919  -8.172 -13.503
  403   HE21  GLN  48          1HE2      GLN  48   5.287  -5.679 -11.567
  404   HE22  GLN  48          2HE2      GLN  48   6.807  -5.572 -12.386
  405    H    LYS  49           HN       LYS  49   0.634  -4.539 -12.850
  406    HA   LYS  49           HA       LYS  49  -0.327  -3.550 -15.382
  407    HB2  LYS  49           2HB      LYS  49  -1.721  -4.057 -12.755
  408    HB3  LYS  49           1HB      LYS  49  -2.538  -3.481 -14.198
  409    HG2  LYS  49           2HG      LYS  49  -1.862  -5.529 -15.372
  410    HG3  LYS  49           1HG      LYS  49  -1.106  -6.109 -13.886
  411    HD2  LYS  49           2HD      LYS  49  -3.244  -6.098 -12.751
  412    HD3  LYS  49           1HD      LYS  49  -4.024  -5.389 -14.167
  413    HE2  LYS  49           2HE      LYS  49  -3.476  -7.393 -15.464
  414    HE3  LYS  49           1HE      LYS  49  -2.708  -8.103 -14.046
  415    HZ1  LYS  49           3HZ      LYS  49  -4.977  -8.903 -14.397
  416    HZ2  LYS  49           1HZ      LYS  49  -5.565  -7.330 -14.231
  417    HZ3  LYS  49           2HZ      LYS  49  -4.827  -8.097 -12.919
  418    H    ILE  50           HN       ILE  50   0.136  -2.273 -12.116
  419    HA   ILE  50           HA       ILE  50  -1.168   0.167 -12.405
  420    HB   ILE  50           HB       ILE  50   1.271  -0.433 -10.717
  421   HG12  ILE  50          2HG1      ILE  50  -1.652  -0.375  -9.942
  422   HG13  ILE  50          1HG1      ILE  50  -0.773  -1.849 -10.336
  423   HG21  ILE  50          1HG2      ILE  50  -0.716   1.834 -10.509
  424   HG22  ILE  50          2HG2      ILE  50   0.962   1.976 -11.032
  425   HG23  ILE  50          3HG2      ILE  50   0.594   1.501  -9.375
  426   HD11  ILE  50          3HD1      ILE  50  -0.982  -1.485  -7.924
  427   HD12  ILE  50          1HD1      ILE  50  -0.094   0.031  -8.085
  428   HD13  ILE  50          2HD1      ILE  50   0.702  -1.500  -8.452
  429    H    LYS  51           HN       LYS  51   2.223  -0.613 -13.122
  430    HA   LYS  51           HA       LYS  51   2.764   2.084 -13.947
  431    HB2  LYS  51           2HB      LYS  51   4.395  -0.439 -14.188
  432    HB3  LYS  51           1HB      LYS  51   4.964   1.141 -14.702
  433    HG2  LYS  51           2HG      LYS  51   4.162   0.397 -11.890
  434    HG3  LYS  51           1HG      LYS  51   5.815   0.531 -12.488
  435    HD2  LYS  51           2HD      LYS  51   3.820   2.805 -12.481
  436    HD3  LYS  51           1HD      LYS  51   5.017   2.534 -11.222
  437    HE2  LYS  51           2HE      LYS  51   6.819   2.824 -12.812
  438    HE3  LYS  51           1HE      LYS  51   5.667   2.961 -14.137
  439    HZ1  LYS  51           3HZ      LYS  51   6.473   5.124 -13.431
  440    HZ2  LYS  51           1HZ      LYS  51   5.906   4.865 -11.855
  441    HZ3  LYS  51           2HZ      LYS  51   4.818   4.986 -13.142
  442    H    SER  52           HN       SER  52   1.084  -0.340 -15.402
  443    HA   SER  52           HA       SER  52   1.903   0.370 -18.109
  444    HB2  SER  52           2HB      SER  52  -0.089  -1.671 -17.099
  445    HB3  SER  52           1HB      SER  52   0.297  -1.399 -18.797
  446    HG   SER  52           HG       SER  52   1.949  -2.445 -16.743
  447    H    GLY  53           HN       GLY  53  -0.472   1.129 -15.756
  448    HA2  GLY  53           2HA      GLY  53  -2.139   2.702 -15.764
  449    HA3  GLY  53           1HA      GLY  53  -1.560   3.218 -17.338
  450    H    GLU  54           HN       GLU  54  -2.916   0.127 -16.235
  451    HA   GLU  54           HA       GLU  54  -5.133   0.513 -18.138
  452    HB2  GLU  54           2HB      GLU  54  -4.990  -1.886 -18.727
  453    HB3  GLU  54           1HB      GLU  54  -3.554  -0.989 -19.195
  454    HG2  GLU  54           2HG      GLU  54  -2.348  -1.862 -17.284
  455    HG3  GLU  54           1HG      GLU  54  -3.795  -2.701 -16.731
  456    H    GLU  55           HN       GLU  55  -4.488   0.428 -15.074
  457    HA   GLU  55           HA       GLU  55  -6.837  -1.184 -14.359
  458    HB2  GLU  55           2HB      GLU  55  -5.501  -1.561 -12.146
  459    HB3  GLU  55           1HB      GLU  55  -5.170  -2.563 -13.548
  460    HG2  GLU  55           2HG      GLU  55  -3.154  -1.752 -12.301
  461    HG3  GLU  55           1HG      GLU  55  -3.163  -1.400 -14.025
  462    H    ASP  56           HN       ASP  56  -6.903  -0.640 -11.693
  463    HA   ASP  56           HA       ASP  56  -6.745   2.243 -11.368
  464    HB2  ASP  56           2HB      ASP  56  -9.080   1.779 -12.000
  465    HB3  ASP  56           1HB      ASP  56  -9.203   0.628 -10.671
  466    H    PHE  57           HN       PHE  57  -5.469   2.536  -9.706
  467    HA   PHE  57           HA       PHE  57  -4.624   0.543  -7.971
  468    HB2  PHE  57           2HB      PHE  57  -3.432   2.698  -8.464
  469    HB3  PHE  57           1HB      PHE  57  -4.561   3.502  -7.380
  470    HD1  PHE  57           1HD      PHE  57  -1.796   1.111  -7.600
  471    HD2  PHE  57           2HD      PHE  57  -4.366   3.273  -4.997
  472    HE1  PHE  57           1HE      PHE  57  -0.338   0.543  -5.698
  473    HE2  PHE  57           2HE      PHE  57  -2.914   2.712  -3.093
  474    HZ   PHE  57           HZ       PHE  57  -0.898   1.346  -3.442
  475    H    GLU  58           HN       GLU  58  -7.200   2.910  -7.593
  476    HA   GLU  58           HA       GLU  58  -7.714   2.474  -4.872
  477    HB2  GLU  58           2HB      GLU  58  -9.483   3.395  -7.122
  478    HB3  GLU  58           1HB      GLU  58 -10.032   3.326  -5.456
  479    HG2  GLU  58           2HG      GLU  58  -8.201   4.865  -4.836
  480    HG3  GLU  58           1HG      GLU  58  -7.768   4.980  -6.542
  481    H    SER  59           HN       SER  59  -9.146   0.988  -7.758
  482    HA   SER  59           HA       SER  59 -10.872  -0.749  -6.384
  483    HB2  SER  59           2HB      SER  59 -10.939  -0.186  -8.854
  484    HB3  SER  59           1HB      SER  59  -9.583  -1.293  -9.068
  485    HG   SER  59           HG       SER  59 -12.241  -1.817  -8.707
  486    H    LEU  60           HN       LEU  60  -7.515  -1.080  -7.431
  487    HA   LEU  60           HA       LEU  60  -7.194  -3.801  -6.712
  488    HB2  LEU  60           2HB      LEU  60  -5.146  -1.595  -6.932
  489    HB3  LEU  60           1HB      LEU  60  -4.762  -3.294  -6.761
  490    HG   LEU  60           HG       LEU  60  -6.220  -2.071  -9.106
  491   HD11  LEU  60          1HD1      LEU  60  -3.889  -1.386  -9.033
  492   HD12  LEU  60          2HD1      LEU  60  -4.162  -2.534 -10.343
  493   HD13  LEU  60          3HD1      LEU  60  -3.387  -3.067  -8.851
  494   HD21  LEU  60          3HD2      LEU  60  -5.878  -4.266 -10.152
  495   HD22  LEU  60          1HD2      LEU  60  -6.892  -4.376  -8.713
  496   HD23  LEU  60          2HD2      LEU  60  -5.202  -4.873  -8.640
  497    H    ALA  61           HN       ALA  61  -6.591  -0.778  -4.984
  498    HA   ALA  61           HA       ALA  61  -5.506  -1.994  -2.659
  499    HB1  ALA  61           1HB      ALA  61  -5.697   0.197  -1.648
  500    HB2  ALA  61           2HB      ALA  61  -6.746   0.733  -2.961
  501    HB3  ALA  61           3HB      ALA  61  -5.060   0.333  -3.287
  502    H    SER  62           HN       SER  62  -8.628  -1.898  -3.825
  503    HA   SER  62           HA       SER  62  -9.787  -2.111  -1.158
  504    HB2  SER  62           2HB      SER  62 -11.173  -1.856  -3.833
  505    HB3  SER  62           1HB      SER  62 -11.954  -1.826  -2.251
  506    HG   SER  62           HG       SER  62 -10.083   0.046  -3.288
  507    H    GLN  63           HN       GLN  63 -10.268  -3.724  -4.315
  508    HA   GLN  63           HA       GLN  63 -11.372  -6.033  -2.966
  509    HB2  GLN  63           2HB      GLN  63 -10.951  -5.455  -5.892
  510    HB3  GLN  63           1HB      GLN  63 -11.770  -6.876  -5.260
  511    HG2  GLN  63           2HG      GLN  63 -13.492  -5.489  -4.282
  512    HG3  GLN  63           1HG      GLN  63 -12.647  -4.033  -4.805
  513   HE21  GLN  63          1HE2      GLN  63 -12.688  -3.456  -6.961
  514   HE22  GLN  63          2HE2      GLN  63 -13.795  -4.153  -8.087
  515    H    PHE  64           HN       PHE  64  -8.266  -5.149  -4.064
  516    HA   PHE  64           HA       PHE  64  -7.468  -7.984  -4.068
  517    HB2  PHE  64           2HB      PHE  64  -6.327  -5.648  -5.595
  518    HB3  PHE  64           1HB      PHE  64  -5.470  -7.175  -5.416
  519    HD1  PHE  64           1HD      PHE  64  -8.398  -5.523  -6.901
  520    HD2  PHE  64           2HD      PHE  64  -6.148  -9.123  -6.621
  521    HE1  PHE  64           1HE      PHE  64  -9.612  -6.430  -8.835
  522    HE2  PHE  64           2HE      PHE  64  -7.361 -10.036  -8.558
  523    HZ   PHE  64           HZ       PHE  64  -9.096  -8.688  -9.666
  524    H    SER  65           HN       SER  65  -7.723  -5.996  -1.860
  525    HA   SER  65           HA       SER  65  -4.990  -6.258  -0.823
  526    HB2  SER  65           2HB      SER  65  -5.574  -3.887  -1.286
  527    HB3  SER  65           1HB      SER  65  -6.971  -4.039  -0.224
  528    HG   SER  65           HG       SER  65  -4.559  -4.797   0.897
  529    H    ASP  66           HN       ASP  66  -4.801  -7.084   1.229
  530    HA   ASP  66           HA       ASP  66  -7.137  -8.451   2.282
  531    HB2  ASP  66           2HB      ASP  66  -4.335  -8.401   3.417
  532    HB3  ASP  66           1HB      ASP  66  -5.599  -9.563   3.781
  533    H    ALA  67           HN       ALA  67  -6.427  -5.415   2.481
  534    HA   ALA  67           HA       ALA  67  -6.581  -5.143   5.391
  535    HB1  ALA  67           1HB      ALA  67  -5.786  -2.895   5.092
  536    HB2  ALA  67           2HB      ALA  67  -5.906  -3.051   3.341
  537    HB3  ALA  67           3HB      ALA  67  -4.729  -4.014   4.233
  538    H    SER  68           HN       SER  68  -7.938  -3.476   6.268
  539    HA   SER  68           HA       SER  68 -10.571  -3.485   5.155
  540    HB2  SER  68           2HB      SER  68  -9.470  -1.942   7.514
  541    HB3  SER  68           1HB      SER  68 -11.174  -2.202   7.145
  542    HG   SER  68           HG       SER  68 -10.650  -4.506   7.290
  543    H    SER  69           HN       SER  69  -7.877  -1.715   4.474
  544    HA   SER  69           HA       SER  69  -8.639   0.940   4.320
  545    HB2  SER  69           2HB      SER  69  -6.827  -0.556   2.426
  546    HB3  SER  69           1HB      SER  69  -6.870   1.190   2.672
  547    HG   SER  69           HG       SER  69  -6.595   0.073   5.059
  548    H    ALA  70           HN       ALA  70  -9.744  -1.698   2.398
  549    HA   ALA  70           HA       ALA  70 -10.544  -0.595   0.019
  550    HB1  ALA  70           1HB      ALA  70 -12.330  -2.254  -0.002
  551    HB2  ALA  70           2HB      ALA  70 -12.138  -2.500   1.733
  552    HB3  ALA  70           3HB      ALA  70 -10.840  -2.955   0.630
  553    H    LYS  71           HN       LYS  71 -11.876  -0.025   3.202
  554    HA   LYS  71           HA       LYS  71 -14.364   1.068   2.537
  555    HB2  LYS  71           2HB      LYS  71 -14.286   2.156   4.741
  556    HB3  LYS  71           1HB      LYS  71 -13.779   0.477   4.825
  557    HG2  LYS  71           2HG      LYS  71 -11.401   1.288   4.772
  558    HG3  LYS  71           1HG      LYS  71 -12.030   2.928   4.937
  559    HD2  LYS  71           2HD      LYS  71 -12.616   0.693   6.881
  560    HD3  LYS  71           1HD      LYS  71 -11.306   1.855   7.086
  561    HE2  LYS  71           2HE      LYS  71 -14.218   2.592   6.825
  562    HE3  LYS  71           1HE      LYS  71 -13.375   2.411   8.359
  563    HZ1  LYS  71           3HZ      LYS  71 -13.429   4.713   7.744
  564    HZ2  LYS  71           1HZ      LYS  71 -12.759   4.387   6.228
  565    HZ3  LYS  71           2HZ      LYS  71 -11.837   4.175   7.628
  566    H    ALA  72           HN       ALA  72 -11.193   2.385   2.175
  567    HA   ALA  72           HA       ALA  72 -12.375   4.925   1.266
  568    HB1  ALA  72           1HB      ALA  72 -10.442   6.124   2.161
  569    HB2  ALA  72           2HB      ALA  72  -9.799   4.615   2.808
  570    HB3  ALA  72           3HB      ALA  72 -11.308   5.275   3.441
  571    H    ARG  73           HN       ARG  73 -11.334   2.327   0.048
  572    HA   ARG  73           HA       ARG  73 -10.278   1.630  -1.825
  573    HB2  ARG  73           2HB      ARG  73 -10.198   4.576  -2.464
  574    HB3  ARG  73           1HB      ARG  73  -9.713   3.313  -3.581
  575    HG2  ARG  73           2HG      ARG  73 -11.825   3.491  -4.308
  576    HG3  ARG  73           1HG      ARG  73 -12.198   2.474  -2.914
  577    HD2  ARG  73           2HD      ARG  73 -13.682   4.392  -3.000
  578    HD3  ARG  73           1HD      ARG  73 -12.637   4.478  -1.580
  579    HE   ARG  73           HE       ARG  73 -11.418   5.892  -3.685
  580   HH11  ARG  73          1HH1      ARG  73 -14.208   6.127  -1.563
  581   HH12  ARG  73          2HH1      ARG  73 -14.276   7.851  -1.618
  582   HH21  ARG  73          1HH2      ARG  73 -11.495   8.182  -3.757
  583   HH22  ARG  73          2HH2      ARG  73 -12.726   9.030  -2.881
  584    H    GLY  74           HN       GLY  74  -8.717   2.640   0.614
  585    HA2  GLY  74           2HA      GLY  74  -6.483   2.199   1.131
  586    HA3  GLY  74           1HA      GLY  74  -6.130   2.118  -0.584
  587    H    ASP  75           HN       ASP  75  -7.761   4.868  -0.469
  588    HA   ASP  75           HA       ASP  75  -5.341   6.440  -0.452
  589    HB2  ASP  75           2HB      ASP  75  -7.112   6.813  -2.153
  590    HB3  ASP  75           1HB      ASP  75  -8.186   7.366  -0.872
  591    H    LEU  76           HN       LEU  76  -4.659   7.831   1.047
  592    HA   LEU  76           HA       LEU  76  -6.127   7.833   3.583
  593    HB2  LEU  76           2HB      LEU  76  -3.318   8.779   2.990
  594    HB3  LEU  76           1HB      LEU  76  -4.055   8.700   4.573
  595    HG   LEU  76           HG       LEU  76  -4.248   6.152   4.104
  596   HD11  LEU  76          1HD1      LEU  76  -2.085   6.906   2.149
  597   HD12  LEU  76          2HD1      LEU  76  -3.670   6.251   1.741
  598   HD13  LEU  76          3HD1      LEU  76  -2.516   5.268   2.641
  599   HD21  LEU  76          3HD2      LEU  76  -1.992   5.803   4.988
  600   HD22  LEU  76          1HD2      LEU  76  -2.812   7.133   5.806
  601   HD23  LEU  76          2HD2      LEU  76  -1.580   7.472   4.590
  602    H    GLY  77           HN       GLY  77  -5.593   9.794   0.894
  603    HA2  GLY  77           2HA      GLY  77  -6.362  11.949   0.505
  604    HA3  GLY  77           1HA      GLY  77  -6.773  12.078   2.215
  605    H    ALA  78           HN       ALA  78  -5.750  14.274   1.775
  606    HA   ALA  78           HA       ALA  78  -2.863  14.263   1.611
  607    HB1  ALA  78           1HB      ALA  78  -3.040  16.688   1.763
  608    HB2  ALA  78           2HB      ALA  78  -4.749  16.555   2.173
  609    HB3  ALA  78           3HB      ALA  78  -4.186  16.069   0.575
  610    H    PHE  79           HN       PHE  79  -1.785  13.558   3.345
  611    HA   PHE  79           HA       PHE  79  -2.710  14.463   5.995
  612    HB2  PHE  79           2HB      PHE  79  -1.942  12.348   6.945
  613    HB3  PHE  79           1HB      PHE  79  -3.130  12.064   5.681
  614    HD1  PHE  79           2HD      PHE  79  -2.419  11.144   3.500
  615    HD2  PHE  79           1HD      PHE  79   0.303  11.561   6.747
  616    HE1  PHE  79           2HE      PHE  79  -0.860   9.601   2.387
  617    HE2  PHE  79           1HE      PHE  79   1.866  10.017   5.641
  618    HZ   PHE  79           HZ       PHE  79   1.286   9.035   3.458
  619    H    SER  80           HN       SER  80  -1.012  14.453   7.664
  620    HA   SER  80           HA       SER  80   1.545  15.358   6.549
  621    HB2  SER  80           2HB      SER  80   0.286  15.959   9.239
  622    HB3  SER  80           1HB      SER  80   1.817  16.607   8.650
  623    HG   SER  80           HG       SER  80   0.665  17.605   6.954
  624    H    ARG  81           HN       ARG  81   3.456  14.888   7.930
  625    HA   ARG  81           HA       ARG  81   3.548  12.111   8.485
  626    HB2  ARG  81           2HB      ARG  81   5.905  12.573   9.222
  627    HB3  ARG  81           1HB      ARG  81   5.521  13.082   7.590
  628    HG2  ARG  81           2HG      ARG  81   6.766  14.852   8.373
  629    HG3  ARG  81           1HG      ARG  81   5.123  15.406   8.681
  630    HD2  ARG  81           2HD      ARG  81   5.298  14.787  11.003
  631    HD3  ARG  81           1HD      ARG  81   6.878  14.055  10.727
  632    HE   ARG  81           HE       ARG  81   6.731  16.837  10.006
  633   HH11  ARG  81          1HH1      ARG  81   7.323  14.591  12.627
  634   HH12  ARG  81          2HH1      ARG  81   8.319  15.681  13.523
  635   HH21  ARG  81          1HH2      ARG  81   8.045  18.305  11.192
  636   HH22  ARG  81          2HH2      ARG  81   8.717  17.814  12.708
  637    H    GLY  82           HN       GLY  82   4.147  11.068  10.437
  638    HA2  GLY  82           2HA      GLY  82   4.360  11.040  12.816
  639    HA3  GLY  82           1HA      GLY  82   3.434  12.534  12.884
  640    H    GLN  83           HN       GLN  83   2.464   9.901  10.818
  641    HA   GLN  83           HA       GLN  83   0.279   9.276  12.699
  642    HB2  GLN  83           2HB      GLN  83   0.013   9.700   9.725
  643    HB3  GLN  83           1HB      GLN  83  -1.258   9.075  10.761
  644    HG2  GLN  83           2HG      GLN  83  -1.135  11.211  12.054
  645    HG3  GLN  83           1HG      GLN  83  -0.032  11.818  10.819
  646   HE21  GLN  83          1HE2      GLN  83  -1.435  10.391   8.679
  647   HE22  GLN  83          2HE2      GLN  83  -2.896  11.266   8.396
  648    H    MET  84           HN       MET  84   2.415   8.145  10.143
  649    HA   MET  84           HA       MET  84   1.429   5.402  10.654
  650    HB2  MET  84           2HB      MET  84   2.450   6.589   8.072
  651    HB3  MET  84           1HB      MET  84   2.164   4.873   8.317
  652    HG2  MET  84           2HG      MET  84   0.061   7.007   8.580
  653    HG3  MET  84           1HG      MET  84   0.338   6.045   7.129
  654    HE1  MET  84           3HE      MET  84  -3.049   4.683   8.700
  655    HE2  MET  84           1HE      MET  84  -2.321   5.446   7.285
  656    HE3  MET  84           2HE      MET  84  -2.453   6.340   8.800
  657    H    GLN  85           HN       GLN  85   3.126   3.724   9.908
  658    HA   GLN  85           HA       GLN  85   5.405   3.965  11.504
  659    HB2  GLN  85           2HB      GLN  85   4.848   2.105   9.188
  660    HB3  GLN  85           1HB      GLN  85   6.247   1.958  10.238
  661    HG2  GLN  85           2HG      GLN  85   4.879   0.469  11.257
  662    HG3  GLN  85           1HG      GLN  85   4.376   1.923  12.111
  663   HE21  GLN  85          1HE2      GLN  85   2.959  -0.567  11.588
  664   HE22  GLN  85          2HE2      GLN  85   1.497  -0.116  10.768
  665    H    LYS  86           HN       LYS  86   7.457   4.570  11.130
  666    HA   LYS  86           HA       LYS  86   8.000   6.611   9.402
  667    HB2  LYS  86           2HB      LYS  86   9.356   6.005  11.385
  668    HB3  LYS  86           1HB      LYS  86  10.062   4.682  10.472
  669    HG2  LYS  86           2HG      LYS  86  11.585   6.537  10.495
  670    HG3  LYS  86           1HG      LYS  86  10.963   6.317   8.860
  671    HD2  LYS  86           2HD      LYS  86   9.391   8.143   9.180
  672    HD3  LYS  86           1HD      LYS  86   9.915   8.330  10.854
  673    HE2  LYS  86           2HE      LYS  86  11.654   8.715   8.418
  674    HE3  LYS  86           1HE      LYS  86  10.920  10.009   9.364
  675    HZ1  LYS  86           3HZ      LYS  86  13.232   9.623   9.971
  676    HZ2  LYS  86           1HZ      LYS  86  12.875   8.030  10.407
  677    HZ3  LYS  86           2HZ      LYS  86  12.201   9.310  11.272
  678    HA   PRO  87           HA       PRO  87  10.301   3.557   6.262
  679    HB2  PRO  87           2HB      PRO  87   9.090   1.059   6.192
  680    HB3  PRO  87           1HB      PRO  87  10.623   1.421   6.990
  681    HG2  PRO  87           2HG      PRO  87   7.876   1.235   8.164
  682    HG3  PRO  87           1HG      PRO  87   9.416   0.639   8.813
  683    HD2  PRO  87           2HD      PRO  87   8.317   2.870   9.749
  684    HD3  PRO  87           1HD      PRO  87  10.075   2.757   9.515
  685    H    PHE  88           HN       PHE  88   6.905   3.461   7.016
  686    HA   PHE  88           HA       PHE  88   6.138   3.163   4.217
  687    HB2  PHE  88           2HB      PHE  88   4.861   1.892   5.843
  688    HB3  PHE  88           1HB      PHE  88   4.533   3.341   6.779
  689    HD1  PHE  88           2HD      PHE  88   2.844   4.926   6.054
  690    HD2  PHE  88           1HD      PHE  88   3.656   1.402   3.814
  691    HE1  PHE  88           2HE      PHE  88   0.742   5.233   4.823
  692    HE2  PHE  88           1HE      PHE  88   1.549   1.703   2.580
  693    HZ   PHE  88           HZ       PHE  88   0.092   3.621   3.087
  694    H    GLU  89           HN       GLU  89   5.856   5.439   6.874
  695    HA   GLU  89           HA       GLU  89   4.379   7.406   5.506
  696    HB2  GLU  89           2HB      GLU  89   4.497   7.140   7.952
  697    HB3  GLU  89           1HB      GLU  89   6.168   7.676   7.911
  698    HG2  GLU  89           2HG      GLU  89   5.471   9.840   7.085
  699    HG3  GLU  89           1HG      GLU  89   3.791   9.304   7.074
  700    H    ASP  90           HN       ASP  90   7.839   7.296   6.383
  701    HA   ASP  90           HA       ASP  90   8.546   9.742   5.211
  702    HB2  ASP  90           2HB      ASP  90  10.006   8.598   6.797
  703    HB3  ASP  90           1HB      ASP  90  10.254   7.283   5.655
  704    H    ALA  91           HN       ALA  91   8.222   6.558   3.837
  705    HA   ALA  91           HA       ALA  91   9.590   6.955   1.434
  706    HB1  ALA  91           1HB      ALA  91   8.343   5.042   0.596
  707    HB2  ALA  91           2HB      ALA  91   7.209   5.176   1.938
  708    HB3  ALA  91           3HB      ALA  91   8.893   4.751   2.245
  709    H    SER  92           HN       SER  92   6.159   7.480   2.235
  710    HA   SER  92           HA       SER  92   5.322   8.141  -0.358
  711    HB2  SER  92           2HB      SER  92   3.328   9.121   0.705
  712    HB3  SER  92           1HB      SER  92   3.732   7.561   1.416
  713    HG   SER  92           HG       SER  92   4.820   8.813   3.113
  714    H    PHE  93           HN       PHE  93   6.590  10.180   2.230
  715    HA   PHE  93           HA       PHE  93   6.145  12.640   0.872
  716    HB2  PHE  93           2HB      PHE  93   7.914  11.903   3.201
  717    HB3  PHE  93           1HB      PHE  93   7.799  13.541   2.571
  718    HD1  PHE  93           2HD      PHE  93   6.061  10.887   4.388
  719    HD2  PHE  93           1HD      PHE  93   5.813  14.865   2.906
  720    HE1  PHE  93           2HE      PHE  93   4.095  11.291   5.809
  721    HE2  PHE  93           1HE      PHE  93   3.851  15.279   4.327
  722    HZ   PHE  93           HZ       PHE  93   2.988  13.489   5.781
  723    H    ALA  94           HN       ALA  94   8.582  10.227   0.664
  724    HA   ALA  94           HA       ALA  94  10.514  12.006  -0.581
  725    HB1  ALA  94           1HB      ALA  94  11.968  10.055  -0.655
  726    HB2  ALA  94           2HB      ALA  94  10.642   9.033  -0.102
  727    HB3  ALA  94           3HB      ALA  94  11.298  10.278   0.961
  728    H    LEU  95           HN       LEU  95   7.827  10.330  -1.581
  729    HA   LEU  95           HA       LEU  95   8.822   9.481  -4.160
  730    HB2  LEU  95           2HB      LEU  95   5.988   9.699  -3.150
  731    HB3  LEU  95           1HB      LEU  95   6.478   8.931  -4.643
  732    HG   LEU  95           HG       LEU  95   7.176   8.002  -1.863
  733   HD11  LEU  95          1HD1      LEU  95   5.355   6.783  -3.931
  734   HD12  LEU  95          2HD1      LEU  95   4.820   7.690  -2.518
  735   HD13  LEU  95          3HD1      LEU  95   5.681   6.166  -2.311
  736   HD21  LEU  95          3HD2      LEU  95   8.143   6.057  -2.954
  737   HD22  LEU  95          1HD2      LEU  95   8.955   7.527  -3.489
  738   HD23  LEU  95          2HD2      LEU  95   7.775   6.739  -4.537
  739    H    ARG  96           HN       ARG  96   7.437  10.205  -6.111
  740    HA   ARG  96           HA       ARG  96   7.332  13.134  -6.057
  741    HB2  ARG  96           2HB      ARG  96   7.548  11.253  -8.416
  742    HB3  ARG  96           1HB      ARG  96   7.512  13.007  -8.514
  743    HG2  ARG  96           2HG      ARG  96   9.593  13.079  -7.181
  744    HG3  ARG  96           1HG      ARG  96   9.644  11.316  -7.235
  745    HD2  ARG  96           2HD      ARG  96   9.652  11.466  -9.720
  746    HD3  ARG  96           1HD      ARG  96   9.774  13.217  -9.566
  747    HE   ARG  96           HE       ARG  96  11.807  11.833  -8.108
  748   HH11  ARG  96          1HH1      ARG  96  10.916  13.051 -11.273
  749   HH12  ARG  96          2HH1      ARG  96  12.546  13.139 -11.840
  750   HH21  ARG  96          1HH2      ARG  96  13.972  11.944  -8.857
  751   HH22  ARG  96          2HH2      ARG  96  14.291  12.523 -10.456
  752    H    THR  97           HN       THR  97   5.591  14.200  -7.063
  753    HA   THR  97           HA       THR  97   3.070  13.110  -6.496
  754    HB   THR  97           HB       THR  97   3.798  15.495  -8.211
  755    HG1  THR  97           1HG      THR  97   2.986  15.371  -5.476
  756   HG21  THR  97          3HG2      THR  97   1.506  16.269  -7.612
  757   HG22  THR  97          1HG2      THR  97   1.195  14.680  -6.918
  758   HG23  THR  97          2HG2      THR  97   1.514  14.839  -8.645
  759    H    GLY  98           HN       GLY  98   2.145  11.498  -7.586
  760    HA2  GLY  98           2HA      GLY  98   0.984  10.727  -9.495
  761    HA3  GLY  98           1HA      GLY  98   2.085  11.653 -10.507
  762    H    GLU  99           HN       GLU  99   3.600   9.912  -7.997
  763    HA   GLU  99           HA       GLU  99   4.246   7.754  -9.882
  764    HB2  GLU  99           2HB      GLU  99   6.091   9.408  -9.733
  765    HB3  GLU  99           1HB      GLU  99   6.199   9.103  -8.008
  766    HG2  GLU  99           2HG      GLU  99   7.926   7.925  -9.280
  767    HG3  GLU  99           1HG      GLU  99   6.866   6.819  -8.413
  768    H    MET 100           HN       MET 100   4.914   5.767  -8.935
  769    HA   MET 100           HA       MET 100   3.709   5.321  -6.283
  770    HB2  MET 100           2HB      MET 100   2.611   4.185  -8.192
  771    HB3  MET 100           1HB      MET 100   4.128   3.383  -8.566
  772    HG2  MET 100           2HG      MET 100   4.040   2.303  -6.336
  773    HG3  MET 100           1HG      MET 100   2.449   3.022  -6.098
  774    HE1  MET 100           3HE      MET 100   3.452  -0.146  -9.291
  775    HE2  MET 100           1HE      MET 100   4.598   0.467  -8.099
  776    HE3  MET 100           2HE      MET 100   4.036   1.513  -9.404
  777    H    SER 101           HN       SER 101   4.781   3.874  -4.843
  778    HA   SER 101           HA       SER 101   7.674   3.847  -5.166
  779    HB2  SER 101           2HB      SER 101   7.699   3.209  -2.792
  780    HB3  SER 101           1HB      SER 101   6.710   4.647  -3.047
  781    HG   SER 101           HG       SER 101   5.975   2.088  -2.278
  782    H    GLY 102           HN       GLY 102   8.636   1.762  -4.002
  783    HA2  GLY 102           2HA      GLY 102   7.591  -0.533  -5.472
  784    HA3  GLY 102           1HA      GLY 102   9.159  -0.428  -4.671
  785    HA   PRO 103           HA       PRO 103   6.060  -2.892  -2.060
  786    HB2  PRO 103           2HB      PRO 103   7.925  -4.883  -1.552
  787    HB3  PRO 103           1HB      PRO 103   6.686  -4.965  -2.805
  788    HG2  PRO 103           2HG      PRO 103   9.568  -4.213  -3.037
  789    HG3  PRO 103           1HG      PRO 103   8.567  -5.179  -4.136
  790    HD2  PRO 103           2HD      PRO 103   9.169  -2.630  -4.680
  791    HD3  PRO 103           1HD      PRO 103   7.575  -3.305  -5.076
  792    H    VAL 104           HN       VAL 104   6.034  -1.725  -0.212
  793    HA   VAL 104           HA       VAL 104   8.536  -1.453   1.286
  794    HB   VAL 104           HB       VAL 104   7.204   0.630   0.841
  795   HG11  VAL 104          1HG1      VAL 104   5.203  -0.587   2.712
  796   HG12  VAL 104          2HG1      VAL 104   4.977  -0.268   0.990
  797   HG13  VAL 104          3HG1      VAL 104   5.189   1.074   2.117
  798   HG21  VAL 104          3HG2      VAL 104   7.370   1.527   3.123
  799   HG22  VAL 104          1HG2      VAL 104   8.778   0.557   2.690
  800   HG23  VAL 104          2HG2      VAL 104   7.534  -0.115   3.746
  801    H    PHE 105           HN       PHE 105   8.841  -2.419   3.214
  802    HA   PHE 105           HA       PHE 105   6.724  -4.275   4.051
  803    HB2  PHE 105           2HB      PHE 105   9.705  -4.500   4.489
  804    HB3  PHE 105           1HB      PHE 105   8.494  -5.701   4.923
  805    HD1  PHE 105           2HD      PHE 105  10.328  -4.136   2.165
  806    HD2  PHE 105           1HD      PHE 105   7.511  -7.122   3.259
  807    HE1  PHE 105           2HE      PHE 105  10.568  -5.163  -0.051
  808    HE2  PHE 105           1HE      PHE 105   7.748  -8.157   1.041
  809    HZ   PHE 105           HZ       PHE 105   9.279  -7.178  -0.617
  810    H    THR 106           HN       THR 106   5.763  -3.876   5.906
  811    HA   THR 106           HA       THR 106   7.331  -2.653   8.066
  812    HB   THR 106           HB       THR 106   5.396  -1.351   8.811
  813    HG1  THR 106           1HG      THR 106   3.513  -1.279   7.602
  814   HG21  THR 106          3HG2      THR 106   5.293   0.311   7.040
  815   HG22  THR 106          1HG2      THR 106   5.912  -0.862   5.876
  816   HG23  THR 106          2HG2      THR 106   6.937  -0.307   7.196
  817    H    ASP 107           HN       ASP 107   5.453  -2.773  10.060
  818    HA   ASP 107           HA       ASP 107   5.492  -5.552  10.706
  819    HB2  ASP 107           2HB      ASP 107   4.451  -4.876  12.814
  820    HB3  ASP 107           1HB      ASP 107   5.810  -3.833  12.421
  821    H    SER 108           HN       SER 108   3.323  -3.710   8.932
  822    HA   SER 108           HA       SER 108   1.030  -5.356   9.702
  823    HB2  SER 108           2HB      SER 108   0.754  -2.878   9.622
  824    HB3  SER 108           1HB      SER 108   1.091  -2.929   7.893
  825    HG   SER 108           HG       SER 108  -1.226  -3.165   9.014
  826    H    GLY 109           HN       GLY 109   3.500  -5.522   7.535
  827    HA2  GLY 109           2HA      GLY 109   3.348  -7.531   6.083
  828    HA3  GLY 109           1HA      GLY 109   1.797  -6.898   5.553
  829    H    ILE 110           HN       ILE 110   2.530  -6.948   3.386
  830    HA   ILE 110           HA       ILE 110   4.682  -5.078   2.702
  831    HB   ILE 110           HB       ILE 110   3.212  -6.885   0.777
  832   HG12  ILE 110          2HG1      ILE 110   5.731  -7.539   2.328
  833   HG13  ILE 110          1HG1      ILE 110   4.150  -8.252   2.625
  834   HG21  ILE 110          1HG2      ILE 110   5.927  -5.562   0.731
  835   HG22  ILE 110          2HG2      ILE 110   4.522  -5.120  -0.242
  836   HG23  ILE 110          3HG2      ILE 110   5.329  -6.669  -0.502
  837   HD11  ILE 110          3HD1      ILE 110   5.591  -9.743   1.350
  838   HD12  ILE 110          1HD1      ILE 110   5.753  -8.518   0.092
  839   HD13  ILE 110          2HD1      ILE 110   4.182  -9.255   0.407
  840    H    HIS 111           HN       HIS 111   4.252  -3.169   1.713
  841    HA   HIS 111           HA       HIS 111   1.450  -2.684   0.927
  842    HB2  HIS 111           2HB      HIS 111   3.223  -0.580   2.175
  843    HB3  HIS 111           1HB      HIS 111   1.504  -0.479   1.845
  844    HD1  HIS 111           1HD      HIS 111   0.113  -0.731   3.869
  845    HD2  HIS 111           2HD      HIS 111   3.744  -2.703   4.234
  846    HE1  HIS 111           1HE      HIS 111   0.160  -1.621   6.209
  847    HE2  HIS 111           2HE      HIS 111   2.500  -2.510   6.469
  848    H    ILE 112           HN       ILE 112   1.156  -0.966  -0.552
  849    HA   ILE 112           HA       ILE 112   3.484  -0.221  -2.194
  850    HB   ILE 112           HB       ILE 112   0.690  -0.587  -3.288
  851   HG12  ILE 112          2HG1      ILE 112   2.962  -2.581  -3.443
  852   HG13  ILE 112          1HG1      ILE 112   1.505  -2.779  -2.475
  853   HG21  ILE 112          1HG2      ILE 112   3.384  -0.383  -4.624
  854   HG22  ILE 112          2HG2      ILE 112   2.152   0.878  -4.553
  855   HG23  ILE 112          3HG2      ILE 112   1.843  -0.606  -5.454
  856   HD11  ILE 112          3HD1      ILE 112   0.163  -2.768  -4.531
  857   HD12  ILE 112          1HD1      ILE 112   1.353  -4.069  -4.516
  858   HD13  ILE 112          2HD1      ILE 112   1.641  -2.621  -5.479
  859    H    ILE 113           HN       ILE 113   3.506   1.980  -2.735
  860    HA   ILE 113           HA       ILE 113   1.258   3.558  -1.673
  861    HB   ILE 113           HB       ILE 113   4.172   4.331  -1.600
  862   HG12  ILE 113          2HG1      ILE 113   2.382   3.533   0.704
  863   HG13  ILE 113          1HG1      ILE 113   3.591   2.484  -0.027
  864   HG21  ILE 113          1HG2      ILE 113   1.733   5.670  -0.421
  865   HG22  ILE 113          2HG2      ILE 113   2.665   6.242  -1.805
  866   HG23  ILE 113          3HG2      ILE 113   3.400   6.202  -0.203
  867   HD11  ILE 113          3HD1      ILE 113   4.403   3.486   2.029
  868   HD12  ILE 113          1HD1      ILE 113   4.131   5.097   1.364
  869   HD13  ILE 113          2HD1      ILE 113   5.345   4.038   0.645
  870    H    LEU 114           HN       LEU 114   0.288   4.669  -3.221
  871    HA   LEU 114           HA       LEU 114   1.910   5.618  -5.485
  872    HB2  LEU 114           2HB      LEU 114  -0.024   3.979  -5.924
  873    HB3  LEU 114           1HB      LEU 114  -1.094   5.293  -5.486
  874    HG   LEU 114           HG       LEU 114   0.900   5.526  -7.745
  875   HD11  LEU 114          1HD1      LEU 114  -0.936   5.007  -9.269
  876   HD12  LEU 114          2HD1      LEU 114  -1.973   4.636  -7.892
  877   HD13  LEU 114          3HD1      LEU 114  -0.555   3.641  -8.220
  878   HD21  LEU 114          3HD2      LEU 114  -0.003   7.635  -6.884
  879   HD22  LEU 114          1HD2      LEU 114  -1.644   7.032  -7.118
  880   HD23  LEU 114          2HD2      LEU 114  -0.597   7.304  -8.511
  881    H    ARG 115           HN       ARG 115   2.398   7.683  -5.255
  882    HA   ARG 115           HA       ARG 115   0.780   9.360  -3.530
  883    HB2  ARG 115           2HB      ARG 115   3.188   9.475  -3.275
  884    HB3  ARG 115           1HB      ARG 115   3.379   9.887  -4.973
  885    HG2  ARG 115           2HG      ARG 115   2.274  12.008  -4.622
  886    HG3  ARG 115           1HG      ARG 115   1.950  11.587  -2.938
  887    HD2  ARG 115           2HD      ARG 115   4.310  11.543  -2.454
  888    HD3  ARG 115           1HD      ARG 115   4.696  11.817  -4.152
  889    HE   ARG 115           HE       ARG 115   3.143  13.952  -3.491
  890   HH11  ARG 115          1HH1      ARG 115   6.018  12.537  -2.061
  891   HH12  ARG 115          2HH1      ARG 115   6.681  14.054  -1.559
  892   HH21  ARG 115          1HH2      ARG 115   4.015  15.969  -2.801
  893   HH22  ARG 115          2HH2      ARG 115   5.536  16.006  -1.980
  894    H    THR 116           HN       THR 116  -0.896  10.406  -4.327
  895    HA   THR 116           HA       THR 116  -1.039  10.956  -7.158
  896    HB   THR 116           HB       THR 116  -3.333  11.892  -6.458
  897    HG1  THR 116           1HG      THR 116  -3.942  10.785  -4.381
  898   HG21  THR 116          3HG2      THR 116  -4.298   9.640  -6.336
  899   HG22  THR 116          1HG2      THR 116  -2.703   8.974  -5.978
  900   HG23  THR 116          2HG2      THR 116  -3.019   9.713  -7.549
  901    H    GLU 117           HN       GLU 117  -0.950  12.738  -4.097
  902    HA   GLU 117           HA       GLU 117  -0.215  15.144  -5.624
  903    HB2  GLU 117           2HB      GLU 117  -1.892  15.102  -3.106
  904    HB3  GLU 117           1HB      GLU 117  -1.385  16.531  -3.987
  905    HG2  GLU 117           2HG      GLU 117  -3.229  14.393  -5.042
  906    HG3  GLU 117           1HG      GLU 117  -3.727  15.957  -4.403
  Start of MODEL    6
    1    H1   GLY   1           1HT      GLY   1  14.027  28.053   6.692
    2    H2   GLY   1           2HT      GLY   1  14.885  27.038   7.728
    3    H3   GLY   1           3HT      GLY   1  14.091  28.392   8.346
    4    HA2  GLY   1           1HA      GLY   1  12.853  26.380   8.835
    5    HA3  GLY   1           2HA      GLY   1  11.959  27.458   7.775
    6    H    SER   2           HN       SER   2  11.675  24.583   8.097
    7    HA   SER   2           HA       SER   2  12.789  23.399   5.728
    8    HB2  SER   2           2HB      SER   2  10.645  22.321   7.578
    9    HB3  SER   2           1HB      SER   2  11.593  21.397   6.412
   10    HG   SER   2           HG       SER   2  13.425  22.455   7.764
   11    H    HIS   3           HN       HIS   3  12.004  24.623   4.020
   12    HA   HIS   3           HA       HIS   3   9.173  25.084   3.737
   13    HB2  HIS   3           2HB      HIS   3  10.753  26.767   2.920
   14    HB3  HIS   3           1HB      HIS   3  11.435  25.598   1.793
   15    HD1  HIS   3           1HD      HIS   3  10.639  26.052  -0.502
   16    HD2  HIS   3           2HD      HIS   3   7.713  26.888   2.323
   17    HE1  HIS   3           1HE      HIS   3   8.633  26.796  -1.807
   18    HE2  HIS   3           2HE      HIS   3   6.820  27.066  -0.088
   19    H    MET   4           HN       MET   4  11.579  22.919   2.385
   20    HA   MET   4           HA       MET   4   9.707  21.765   0.534
   21    HB2  MET   4           2HB      MET   4  12.492  20.947   1.352
   22    HB3  MET   4           1HB      MET   4  11.532  20.071   0.168
   23    HG2  MET   4           2HG      MET   4  11.424  22.102  -1.209
   24    HG3  MET   4           1HG      MET   4  12.447  22.929  -0.036
   25    HE1  MET   4           3HE      MET   4  14.537  20.696   0.796
   26    HE2  MET   4           1HE      MET   4  14.963  22.362   0.401
   27    HE3  MET   4           2HE      MET   4  15.826  21.025  -0.360
   28    H    GLU   5           HN       GLU   5   9.511  19.278   0.579
   29    HA   GLU   5           HA       GLU   5   8.461  17.517   1.517
   30    HB2  GLU   5           2HB      GLU   5  10.286  18.290   3.791
   31    HB3  GLU   5           1HB      GLU   5   9.175  16.937   3.932
   32    HG2  GLU   5           2HG      GLU   5  11.323  16.089   3.331
   33    HG3  GLU   5           1HG      GLU   5  10.255  15.914   1.948
   34    HA   PRO   6           HA       PRO   6   5.164  20.287   3.123
   35    HB2  PRO   6           2HB      PRO   6   3.580  18.086   1.910
   36    HB3  PRO   6           1HB      PRO   6   3.403  19.833   1.723
   37    HG2  PRO   6           2HG      PRO   6   4.433  18.361  -0.238
   38    HG3  PRO   6           1HG      PRO   6   5.085  19.969   0.132
   39    HD2  PRO   6           2HD      PRO   6   6.183  17.273   0.818
   40    HD3  PRO   6           1HD      PRO   6   7.037  18.740   0.297
   41    H    ALA   7           HN       ALA   7   3.922  20.084   4.927
   42    HA   ALA   7           HA       ALA   7   4.464  17.884   6.664
   43    HB1  ALA   7           1HB      ALA   7   3.046  19.069   8.263
   44    HB2  ALA   7           2HB      ALA   7   2.532  20.179   6.993
   45    HB3  ALA   7           3HB      ALA   7   4.214  20.161   7.520
   46    H    ARG   8           HN       ARG   8   2.011  18.670   4.401
   47    HA   ARG   8           HA       ARG   8   0.495  16.280   5.199
   48    HB2  ARG   8           2HB      ARG   8  -0.657  18.918   4.267
   49    HB3  ARG   8           1HB      ARG   8  -1.583  17.448   4.526
   50    HG2  ARG   8           2HG      ARG   8  -1.094  17.493   6.880
   51    HG3  ARG   8           1HG      ARG   8  -0.014  18.870   6.662
   52    HD2  ARG   8           2HD      ARG   8  -1.899  20.230   5.915
   53    HD3  ARG   8           1HD      ARG   8  -2.981  18.853   6.120
   54    HE   ARG   8           HE       ARG   8  -1.778  19.160   8.551
   55   HH11  ARG   8          1HH1      ARG   8  -3.666  21.249   6.458
   56   HH12  ARG   8          2HH1      ARG   8  -4.364  22.140   7.769
   57   HH21  ARG   8          1HH2      ARG   8  -2.675  20.360  10.287
   58   HH22  ARG   8          2HH2      ARG   8  -3.790  21.639   9.955
   59    H    VAL   9           HN       VAL   9   0.419  14.843   3.621
   60    HA   VAL   9           HA       VAL   9   0.314  15.738   0.826
   61    HB   VAL   9           HB       VAL   9   1.835  13.864   0.163
   62   HG11  VAL   9          1HG1      VAL   9   3.065  15.920   1.995
   63   HG12  VAL   9          2HG1      VAL   9   2.701  16.131   0.282
   64   HG13  VAL   9          3HG1      VAL   9   3.932  14.972   0.787
   65   HG21  VAL   9          3HG2      VAL   9   3.303  12.865   1.868
   66   HG22  VAL   9          1HG2      VAL   9   1.607  12.464   2.140
   67   HG23  VAL   9          2HG2      VAL   9   2.391  13.698   3.127
   68    H    ARG  10           HN       ARG  10  -0.281  13.797  -0.630
   69    HA   ARG  10           HA       ARG  10  -2.201  12.121   0.848
   70    HB2  ARG  10           2HB      ARG  10  -3.384  13.752  -0.513
   71    HB3  ARG  10           1HB      ARG  10  -2.465  13.248  -1.926
   72    HG2  ARG  10           2HG      ARG  10  -3.464  11.009  -1.756
   73    HG3  ARG  10           1HG      ARG  10  -4.446  11.578  -0.408
   74    HD2  ARG  10           2HD      ARG  10  -5.540  13.183  -1.824
   75    HD3  ARG  10           1HD      ARG  10  -4.471  12.780  -3.168
   76    HE   ARG  10           HE       ARG  10  -6.100  10.623  -2.069
   77   HH11  ARG  10          1HH1      ARG  10  -5.711  13.032  -4.610
   78   HH12  ARG  10          2HH1      ARG  10  -6.746  12.195  -5.723
   79   HH21  ARG  10          1HH2      ARG  10  -7.481   9.561  -3.530
   80   HH22  ARG  10          2HH2      ARG  10  -7.749  10.214  -5.115
   81    H    CYS  11           HN       CYS  11  -1.754  10.063   0.807
   82    HA   CYS  11           HA       CYS  11  -0.648   8.892  -1.626
   83    HB2  CYS  11           2HB      CYS  11   0.368   8.253   1.153
   84    HB3  CYS  11           1HB      CYS  11   0.895   7.503  -0.345
   85    HG   CYS  11           HG       CYS  11   2.780   9.359   0.815
   86    H    SER  12           HN       SER  12  -1.439   6.934  -2.114
   87    HA   SER  12           HA       SER  12  -3.564   5.901  -0.406
   88    HB2  SER  12           2HB      SER  12  -2.788   5.105  -3.226
   89    HB3  SER  12           1HB      SER  12  -4.273   4.669  -2.378
   90    HG   SER  12           HG       SER  12  -4.426   7.165  -2.223
   91    H    HIS  13           HN       HIS  13  -3.613   3.512  -0.036
   92    HA   HIS  13           HA       HIS  13  -0.937   2.328  -0.077
   93    HB2  HIS  13           2HB      HIS  13  -0.980   1.749   2.287
   94    HB3  HIS  13           1HB      HIS  13  -1.101   3.489   2.085
   95    HD1  HIS  13           1HD      HIS  13  -2.107   1.624   4.554
   96    HD2  HIS  13           2HD      HIS  13  -4.450   3.520   1.702
   97    HE1  HIS  13           1HE      HIS  13  -4.366   1.886   5.608
   98    HE2  HIS  13           2HE      HIS  13  -5.812   2.814   3.773
   99    H    LEU  14           HN       LEU  14  -0.847   0.197  -0.262
  100    HA   LEU  14           HA       LEU  14  -3.375  -1.323  -0.226
  101    HB2  LEU  14           2HB      LEU  14  -2.069  -0.911  -2.457
  102    HB3  LEU  14           1HB      LEU  14  -0.938  -2.083  -1.825
  103    HG   LEU  14           HG       LEU  14  -3.864  -2.708  -2.208
  104   HD11  LEU  14          1HD1      LEU  14  -1.593  -3.145  -4.142
  105   HD12  LEU  14          2HD1      LEU  14  -2.940  -2.028  -4.353
  106   HD13  LEU  14          3HD1      LEU  14  -3.233  -3.766  -4.318
  107   HD21  LEU  14          3HD2      LEU  14  -3.081  -5.019  -2.218
  108   HD22  LEU  14          1HD2      LEU  14  -2.613  -4.206  -0.724
  109   HD23  LEU  14          2HD2      LEU  14  -1.420  -4.468  -1.998
  110    H    LEU  15           HN       LEU  15  -3.395  -3.160   1.048
  111    HA   LEU  15           HA       LEU  15  -0.893  -3.746   2.486
  112    HB2  LEU  15           2HB      LEU  15  -3.748  -3.883   3.441
  113    HB3  LEU  15           1HB      LEU  15  -2.419  -4.610   4.312
  114    HG   LEU  15           HG       LEU  15  -2.888  -2.564   5.387
  115   HD11  LEU  15          1HD1      LEU  15  -0.843  -1.304   5.148
  116   HD12  LEU  15          2HD1      LEU  15  -0.519  -2.085   3.603
  117   HD13  LEU  15          3HD1      LEU  15  -0.518  -3.036   5.090
  118   HD21  LEU  15          3HD2      LEU  15  -2.950  -0.400   4.238
  119   HD22  LEU  15          1HD2      LEU  15  -4.205  -1.491   3.652
  120   HD23  LEU  15          2HD2      LEU  15  -2.752  -1.223   2.690
  121    H    VAL  16           HN       VAL  16  -0.101  -5.716   2.406
  122    HA   VAL  16           HA       VAL  16  -1.866  -7.940   1.633
  123    HB   VAL  16           HB       VAL  16   0.974  -7.591   0.634
  124   HG11  VAL  16          1HG1      VAL  16  -1.108  -9.673  -0.019
  125   HG12  VAL  16          2HG1      VAL  16   0.354  -9.920   0.937
  126   HG13  VAL  16          3HG1      VAL  16   0.478  -9.531  -0.779
  127   HG21  VAL  16          3HG2      VAL  16   0.013  -7.251  -1.569
  128   HG22  VAL  16          1HG2      VAL  16  -0.539  -6.005  -0.452
  129   HG23  VAL  16          2HG2      VAL  16  -1.613  -7.333  -0.893
  130    H    LYS  17           HN       LYS  17  -1.984  -8.950   3.583
  131    HA   LYS  17           HA       LYS  17   0.262  -9.295   5.324
  132    HB2  LYS  17           2HB      LYS  17  -2.335 -10.844   5.211
  133    HB3  LYS  17           1HB      LYS  17  -1.171 -10.910   6.521
  134    HG2  LYS  17           2HG      LYS  17  -2.699  -8.457   5.682
  135    HG3  LYS  17           1HG      LYS  17  -3.123  -9.513   7.029
  136    HD2  LYS  17           2HD      LYS  17  -1.002  -8.988   8.116
  137    HD3  LYS  17           1HD      LYS  17  -0.552  -7.957   6.756
  138    HE2  LYS  17           2HE      LYS  17  -2.945  -7.544   8.547
  139    HE3  LYS  17           1HE      LYS  17  -1.420  -6.668   8.663
  140    HZ1  LYS  17           3HZ      LYS  17  -3.110  -5.419   7.456
  141    HZ2  LYS  17           1HZ      LYS  17  -3.226  -6.649   6.293
  142    HZ3  LYS  17           2HZ      LYS  17  -1.784  -5.767   6.475
  143    H    HIS  18           HN       HIS  18   1.197 -11.385   5.896
  144    HA   HIS  18           HA       HIS  18   1.063 -13.370   3.756
  145    HB2  HIS  18           2HB      HIS  18   3.576 -13.801   4.186
  146    HB3  HIS  18           1HB      HIS  18   3.128 -12.427   3.190
  147    HD1  HIS  18           1HD      HIS  18   3.813 -12.936   6.936
  148    HD2  HIS  18           2HD      HIS  18   4.617 -10.293   3.829
  149    HE1  HIS  18           1HE      HIS  18   5.283 -11.165   7.917
  150    HE2  HIS  18           2HE      HIS  18   5.967  -9.756   5.961
  151    H    SER  19           HN       SER  19   1.681 -15.517   4.377
  152    HA   SER  19           HA       SER  19   0.279 -16.621   6.360
  153    HB2  SER  19           2HB      SER  19   1.484 -17.930   4.670
  154    HB3  SER  19           1HB      SER  19   3.006 -17.610   5.499
  155    HG   SER  19           HG       SER  19   0.807 -18.874   6.763
  156    H    GLN  20           HN       GLN  20   3.739 -15.861   6.844
  157    HA   GLN  20           HA       GLN  20   3.560 -16.269   9.672
  158    HB2  GLN  20           2HB      GLN  20   5.721 -14.635   8.355
  159    HB3  GLN  20           1HB      GLN  20   5.839 -15.659   9.774
  160    HG2  GLN  20           2HG      GLN  20   6.933 -16.957   8.261
  161    HG3  GLN  20           1HG      GLN  20   5.290 -17.558   8.032
  162   HE21  GLN  20          1HE2      GLN  20   7.871 -15.710   6.684
  163   HE22  GLN  20          2HE2      GLN  20   7.220 -15.559   5.091
  164    H    SER  21           HN       SER  21   1.869 -14.930  10.356
  165    HA   SER  21           HA       SER  21   2.480 -12.063  10.297
  166    HB2  SER  21           2HB      SER  21   0.767 -12.542   8.594
  167    HB3  SER  21           1HB      SER  21  -0.242 -13.302   9.824
  168    HG   SER  21           HG       SER  21  -0.988 -11.255   9.711
  169    H    ARG  22           HN       ARG  22   1.714 -10.861  12.042
  170    HA   ARG  22           HA       ARG  22   1.512 -12.273  14.516
  171    HB2  ARG  22           2HB      ARG  22   1.272 -10.045  15.525
  172    HB3  ARG  22           1HB      ARG  22   2.613 -10.089  14.393
  173    HG2  ARG  22           2HG      ARG  22   0.980  -9.115  12.688
  174    HG3  ARG  22           1HG      ARG  22  -0.061  -8.773  14.073
  175    HD2  ARG  22           2HD      ARG  22   1.285  -6.830  13.543
  176    HD3  ARG  22           1HD      ARG  22   1.776  -7.496  15.101
  177    HE   ARG  22           HE       ARG  22   3.411  -8.671  13.214
  178   HH11  ARG  22          1HH1      ARG  22   2.768  -5.406  14.333
  179   HH12  ARG  22          2HH1      ARG  22   4.361  -4.838  13.970
  180   HH21  ARG  22          1HH2      ARG  22   5.517  -7.922  12.739
  181   HH22  ARG  22          2HH2      ARG  22   5.936  -6.270  13.052
  182    H    ARG  23           HN       ARG  23  -0.676 -11.093  12.169
  183    HA   ARG  23           HA       ARG  23  -2.894 -12.233  13.654
  184    HB2  ARG  23           2HB      ARG  23  -3.010  -9.868  14.263
  185    HB3  ARG  23           1HB      ARG  23  -2.938  -9.407  12.570
  186    HG2  ARG  23           2HG      ARG  23  -5.091 -10.637  12.230
  187    HG3  ARG  23           1HG      ARG  23  -5.174 -10.842  13.981
  188    HD2  ARG  23           2HD      ARG  23  -5.222  -8.457  14.303
  189    HD3  ARG  23           1HD      ARG  23  -4.961  -8.182  12.582
  190    HE   ARG  23           HE       ARG  23  -7.355  -9.652  13.404
  191   HH11  ARG  23          1HH1      ARG  23  -5.932  -6.692  12.162
  192   HH12  ARG  23          2HH1      ARG  23  -7.434  -6.049  11.606
  193   HH21  ARG  23          1HH2      ARG  23  -9.349  -8.801  12.669
  194   HH22  ARG  23          2HH2      ARG  23  -9.393  -7.248  11.902
  195    HA   PRO  24           HA       PRO  24  -3.031 -13.414   9.230
  196    HB2  PRO  24           2HB      PRO  24  -4.052 -15.952  10.270
  197    HB3  PRO  24           1HB      PRO  24  -2.606 -15.654   9.300
  198    HG2  PRO  24           2HG      PRO  24  -2.486 -16.402  11.901
  199    HG3  PRO  24           1HG      PRO  24  -1.266 -15.358  11.149
  200    HD2  PRO  24           2HD      PRO  24  -3.577 -14.609  12.905
  201    HD3  PRO  24           1HD      PRO  24  -1.907 -14.000  12.917
  202    H    SER  25           HN       SER  25  -4.806 -11.850   9.215
  203    HA   SER  25           HA       SER  25  -7.370 -13.182   8.955
  204    HB2  SER  25           2HB      SER  25  -7.051 -10.750  10.735
  205    HB3  SER  25           1HB      SER  25  -8.554 -11.600  10.378
  206    HG   SER  25           HG       SER  25  -6.701 -13.326  11.278
  207    H    SER  26           HN       SER  26  -8.849 -12.011   7.664
  208    HA   SER  26           HA       SER  26  -7.979  -9.503   6.472
  209    HB2  SER  26           2HB      SER  26  -6.964 -10.998   4.926
  210    HB3  SER  26           1HB      SER  26  -8.345 -12.091   4.955
  211    H    TRP  27           HN       TRP  27  -9.715  -8.584   5.062
  212    HA   TRP  27           HA       TRP  27 -12.296  -8.950   6.307
  213    HB2  TRP  27           2HB      TRP  27 -13.007  -7.021   5.075
  214    HB3  TRP  27           1HB      TRP  27 -11.359  -6.689   5.590
  215    HD1  TRP  27           1HD      TRP  27  -9.465  -6.637   3.644
  216    HE1  TRP  27           1HE      TRP  27  -9.626  -6.270   1.119
  217    HE3  TRP  27           3HE      TRP  27 -14.476  -7.454   3.038
  218    HZ2  TRP  27           2HZ      TRP  27 -11.618  -6.313  -0.885
  219    HZ3  TRP  27           3HZ      TRP  27 -15.427  -7.268   0.779
  220    HH2  TRP  27           2HH      TRP  27 -14.027  -6.710  -1.142
  221    H    ARG  28           HN       ARG  28 -10.628  -9.945   3.477
  222    HA   ARG  28           HA       ARG  28 -13.093 -10.885   2.205
  223    HB2  ARG  28           2HB      ARG  28 -11.573 -11.341   0.244
  224    HB3  ARG  28           1HB      ARG  28 -11.749  -9.650   0.688
  225    HG2  ARG  28           2HG      ARG  28  -9.606  -9.606   1.706
  226    HG3  ARG  28           1HG      ARG  28  -9.448 -11.358   1.595
  227    HD2  ARG  28           2HD      ARG  28  -9.689  -9.538  -0.786
  228    HD3  ARG  28           1HD      ARG  28  -8.149 -10.055  -0.101
  229    HE   ARG  28           HE       ARG  28  -9.718 -12.324  -0.621
  230   HH11  ARG  28          1HH1      ARG  28  -8.088  -9.780  -2.378
  231   HH12  ARG  28          2HH1      ARG  28  -7.707 -10.782  -3.742
  232   HH21  ARG  28          1HH2      ARG  28  -9.207 -13.668  -2.438
  233   HH22  ARG  28          2HH2      ARG  28  -8.343 -12.989  -3.772
  234    H    GLN  29           HN       GLN  29 -10.102 -12.001   3.639
  235    HA   GLN  29           HA       GLN  29 -11.054 -14.762   3.262
  236    HB2  GLN  29           2HB      GLN  29  -8.191 -13.809   3.435
  237    HB3  GLN  29           1HB      GLN  29  -8.697 -15.489   3.332
  238    HG2  GLN  29           2HG      GLN  29  -9.744 -14.958   1.135
  239    HG3  GLN  29           1HG      GLN  29  -9.019 -13.355   1.240
  240   HE21  GLN  29          1HE2      GLN  29  -8.463 -16.723   0.757
  241   HE22  GLN  29          2HE2      GLN  29  -6.827 -16.592   0.212
  242    H    GLU  30           HN       GLU  30 -11.015 -16.119   5.005
  243    HA   GLU  30           HA       GLU  30 -10.783 -14.820   7.594
  244    HB2  GLU  30           2HB      GLU  30 -11.767 -17.551   6.773
  245    HB3  GLU  30           1HB      GLU  30 -11.671 -17.015   8.443
  246    HG2  GLU  30           2HG      GLU  30 -13.238 -15.218   7.972
  247    HG3  GLU  30           1HG      GLU  30 -13.317 -15.722   6.284
  248    H    LYS  31           HN       LYS  31  -8.719 -16.283   5.563
  249    HA   LYS  31           HA       LYS  31  -6.894 -16.958   7.725
  250    HB2  LYS  31           2HB      LYS  31  -6.220 -19.041   6.614
  251    HB3  LYS  31           1HB      LYS  31  -7.912 -19.093   7.089
  252    HG2  LYS  31           2HG      LYS  31  -8.612 -18.673   4.827
  253    HG3  LYS  31           1HG      LYS  31  -6.940 -18.449   4.312
  254    HD2  LYS  31           2HD      LYS  31  -6.463 -20.778   4.910
  255    HD3  LYS  31           1HD      LYS  31  -8.146 -20.988   5.397
  256    HE2  LYS  31           2HE      LYS  31  -8.878 -20.514   3.125
  257    HE3  LYS  31           1HE      LYS  31  -7.207 -20.245   2.629
  258    HZ1  LYS  31           3HZ      LYS  31  -8.043 -22.469   2.059
  259    HZ2  LYS  31           1HZ      LYS  31  -8.253 -22.804   3.700
  260    HZ3  LYS  31           2HZ      LYS  31  -6.705 -22.531   3.085
  261    H    ILE  32           HN       ILE  32  -4.736 -16.694   7.160
  262    HA   ILE  32           HA       ILE  32  -4.303 -15.454   4.536
  263    HB   ILE  32           HB       ILE  32  -2.666 -15.092   7.064
  264   HG12  ILE  32          2HG1      ILE  32  -4.827 -13.923   7.156
  265   HG13  ILE  32          1HG1      ILE  32  -3.493 -12.783   7.032
  266   HG21  ILE  32          1HG2      ILE  32  -2.357 -13.799   4.356
  267   HG22  ILE  32          2HG2      ILE  32  -1.275 -14.996   5.063
  268   HG23  ILE  32          3HG2      ILE  32  -1.427 -13.401   5.799
  269   HD11  ILE  32          3HD1      ILE  32  -3.962 -12.536   4.629
  270   HD12  ILE  32          1HD1      ILE  32  -5.334 -12.083   5.642
  271   HD13  ILE  32          2HD1      ILE  32  -5.333 -13.632   4.803
  272    H    THR  33           HN       THR  33  -3.971 -17.334   3.426
  273    HA   THR  33           HA       THR  33  -1.832 -19.098   4.303
  274    HB   THR  33           HB       THR  33  -2.628 -20.325   2.109
  275    HG1  THR  33           1HG      THR  33  -4.075 -18.808   1.336
  276   HG21  THR  33          3HG2      THR  33  -4.306 -21.526   3.441
  277   HG22  THR  33          1HG2      THR  33  -4.293 -20.222   4.627
  278   HG23  THR  33          2HG2      THR  33  -2.851 -21.209   4.385
  279    H    ARG  34           HN       ARG  34  -2.318 -16.451   2.283
  280    HA   ARG  34           HA       ARG  34  -0.454 -17.027   0.238
  281    HB2  ARG  34           2HB      ARG  34  -0.417 -14.537  -0.101
  282    HB3  ARG  34           1HB      ARG  34  -2.029 -15.235  -0.105
  283    HG2  ARG  34           2HG      ARG  34  -2.433 -14.438   2.134
  284    HG3  ARG  34           1HG      ARG  34  -0.771 -13.869   2.267
  285    HD2  ARG  34           2HD      ARG  34  -2.163 -11.983   1.817
  286    HD3  ARG  34           1HD      ARG  34  -1.224 -12.321   0.366
  287    HE   ARG  34           HE       ARG  34  -3.499 -13.640  -0.143
  288   HH11  ARG  34          1HH1      ARG  34  -2.940 -10.385   1.047
  289   HH12  ARG  34          2HH1      ARG  34  -4.357  -9.722   0.315
  290   HH21  ARG  34          1HH2      ARG  34  -5.381 -12.779  -1.106
  291   HH22  ARG  34          2HH2      ARG  34  -5.760 -11.100  -0.922
  292    H    THR  35           HN       THR  35   1.560 -17.635   0.748
  293    HA   THR  35           HA       THR  35   2.916 -16.540   3.036
  294    HB   THR  35           HB       THR  35   3.214 -18.921   2.414
  295    HG1  THR  35           1HG      THR  35   5.059 -18.717   3.379
  296   HG21  THR  35          3HG2      THR  35   4.687 -19.491   0.504
  297   HG22  THR  35          1HG2      THR  35   4.654 -17.800   0.004
  298   HG23  THR  35          2HG2      THR  35   3.169 -18.755  -0.004
  299    H    LYS  36           HN       LYS  36   5.452 -16.136   2.427
  300    HA   LYS  36           HA       LYS  36   5.550 -13.531   1.435
  301    HB2  LYS  36           2HB      LYS  36   7.273 -14.460   2.900
  302    HB3  LYS  36           1HB      LYS  36   7.785 -15.561   1.627
  303    HG2  LYS  36           2HG      LYS  36   8.430 -13.621   0.248
  304    HG3  LYS  36           1HG      LYS  36   7.987 -12.555   1.582
  305    HD2  LYS  36           2HD      LYS  36  10.088 -14.722   1.716
  306    HD3  LYS  36           1HD      LYS  36  10.419 -13.009   1.472
  307    HE2  LYS  36           2HE      LYS  36   9.250 -12.574   3.648
  308    HE3  LYS  36           1HE      LYS  36   9.193 -14.318   3.889
  309    HZ1  LYS  36           3HZ      LYS  36  11.081 -13.421   5.020
  310    HZ2  LYS  36           1HZ      LYS  36  11.622 -12.646   3.621
  311    HZ3  LYS  36           2HZ      LYS  36  11.635 -14.328   3.708
  312    H    GLU  37           HN       GLU  37   6.353 -16.572  -0.171
  313    HA   GLU  37           HA       GLU  37   7.287 -15.538  -2.588
  314    HB2  GLU  37           2HB      GLU  37   5.843 -18.138  -2.079
  315    HB3  GLU  37           1HB      GLU  37   6.802 -17.763  -3.504
  316    HG2  GLU  37           2HG      GLU  37   8.788 -17.553  -2.139
  317    HG3  GLU  37           1HG      GLU  37   7.841 -17.864  -0.688
  318    H    GLU  38           HN       GLU  38   4.027 -16.411  -1.578
  319    HA   GLU  38           HA       GLU  38   2.789 -15.923  -4.081
  320    HB2  GLU  38           2HB      GLU  38   1.592 -15.903  -1.307
  321    HB3  GLU  38           1HB      GLU  38   0.693 -15.996  -2.813
  322    HG2  GLU  38           2HG      GLU  38   2.643 -18.047  -1.802
  323    HG3  GLU  38           1HG      GLU  38   0.886 -18.173  -1.737
  324    H    ALA  39           HN       ALA  39   3.122 -14.033  -1.112
  325    HA   ALA  39           HA       ALA  39   1.676 -11.784  -1.939
  326    HB1  ALA  39           1HB      ALA  39   2.771 -10.619  -0.108
  327    HB2  ALA  39           2HB      ALA  39   3.968 -11.907   0.016
  328    HB3  ALA  39           3HB      ALA  39   2.277 -12.235   0.395
  329    H    LEU  40           HN       LEU  40   5.103 -12.588  -2.239
  330    HA   LEU  40           HA       LEU  40   5.993 -10.134  -3.252
  331    HB2  LEU  40           2HB      LEU  40   7.433 -11.984  -2.411
  332    HB3  LEU  40           1HB      LEU  40   7.071 -12.883  -3.870
  333    HG   LEU  40           HG       LEU  40   8.159 -11.102  -5.202
  334   HD11  LEU  40          1HD1      LEU  40   8.903  -9.986  -2.503
  335   HD12  LEU  40          2HD1      LEU  40   7.847  -9.226  -3.697
  336   HD13  LEU  40          3HD1      LEU  40   9.560  -9.452  -4.050
  337   HD21  LEU  40          3HD2      LEU  40  10.452 -11.674  -4.557
  338   HD22  LEU  40          1HD2      LEU  40   9.400 -13.091  -4.553
  339   HD23  LEU  40          2HD2      LEU  40   9.855 -12.325  -3.031
  340    H    GLU  41           HN       GLU  41   4.664 -12.982  -4.864
  341    HA   GLU  41           HA       GLU  41   5.017 -11.961  -7.498
  342    HB2  GLU  41           2HB      GLU  41   3.308 -14.187  -6.398
  343    HB3  GLU  41           1HB      GLU  41   3.369 -13.783  -8.108
  344    HG2  GLU  41           2HG      GLU  41   5.701 -14.646  -6.415
  345    HG3  GLU  41           1HG      GLU  41   4.836 -15.649  -7.578
  346    H    LEU  42           HN       LEU  42   2.443 -11.827  -5.114
  347    HA   LEU  42           HA       LEU  42   0.455 -10.700  -6.759
  348    HB2  LEU  42           2HB      LEU  42   0.963 -10.399  -3.797
  349    HB3  LEU  42           1HB      LEU  42  -0.452  -9.752  -4.602
  350    HG   LEU  42           HG       LEU  42   0.265 -12.684  -4.438
  351   HD11  LEU  42          1HD1      LEU  42  -1.841 -11.095  -2.981
  352   HD12  LEU  42          2HD1      LEU  42  -0.375 -11.771  -2.270
  353   HD13  LEU  42          3HD1      LEU  42  -1.625 -12.842  -2.904
  354   HD21  LEU  42          3HD2      LEU  42  -1.994 -13.039  -5.326
  355   HD22  LEU  42          1HD2      LEU  42  -0.988 -12.143  -6.463
  356   HD23  LEU  42          2HD2      LEU  42  -2.198 -11.296  -5.501
  357    H    ILE  43           HN       ILE  43   2.963  -9.235  -4.726
  358    HA   ILE  43           HA       ILE  43   2.420  -6.544  -5.239
  359    HB   ILE  43           HB       ILE  43   5.145  -7.812  -4.846
  360   HG12  ILE  43          2HG1      ILE  43   3.644  -8.349  -2.992
  361   HG13  ILE  43          1HG1      ILE  43   4.877  -7.209  -2.471
  362   HG21  ILE  43          1HG2      ILE  43   4.271  -4.952  -4.451
  363   HG22  ILE  43          2HG2      ILE  43   5.299  -5.556  -5.751
  364   HG23  ILE  43          3HG2      ILE  43   5.867  -5.605  -4.083
  365   HD11  ILE  43          3HD1      ILE  43   2.714  -6.647  -1.541
  366   HD12  ILE  43          1HD1      ILE  43   2.023  -6.543  -3.161
  367   HD13  ILE  43          2HD1      ILE  43   3.256  -5.389  -2.652
  368    H    ASN  44           HN       ASN  44   4.451  -8.842  -6.981
  369    HA   ASN  44           HA       ASN  44   5.479  -7.212  -8.982
  370    HB2  ASN  44           2HB      ASN  44   6.006  -9.669  -8.505
  371    HB3  ASN  44           1HB      ASN  44   4.551 -10.059  -9.408
  372   HD21  ASN  44          1HD2      ASN  44   7.217 -10.848 -10.017
  373   HD22  ASN  44          2HD2      ASN  44   7.608 -10.187 -11.563
  374    H    GLY  45           HN       GLY  45   2.461  -9.074  -8.912
  375    HA2  GLY  45           2HA      GLY  45   1.489  -8.403 -11.441
  376    HA3  GLY  45           1HA      GLY  45   0.496  -8.863 -10.066
  377    H    TYR  46           HN       TYR  46   0.921  -6.790  -8.310
  378    HA   TYR  46           HA       TYR  46  -0.834  -4.813  -9.256
  379    HB2  TYR  46           2HB      TYR  46   1.182  -4.420  -7.036
  380    HB3  TYR  46           1HB      TYR  46  -0.325  -3.548  -7.263
  381    HD1  TYR  46           2HD      TYR  46  -2.133  -5.908  -7.838
  382    HD2  TYR  46           1HD      TYR  46   0.897  -5.312  -4.920
  383    HE1  TYR  46           2HE      TYR  46  -3.242  -7.531  -6.359
  384    HE2  TYR  46           1HE      TYR  46  -0.197  -6.929  -3.443
  385    HH   TYR  46           HH       TYR  46  -2.343  -7.913  -3.069
  386    H    ILE  47           HN       ILE  47   2.686  -4.752  -8.846
  387    HA   ILE  47           HA       ILE  47   3.180  -2.170  -9.750
  388    HB   ILE  47           HB       ILE  47   4.914  -4.632 -10.081
  389   HG12  ILE  47          2HG1      ILE  47   4.956  -2.455  -7.975
  390   HG13  ILE  47          1HG1      ILE  47   4.336  -4.085  -7.742
  391   HG21  ILE  47          1HG2      ILE  47   5.609  -2.885 -11.626
  392   HG22  ILE  47          2HG2      ILE  47   6.792  -3.070 -10.329
  393   HG23  ILE  47          3HG2      ILE  47   5.661  -1.717 -10.305
  394   HD11  ILE  47          3HD1      ILE  47   6.561  -3.828  -6.796
  395   HD12  ILE  47          1HD1      ILE  47   7.187  -3.361  -8.378
  396   HD13  ILE  47          2HD1      ILE  47   6.567  -4.991  -8.121
  397    H    GLN  48           HN       GLN  48   3.071  -5.200 -11.601
  398    HA   GLN  48           HA       GLN  48   3.639  -4.090 -14.106
  399    HB2  GLN  48           2HB      GLN  48   2.026  -6.540 -13.387
  400    HB3  GLN  48           1HB      GLN  48   2.473  -6.115 -15.032
  401    HG2  GLN  48           2HG      GLN  48   4.351  -6.768 -12.772
  402    HG3  GLN  48           1HG      GLN  48   3.990  -7.773 -14.176
  403   HE21  GLN  48          1HE2      GLN  48   5.727  -5.027 -12.985
  404   HE22  GLN  48          2HE2      GLN  48   6.677  -4.747 -14.395
  405    H    LYS  49           HN       LYS  49   0.505  -4.625 -12.516
  406    HA   LYS  49           HA       LYS  49  -1.108  -3.747 -14.640
  407    HB2  LYS  49           2HB      LYS  49  -1.607  -3.672 -11.665
  408    HB3  LYS  49           1HB      LYS  49  -2.829  -3.326 -12.878
  409    HG2  LYS  49           2HG      LYS  49  -2.611  -5.595 -13.749
  410    HG3  LYS  49           1HG      LYS  49  -1.376  -5.939 -12.533
  411    HD2  LYS  49           2HD      LYS  49  -2.981  -5.534 -10.755
  412    HD3  LYS  49           1HD      LYS  49  -4.214  -5.107 -11.939
  413    HE2  LYS  49           2HE      LYS  49  -2.892  -7.797 -11.624
  414    HE3  LYS  49           1HE      LYS  49  -4.531  -7.380 -11.135
  415    HZ1  LYS  49           3HZ      LYS  49  -4.823  -8.391 -13.178
  416    HZ2  LYS  49           1HZ      LYS  49  -3.437  -7.692 -13.851
  417    HZ3  LYS  49           2HZ      LYS  49  -4.813  -6.749 -13.604
  418    H    ILE  50           HN       ILE  50   0.180  -1.980 -11.848
  419    HA   ILE  50           HA       ILE  50  -1.074   0.473 -12.506
  420    HB   ILE  50           HB       ILE  50   1.338  -0.023 -10.750
  421   HG12  ILE  50          2HG1      ILE  50  -1.568   0.322  -9.990
  422   HG13  ILE  50          1HG1      ILE  50  -0.760  -1.236 -10.121
  423   HG21  ILE  50          1HG2      ILE  50  -0.493   2.376 -10.916
  424   HG22  ILE  50          2HG2      ILE  50   1.194   2.318 -11.430
  425   HG23  ILE  50          3HG2      ILE  50   0.786   2.141  -9.722
  426   HD11  ILE  50          3HD1      ILE  50  -0.877  -0.561  -7.823
  427   HD12  ILE  50          1HD1      ILE  50  -0.094   0.976  -8.198
  428   HD13  ILE  50          2HD1      ILE  50   0.802  -0.534  -8.358
  429    H    LYS  51           HN       LYS  51   2.271  -0.678 -12.986
  430    HA   LYS  51           HA       LYS  51   3.174   1.749 -14.126
  431    HB2  LYS  51           2HB      LYS  51   4.302  -1.041 -14.347
  432    HB3  LYS  51           1HB      LYS  51   5.116   0.401 -14.930
  433    HG2  LYS  51           2HG      LYS  51   4.415  -0.252 -12.070
  434    HG3  LYS  51           1HG      LYS  51   6.024  -0.225 -12.790
  435    HD2  LYS  51           2HD      LYS  51   4.186   2.146 -12.411
  436    HD3  LYS  51           1HD      LYS  51   5.640   1.794 -11.481
  437    HE2  LYS  51           2HE      LYS  51   7.013   2.064 -13.463
  438    HE3  LYS  51           1HE      LYS  51   5.575   2.314 -14.451
  439    HZ1  LYS  51           3HZ      LYS  51   6.569   4.410 -13.948
  440    HZ2  LYS  51           1HZ      LYS  51   6.557   4.094 -12.288
  441    HZ3  LYS  51           2HZ      LYS  51   5.102   4.308 -13.120
  442    H    SER  52           HN       SER  52   1.576  -1.018 -15.514
  443    HA   SER  52           HA       SER  52   2.135  -0.124 -18.213
  444    HB2  SER  52           2HB      SER  52   2.067  -2.540 -17.672
  445    HB3  SER  52           1HB      SER  52   0.366  -2.382 -17.242
  446    HG   SER  52           HG       SER  52   1.468  -1.786 -19.790
  447    H    GLY  53           HN       GLY  53  -0.203   0.447 -15.804
  448    HA2  GLY  53           2HA      GLY  53  -1.991   1.920 -15.851
  449    HA3  GLY  53           1HA      GLY  53  -1.717   2.145 -17.573
  450    H    GLU  54           HN       GLU  54  -2.116  -0.965 -16.082
  451    HA   GLU  54           HA       GLU  54  -4.289  -1.620 -17.851
  452    HB2  GLU  54           2HB      GLU  54  -2.875  -3.143 -15.670
  453    HB3  GLU  54           1HB      GLU  54  -4.199  -3.817 -16.604
  454    HG2  GLU  54           2HG      GLU  54  -1.643  -2.787 -17.793
  455    HG3  GLU  54           1HG      GLU  54  -1.947  -4.478 -17.388
  456    H    GLU  55           HN       GLU  55  -4.056  -2.214 -14.378
  457    HA   GLU  55           HA       GLU  55  -6.880  -1.484 -14.140
  458    HB2  GLU  55           2HB      GLU  55  -5.116  -3.323 -12.531
  459    HB3  GLU  55           1HB      GLU  55  -6.641  -2.733 -11.899
  460    HG2  GLU  55           2HG      GLU  55  -6.938  -4.937 -12.819
  461    HG3  GLU  55           1HG      GLU  55  -7.815  -3.768 -13.798
  462    H    ASP  56           HN       ASP  56  -7.414  -0.585 -11.903
  463    HA   ASP  56           HA       ASP  56  -5.557   1.621 -11.429
  464    HB2  ASP  56           2HB      ASP  56  -8.417   1.226 -10.516
  465    HB3  ASP  56           1HB      ASP  56  -7.440   2.649 -10.179
  466    H    PHE  57           HN       PHE  57  -4.837   2.168  -9.371
  467    HA   PHE  57           HA       PHE  57  -4.111   0.050  -7.673
  468    HB2  PHE  57           2HB      PHE  57  -2.882   2.194  -7.824
  469    HB3  PHE  57           1HB      PHE  57  -4.243   3.020  -7.082
  470    HD1  PHE  57           1HD      PHE  57  -4.687   2.796  -4.702
  471    HD2  PHE  57           2HD      PHE  57  -1.388   0.825  -6.521
  472    HE1  PHE  57           1HE      PHE  57  -3.701   2.403  -2.484
  473    HE2  PHE  57           2HE      PHE  57  -0.399   0.426  -4.308
  474    HZ   PHE  57           HZ       PHE  57  -1.555   1.216  -2.287
  475    H    GLU  58           HN       GLU  58  -6.753   2.315  -7.689
  476    HA   GLU  58           HA       GLU  58  -7.823   1.957  -5.161
  477    HB2  GLU  58           2HB      GLU  58  -9.276   2.416  -7.764
  478    HB3  GLU  58           1HB      GLU  58  -9.968   2.650  -6.167
  479    HG2  GLU  58           2HG      GLU  58  -8.274   4.384  -5.724
  480    HG3  GLU  58           1HG      GLU  58  -7.666   4.171  -7.364
  481    H    SER  59           HN       SER  59  -8.567   0.161  -8.143
  482    HA   SER  59           HA       SER  59 -10.434  -1.575  -6.957
  483    HB2  SER  59           2HB      SER  59 -10.178  -1.167  -9.434
  484    HB3  SER  59           1HB      SER  59  -8.731  -2.171  -9.389
  485    HG   SER  59           HG       SER  59 -11.238  -3.078  -8.440
  486    H    LEU  60           HN       LEU  60  -6.958  -1.772  -7.381
  487    HA   LEU  60           HA       LEU  60  -6.671  -4.462  -6.576
  488    HB2  LEU  60           2HB      LEU  60  -4.679  -2.206  -6.375
  489    HB3  LEU  60           1HB      LEU  60  -4.306  -3.915  -6.259
  490    HG   LEU  60           HG       LEU  60  -5.356  -2.502  -8.713
  491   HD11  LEU  60          1HD1      LEU  60  -3.141  -2.965  -9.642
  492   HD12  LEU  60          2HD1      LEU  60  -2.631  -3.626  -8.088
  493   HD13  LEU  60          3HD1      LEU  60  -3.051  -1.919  -8.224
  494   HD21  LEU  60          3HD2      LEU  60  -4.917  -4.635  -9.852
  495   HD22  LEU  60          1HD2      LEU  60  -6.157  -4.794  -8.607
  496   HD23  LEU  60          2HD2      LEU  60  -4.520  -5.372  -8.301
  497    H    ALA  61           HN       ALA  61  -6.570  -1.405  -4.812
  498    HA   ALA  61           HA       ALA  61  -5.944  -2.650  -2.309
  499    HB1  ALA  61           1HB      ALA  61  -6.231  -0.432  -1.358
  500    HB2  ALA  61           2HB      ALA  61  -6.930   0.139  -2.875
  501    HB3  ALA  61           3HB      ALA  61  -5.240  -0.365  -2.816
  502    H    SER  62           HN       SER  62  -8.797  -2.269  -4.077
  503    HA   SER  62           HA       SER  62 -10.475  -2.414  -1.698
  504    HB2  SER  62           2HB      SER  62 -11.264  -2.061  -4.592
  505    HB3  SER  62           1HB      SER  62 -12.348  -1.975  -3.205
  506    HG   SER  62           HG       SER  62 -10.264  -0.216  -3.947
  507    H    GLN  63           HN       GLN  63  -8.896  -4.557  -3.600
  508    HA   GLN  63           HA       GLN  63 -10.917  -6.612  -3.051
  509    HB2  GLN  63           2HB      GLN  63  -9.436  -6.330  -5.672
  510    HB3  GLN  63           1HB      GLN  63 -10.454  -7.692  -5.232
  511    HG2  GLN  63           2HG      GLN  63 -12.390  -6.200  -5.107
  512    HG3  GLN  63           1HG      GLN  63 -11.366  -4.837  -5.553
  513   HE21  GLN  63          1HE2      GLN  63  -9.820  -6.459  -7.450
  514   HE22  GLN  63          2HE2      GLN  63 -10.836  -6.671  -8.826
  515    H    PHE  64           HN       PHE  64  -7.576  -6.168  -4.204
  516    HA   PHE  64           HA       PHE  64  -6.814  -8.767  -3.259
  517    HB2  PHE  64           2HB      PHE  64  -5.227  -6.476  -4.403
  518    HB3  PHE  64           1HB      PHE  64  -4.508  -8.008  -3.925
  519    HD1  PHE  64           1HD      PHE  64  -6.909  -6.433  -6.254
  520    HD2  PHE  64           2HD      PHE  64  -4.625  -9.901  -5.327
  521    HE1  PHE  64           1HE      PHE  64  -7.427  -7.360  -8.472
  522    HE2  PHE  64           2HE      PHE  64  -5.138 -10.836  -7.544
  523    HZ   PHE  64           HZ       PHE  64  -6.541  -9.563  -9.120
  524    H    SER  65           HN       SER  65  -6.519  -5.479  -2.123
  525    HA   SER  65           HA       SER  65  -4.713  -5.985  -0.005
  526    HB2  SER  65           2HB      SER  65  -5.088  -3.729  -0.869
  527    HB3  SER  65           1HB      SER  65  -6.771  -3.786  -0.350
  528    HG   SER  65           HG       SER  65  -6.001  -2.917   1.390
  529    H    ASP  66           HN       ASP  66  -5.049  -6.574   2.069
  530    HA   ASP  66           HA       ASP  66  -7.632  -7.782   2.688
  531    HB2  ASP  66           2HB      ASP  66  -6.444  -8.780   4.619
  532    HB3  ASP  66           1HB      ASP  66  -5.661  -9.141   3.085
  533    H    ALA  67           HN       ALA  67  -6.528  -4.799   2.969
  534    HA   ALA  67           HA       ALA  67  -7.273  -4.325   5.740
  535    HB1  ALA  67           1HB      ALA  67  -6.482  -2.057   5.368
  536    HB2  ALA  67           2HB      ALA  67  -6.253  -2.408   3.656
  537    HB3  ALA  67           3HB      ALA  67  -5.274  -3.237   4.866
  538    H    SER  68           HN       SER  68  -8.731  -2.590   6.303
  539    HA   SER  68           HA       SER  68 -11.224  -2.781   4.958
  540    HB2  SER  68           2HB      SER  68 -11.861  -0.982   6.658
  541    HB3  SER  68           1HB      SER  68 -11.294  -2.520   7.312
  542    HG   SER  68           HG       SER  68 -10.351  -0.155   7.844
  543    H    SER  69           HN       SER  69  -8.513  -1.022   4.289
  544    HA   SER  69           HA       SER  69  -9.337   1.524   3.594
  545    HB2  SER  69           2HB      SER  69  -7.300  -0.151   2.125
  546    HB3  SER  69           1HB      SER  69  -7.369   1.610   2.217
  547    HG   SER  69           HG       SER  69  -7.337   0.942   4.674
  548    H    ALA  70           HN       ALA  70 -10.093  -1.482   2.086
  549    HA   ALA  70           HA       ALA  70 -10.621  -0.844  -0.535
  550    HB1  ALA  70           1HB      ALA  70 -12.253  -2.665  -0.488
  551    HB2  ALA  70           2HB      ALA  70 -12.244  -2.633   1.275
  552    HB3  ALA  70           3HB      ALA  70 -10.790  -3.104   0.395
  553    H    LYS  71           HN       LYS  71 -12.409   0.045   2.330
  554    HA   LYS  71           HA       LYS  71 -14.827   0.824   1.061
  555    HB2  LYS  71           2HB      LYS  71 -13.606   1.735   3.671
  556    HB3  LYS  71           1HB      LYS  71 -15.253   2.071   3.159
  557    HG2  LYS  71           2HG      LYS  71 -14.127  -0.689   3.581
  558    HG3  LYS  71           1HG      LYS  71 -15.066   0.211   4.774
  559    HD2  LYS  71           2HD      LYS  71 -16.942   0.316   3.167
  560    HD3  LYS  71           1HD      LYS  71 -15.999  -0.662   2.039
  561    HE2  LYS  71           2HE      LYS  71 -17.601  -2.026   3.290
  562    HE3  LYS  71           1HE      LYS  71 -15.939  -2.485   3.647
  563    HZ1  LYS  71           3HZ      LYS  71 -17.310  -2.368   5.638
  564    HZ2  LYS  71           1HZ      LYS  71 -17.630  -0.737   5.343
  565    HZ3  LYS  71           2HZ      LYS  71 -16.055  -1.240   5.696
  566    H    ALA  72           HN       ALA  72 -11.744   2.334   1.421
  567    HA   ALA  72           HA       ALA  72 -12.823   4.860   0.356
  568    HB1  ALA  72           1HB      ALA  72 -10.865   5.954   1.333
  569    HB2  ALA  72           2HB      ALA  72 -10.301   4.402   1.949
  570    HB3  ALA  72           3HB      ALA  72 -11.798   5.102   2.564
  571    H    ARG  73           HN       ARG  73 -11.837   2.259  -0.919
  572    HA   ARG  73           HA       ARG  73 -10.822   1.633  -2.846
  573    HB2  ARG  73           2HB      ARG  73 -10.681   4.612  -3.204
  574    HB3  ARG  73           1HB      ARG  73  -9.949   3.530  -4.372
  575    HG2  ARG  73           2HG      ARG  73 -12.081   4.117  -5.213
  576    HG3  ARG  73           1HG      ARG  73 -12.211   2.457  -4.639
  577    HD2  ARG  73           2HD      ARG  73 -14.162   3.753  -3.986
  578    HD3  ARG  73           1HD      ARG  73 -13.240   3.263  -2.566
  579    HE   ARG  73           HE       ARG  73 -12.281   5.744  -3.176
  580   HH11  ARG  73          1HH1      ARG  73 -15.470   4.441  -2.508
  581   HH12  ARG  73          2HH1      ARG  73 -16.075   5.910  -1.831
  582   HH21  ARG  73          1HH2      ARG  73 -13.069   7.694  -2.252
  583   HH22  ARG  73          2HH2      ARG  73 -14.699   7.770  -1.680
  584    H    GLY  74           HN       GLY  74  -9.271   2.498  -0.279
  585    HA2  GLY  74           2HA      GLY  74  -7.101   1.763   0.268
  586    HA3  GLY  74           1HA      GLY  74  -6.676   1.831  -1.432
  587    H    ASP  75           HN       ASP  75  -8.230   4.648  -0.849
  588    HA   ASP  75           HA       ASP  75  -5.684   6.048  -0.651
  589    HB2  ASP  75           2HB      ASP  75  -7.229   6.707  -2.443
  590    HB3  ASP  75           1HB      ASP  75  -8.444   7.135  -1.244
  591    H    LEU  76           HN       LEU  76  -5.166   7.537   0.888
  592    HA   LEU  76           HA       LEU  76  -6.765   7.429   3.357
  593    HB2  LEU  76           2HB      LEU  76  -3.857   8.017   2.855
  594    HB3  LEU  76           1HB      LEU  76  -4.629   8.334   4.393
  595    HG   LEU  76           HG       LEU  76  -4.500   5.601   3.126
  596   HD11  LEU  76          1HD1      LEU  76  -2.250   6.401   3.609
  597   HD12  LEU  76          2HD1      LEU  76  -2.723   5.134   4.742
  598   HD13  LEU  76          3HD1      LEU  76  -2.741   6.824   5.249
  599   HD21  LEU  76          3HD2      LEU  76  -5.084   4.844   5.377
  600   HD22  LEU  76          1HD2      LEU  76  -6.321   5.919   4.726
  601   HD23  LEU  76          2HD2      LEU  76  -5.173   6.520   5.922
  602    H    GLY  77           HN       GLY  77  -5.664   9.475   0.842
  603    HA2  GLY  77           2HA      GLY  77  -6.340  11.651   0.408
  604    HA3  GLY  77           1HA      GLY  77  -7.073  11.710   2.006
  605    H    ALA  78           HN       ALA  78  -6.144  13.777   2.323
  606    HA   ALA  78           HA       ALA  78  -3.282  14.050   2.320
  607    HB1  ALA  78           1HB      ALA  78  -3.704  16.325   3.094
  608    HB2  ALA  78           2HB      ALA  78  -5.410  15.940   3.326
  609    HB3  ALA  78           3HB      ALA  78  -4.719  15.938   1.703
  610    H    PHE  79           HN       PHE  79  -2.086  13.252   3.882
  611    HA   PHE  79           HA       PHE  79  -3.117  13.357   6.638
  612    HB2  PHE  79           2HB      PHE  79  -1.788  11.338   7.136
  613    HB3  PHE  79           1HB      PHE  79  -2.988  11.027   5.889
  614    HD1  PHE  79           2HD      PHE  79   0.588  11.383   6.612
  615    HD2  PHE  79           1HD      PHE  79  -2.324  10.530   3.630
  616    HE1  PHE  79           2HE      PHE  79   2.355  10.507   5.144
  617    HE2  PHE  79           1HE      PHE  79  -0.567   9.654   2.161
  618    HZ   PHE  79           HZ       PHE  79   1.779   9.640   2.913
  619    H    SER  80           HN       SER  80  -1.273  13.339   8.260
  620    HA   SER  80           HA       SER  80   0.841  15.088   7.227
  621    HB2  SER  80           2HB      SER  80  -0.935  15.996   8.888
  622    HB3  SER  80           1HB      SER  80  -0.042  15.078  10.101
  623    HG   SER  80           HG       SER  80   1.355  16.775   8.353
  624    H    ARG  81           HN       ARG  81   2.799  15.080   8.754
  625    HA   ARG  81           HA       ARG  81   4.019  12.559   8.596
  626    HB2  ARG  81           2HB      ARG  81   4.847  14.930  10.268
  627    HB3  ARG  81           1HB      ARG  81   5.872  13.586   9.797
  628    HG2  ARG  81           2HG      ARG  81   5.918  14.238   7.563
  629    HG3  ARG  81           1HG      ARG  81   4.522  15.304   7.752
  630    HD2  ARG  81           2HD      ARG  81   7.236  15.710   9.000
  631    HD3  ARG  81           1HD      ARG  81   6.614  16.555   7.581
  632    HE   ARG  81           HE       ARG  81   4.997  16.768   9.977
  633   HH11  ARG  81          1HH1      ARG  81   7.519  18.211   8.015
  634   HH12  ARG  81          2HH1      ARG  81   7.286  19.799   8.659
  635   HH21  ARG  81          1HH2      ARG  81   4.666  18.867  10.821
  636   HH22  ARG  81          2HH2      ARG  81   5.656  20.172  10.271
  637    H    GLY  82           HN       GLY  82   2.712  14.318  11.393
  638    HA2  GLY  82           2HA      GLY  82   3.403  12.251  13.260
  639    HA3  GLY  82           1HA      GLY  82   2.367  13.633  13.577
  640    H    GLN  83           HN       GLN  83   1.213  12.202  10.867
  641    HA   GLN  83           HA       GLN  83  -0.706  10.552  12.373
  642    HB2  GLN  83           2HB      GLN  83  -1.078  12.168   9.842
  643    HB3  GLN  83           1HB      GLN  83  -2.277  11.052  10.480
  644    HG2  GLN  83           2HG      GLN  83  -1.231  13.475  11.925
  645    HG3  GLN  83           1HG      GLN  83  -2.743  13.407  11.023
  646   HE21  GLN  83          1HE2      GLN  83  -3.337  10.679  11.877
  647   HE22  GLN  83          2HE2      GLN  83  -3.832  10.796  13.525
  648    H    MET  84           HN       MET  84   1.939   9.903  11.068
  649    HA   MET  84           HA       MET  84   1.036   7.567   9.627
  650    HB2  MET  84           2HB      MET  84   1.136   9.394   7.925
  651    HB3  MET  84           1HB      MET  84   2.843   9.587   8.286
  652    HG2  MET  84           2HG      MET  84   2.418   8.281   6.253
  653    HG3  MET  84           1HG      MET  84   3.318   7.391   7.481
  654    HE1  MET  84           3HE      MET  84  -1.186   6.746   6.686
  655    HE2  MET  84           1HE      MET  84  -0.212   7.940   5.828
  656    HE3  MET  84           2HE      MET  84  -0.550   8.147   7.547
  657    H    GLN  85           HN       GLN  85   2.874   6.110   9.119
  658    HA   GLN  85           HA       GLN  85   4.787   6.062  11.262
  659    HB2  GLN  85           2HB      GLN  85   4.481   4.259   8.842
  660    HB3  GLN  85           1HB      GLN  85   5.619   3.979  10.148
  661    HG2  GLN  85           2HG      GLN  85   3.816   2.559  10.597
  662    HG3  GLN  85           1HG      GLN  85   3.602   3.918  11.696
  663   HE21  GLN  85          1HE2      GLN  85   2.408   2.303   8.871
  664   HE22  GLN  85          2HE2      GLN  85   0.889   3.119   8.793
  665    H    LYS  86           HN       LYS  86   7.081   6.107  11.026
  666    HA   LYS  86           HA       LYS  86   7.983   8.244   9.482
  667    HB2  LYS  86           2HB      LYS  86   9.034   7.320  11.603
  668    HB3  LYS  86           1HB      LYS  86   9.822   6.127  10.582
  669    HG2  LYS  86           2HG      LYS  86  11.394   7.843  10.897
  670    HG3  LYS  86           1HG      LYS  86  10.766   8.065   9.263
  671    HD2  LYS  86           2HD      LYS  86   9.211   9.782  10.126
  672    HD3  LYS  86           1HD      LYS  86   9.923   9.590  11.728
  673    HE2  LYS  86           2HE      LYS  86  10.979  11.474  10.796
  674    HE3  LYS  86           1HE      LYS  86  12.144  10.161  10.644
  675    HZ1  LYS  86           3HZ      LYS  86  12.056  11.407   8.612
  676    HZ2  LYS  86           1HZ      LYS  86  10.379  11.223   8.504
  677    HZ3  LYS  86           2HZ      LYS  86  11.395   9.878   8.318
  678    HA   PRO  87           HA       PRO  87  10.176   4.986   6.479
  679    HB2  PRO  87           2HB      PRO  87   8.138   2.826   6.643
  680    HB3  PRO  87           1HB      PRO  87   9.893   2.700   6.469
  681    HG2  PRO  87           2HG      PRO  87   8.734   2.138   8.790
  682    HG3  PRO  87           1HG      PRO  87  10.272   3.020   8.738
  683    HD2  PRO  87           2HD      PRO  87   7.506   4.054   9.211
  684    HD3  PRO  87           1HD      PRO  87   9.029   4.505  10.003
  685    H    PHE  88           HN       PHE  88   6.714   5.182   6.930
  686    HA   PHE  88           HA       PHE  88   6.056   5.140   4.131
  687    HB2  PHE  88           2HB      PHE  88   4.580   4.409   6.109
  688    HB3  PHE  88           1HB      PHE  88   4.324   6.118   6.409
  689    HD1  PHE  88           1HD      PHE  88   3.473   7.466   4.258
  690    HD2  PHE  88           2HD      PHE  88   3.038   3.275   4.865
  691    HE1  PHE  88           1HE      PHE  88   1.572   7.438   2.701
  692    HE2  PHE  88           2HE      PHE  88   1.139   3.244   3.302
  693    HZ   PHE  88           HZ       PHE  88   0.403   5.328   2.218
  694    H    GLU  89           HN       GLU  89   6.458   7.528   6.685
  695    HA   GLU  89           HA       GLU  89   5.619   9.849   5.385
  696    HB2  GLU  89           2HB      GLU  89   6.073   9.733   7.785
  697    HB3  GLU  89           1HB      GLU  89   7.780   9.474   7.465
  698    HG2  GLU  89           2HG      GLU  89   7.670  11.744   6.256
  699    HG3  GLU  89           1HG      GLU  89   6.157  11.958   7.136
  700    H    ASP  90           HN       ASP  90   8.958   8.673   5.822
  701    HA   ASP  90           HA       ASP  90  10.230  10.587   4.241
  702    HB2  ASP  90           2HB      ASP  90  11.017   7.769   4.953
  703    HB3  ASP  90           1HB      ASP  90  12.051   8.805   3.978
  704    H    ALA  91           HN       ALA  91   8.898   7.455   3.339
  705    HA   ALA  91           HA       ALA  91   9.828   7.427   0.693
  706    HB1  ALA  91           1HB      ALA  91   8.141   5.718   0.296
  707    HB2  ALA  91           2HB      ALA  91   7.343   6.136   1.813
  708    HB3  ALA  91           3HB      ALA  91   8.963   5.439   1.832
  709    H    SER  92           HN       SER  92   6.794   8.617   2.093
  710    HA   SER  92           HA       SER  92   5.498   9.272  -0.294
  711    HB2  SER  92           2HB      SER  92   5.261  10.568   2.427
  712    HB3  SER  92           1HB      SER  92   4.126  10.799   1.096
  713    HG   SER  92           HG       SER  92   4.702   8.408   2.510
  714    H    PHE  93           HN       PHE  93   7.788  11.138   1.638
  715    HA   PHE  93           HA       PHE  93   7.478  13.493   0.019
  716    HB2  PHE  93           2HB      PHE  93   9.610  12.823   2.050
  717    HB3  PHE  93           1HB      PHE  93   9.328  14.403   1.330
  718    HD1  PHE  93           1HD      PHE  93   6.231  14.118   1.427
  719    HD2  PHE  93           2HD      PHE  93   9.318  13.572   4.303
  720    HE1  PHE  93           1HE      PHE  93   4.645  14.642   3.219
  721    HE2  PHE  93           2HE      PHE  93   7.727  14.095   6.103
  722    HZ   PHE  93           HZ       PHE  93   5.387  14.628   5.562
  723    H    ALA  94           HN       ALA  94   9.442  10.668  -0.061
  724    HA   ALA  94           HA       ALA  94  11.402  11.792  -1.859
  725    HB1  ALA  94           1HB      ALA  94  12.319   9.529  -1.943
  726    HB2  ALA  94           2HB      ALA  94  10.916   8.919  -1.068
  727    HB3  ALA  94           3HB      ALA  94  12.036  10.027  -0.275
  728    H    LEU  95           HN       LEU  95   8.373  10.184  -2.043
  729    HA   LEU  95           HA       LEU  95   8.610   9.386  -4.796
  730    HB2  LEU  95           2HB      LEU  95   6.210   9.594  -2.981
  731    HB3  LEU  95           1HB      LEU  95   6.166   8.948  -4.606
  732    HG   LEU  95           HG       LEU  95   7.674   7.766  -2.277
  733   HD11  LEU  95          1HD1      LEU  95   5.181   6.856  -3.704
  734   HD12  LEU  95          2HD1      LEU  95   5.259   7.527  -2.076
  735   HD13  LEU  95          3HD1      LEU  95   6.020   5.976  -2.428
  736   HD21  LEU  95          3HD2      LEU  95   8.085   5.884  -3.774
  737   HD22  LEU  95          1HD2      LEU  95   8.810   7.365  -4.398
  738   HD23  LEU  95          2HD2      LEU  95   7.307   6.757  -5.093
  739    H    ARG  96           HN       ARG  96   7.566  10.318  -6.534
  740    HA   ARG  96           HA       ARG  96   7.058  13.171  -6.305
  741    HB2  ARG  96           2HB      ARG  96   7.044  11.324  -8.703
  742    HB3  ARG  96           1HB      ARG  96   6.829  13.065  -8.770
  743    HG2  ARG  96           2HG      ARG  96   9.072  13.429  -8.018
  744    HG3  ARG  96           1HG      ARG  96   9.297  11.704  -7.727
  745    HD2  ARG  96           2HD      ARG  96   8.774  12.988 -10.407
  746    HD3  ARG  96           1HD      ARG  96  10.338  12.407  -9.834
  747    HE   ARG  96           HE       ARG  96   8.778  10.216  -9.625
  748   HH11  ARG  96          1HH1      ARG  96   9.370  12.443 -12.285
  749   HH12  ARG  96          2HH1      ARG  96   9.093  11.248 -13.502
  750   HH21  ARG  96          1HH2      ARG  96   8.401   8.636 -11.250
  751   HH22  ARG  96          2HH2      ARG  96   8.547   9.095 -12.918
  752    H    THR  97           HN       THR  97   5.088  13.994  -7.511
  753    HA   THR  97           HA       THR  97   2.748  12.797  -6.475
  754    HB   THR  97           HB       THR  97   3.071  14.918  -8.613
  755    HG1  THR  97           1HG      THR  97   2.430  15.226  -5.845
  756   HG21  THR  97          3HG2      THR  97   0.751  15.545  -7.985
  757   HG22  THR  97          1HG2      THR  97   0.665  14.097  -6.983
  758   HG23  THR  97          2HG2      THR  97   0.851  13.949  -8.730
  759    H    GLY  98           HN       GLY  98   2.032  10.900  -7.186
  760    HA2  GLY  98           2HA      GLY  98   0.941   9.567  -8.794
  761    HA3  GLY  98           1HA      GLY  98   1.738  10.489 -10.065
  762    H    GLU  99           HN       GLU  99   3.390   9.202  -7.253
  763    HA   GLU  99           HA       GLU  99   4.723   7.251  -8.998
  764    HB2  GLU  99           2HB      GLU  99   6.146   9.241  -8.543
  765    HB3  GLU  99           1HB      GLU  99   6.044   8.886  -6.826
  766    HG2  GLU  99           2HG      GLU  99   8.144   8.119  -7.784
  767    HG3  GLU  99           1HG      GLU  99   7.181   6.773  -7.175
  768    H    MET 100           HN       MET 100   5.458   5.341  -8.007
  769    HA   MET 100           HA       MET 100   4.122   4.731  -5.449
  770    HB2  MET 100           2HB      MET 100   3.134   3.563  -7.379
  771    HB3  MET 100           1HB      MET 100   4.705   2.886  -7.770
  772    HG2  MET 100           2HG      MET 100   4.707   1.690  -5.627
  773    HG3  MET 100           1HG      MET 100   3.109   2.342  -5.276
  774    HE1  MET 100           3HE      MET 100   4.006  -0.589  -8.727
  775    HE2  MET 100           1HE      MET 100   5.225   0.019  -7.611
  776    HE3  MET 100           2HE      MET 100   4.477   1.108  -8.780
  777    H    SER 101           HN       SER 101   5.250   3.626  -3.889
  778    HA   SER 101           HA       SER 101   8.123   3.671  -4.089
  779    HB2  SER 101           2HB      SER 101   7.999   2.825  -1.732
  780    HB3  SER 101           1HB      SER 101   7.118   4.329  -1.993
  781    HG   SER 101           HG       SER 101   6.152   2.188  -0.927
  782    H    GLY 102           HN       GLY 102   5.740   1.172  -3.341
  783    HA2  GLY 102           2HA      GLY 102   5.982  -0.919  -4.725
  784    HA3  GLY 102           1HA      GLY 102   7.674  -0.859  -4.236
  785    HA   PRO 103           HA       PRO 103   5.627  -3.323  -0.997
  786    HB2  PRO 103           2HB      PRO 103   7.513  -5.232  -0.769
  787    HB3  PRO 103           1HB      PRO 103   6.288  -5.268  -2.041
  788    HG2  PRO 103           2HG      PRO 103   9.157  -4.483  -2.194
  789    HG3  PRO 103           1HG      PRO 103   8.155  -5.313  -3.394
  790    HD2  PRO 103           2HD      PRO 103   8.803  -2.603  -3.421
  791    HD3  PRO 103           1HD      PRO 103   7.468  -3.349  -4.318
  792    H    VAL 104           HN       VAL 104   5.864  -1.870   0.671
  793    HA   VAL 104           HA       VAL 104   8.504  -1.645   1.928
  794    HB   VAL 104           HB       VAL 104   5.981  -0.057   2.489
  795   HG11  VAL 104          1HG1      VAL 104   8.816   0.386   3.427
  796   HG12  VAL 104          2HG1      VAL 104   7.476  -0.187   4.418
  797   HG13  VAL 104          3HG1      VAL 104   7.442   1.444   3.749
  798   HG21  VAL 104          3HG2      VAL 104   7.104   1.788   1.321
  799   HG22  VAL 104          1HG2      VAL 104   6.837   0.408   0.255
  800   HG23  VAL 104          2HG2      VAL 104   8.442   0.713   0.918
  801    H    PHE 105           HN       PHE 105   8.920  -2.841   3.662
  802    HA   PHE 105           HA       PHE 105   6.697  -4.229   4.968
  803    HB2  PHE 105           2HB      PHE 105   9.669  -4.764   5.140
  804    HB3  PHE 105           1HB      PHE 105   8.400  -5.756   5.844
  805    HD1  PHE 105           1HD      PHE 105  10.113  -4.790   2.763
  806    HD2  PHE 105           2HD      PHE 105   7.035  -7.196   4.451
  807    HE1  PHE 105           1HE      PHE 105  10.005  -6.100   0.683
  808    HE2  PHE 105           2HE      PHE 105   6.922  -8.511   2.374
  809    HZ   PHE 105           HZ       PHE 105   8.407  -7.964   0.488
  810    H    THR 106           HN       THR 106   5.921  -3.197   6.690
  811    HA   THR 106           HA       THR 106   7.844  -2.022   8.590
  812    HB   THR 106           HB       THR 106   5.895  -0.613   9.370
  813    HG1  THR 106           1HG      THR 106   4.158  -1.748   8.502
  814   HG21  THR 106          3HG2      THR 106   6.043   0.992   7.517
  815   HG22  THR 106          1HG2      THR 106   6.738  -0.262   6.488
  816   HG23  THR 106          2HG2      THR 106   7.626   0.313   7.900
  817    H    ASP 107           HN       ASP 107   5.454  -4.356   8.043
  818    HA   ASP 107           HA       ASP 107   5.648  -5.423  10.680
  819    HB2  ASP 107           2HB      ASP 107   3.190  -5.340  11.136
  820    HB3  ASP 107           1HB      ASP 107   3.952  -3.756  11.157
  821    H    SER 108           HN       SER 108   3.232  -6.975  10.477
  822    HA   SER 108           HA       SER 108   4.179  -9.094   8.885
  823    HB2  SER 108           2HB      SER 108   1.467  -8.653  10.132
  824    HB3  SER 108           1HB      SER 108   2.048 -10.186   9.475
  825    HG   SER 108           HG       SER 108   3.866  -9.875  11.005
  826    H    GLY 109           HN       GLY 109   2.340  -6.347   8.035
  827    HA2  GLY 109           2HA      GLY 109   1.430  -7.698   5.587
  828    HA3  GLY 109           1HA      GLY 109   0.716  -6.236   6.251
  829    H    ILE 110           HN       ILE 110   1.889  -6.876   3.605
  830    HA   ILE 110           HA       ILE 110   4.207  -5.159   3.436
  831    HB   ILE 110           HB       ILE 110   2.538  -6.327   1.193
  832   HG12  ILE 110          2HG1      ILE 110   5.069  -7.399   2.461
  833   HG13  ILE 110          1HG1      ILE 110   3.461  -8.087   2.654
  834   HG21  ILE 110          1HG2      ILE 110   5.338  -5.201   1.212
  835   HG22  ILE 110          2HG2      ILE 110   3.913  -4.439   0.504
  836   HG23  ILE 110          3HG2      ILE 110   4.539  -5.942  -0.175
  837   HD11  ILE 110          3HD1      ILE 110   4.758  -9.355   1.052
  838   HD12  ILE 110          1HD1      ILE 110   5.018  -7.903   0.085
  839   HD13  ILE 110          2HD1      ILE 110   3.393  -8.569   0.254
  840    H    HIS 111           HN       HIS 111   4.182  -3.049   2.924
  841    HA   HIS 111           HA       HIS 111   1.550  -1.819   2.451
  842    HB2  HIS 111           2HB      HIS 111   4.063  -0.659   3.672
  843    HB3  HIS 111           1HB      HIS 111   2.607   0.264   3.330
  844    HD1  HIS 111           1HD      HIS 111   1.367   0.666   5.412
  845    HD2  HIS 111           2HD      HIS 111   3.164  -3.072   5.408
  846    HE1  HIS 111           1HE      HIS 111   0.759  -0.375   7.608
  847    HE2  HIS 111           2HE      HIS 111   2.106  -2.494   7.687
  848    H    ILE 112           HN       ILE 112   1.222  -1.060   0.483
  849    HA   ILE 112           HA       ILE 112   3.558  -0.256  -1.118
  850    HB   ILE 112           HB       ILE 112   0.740  -0.703  -2.088
  851   HG12  ILE 112          2HG1      ILE 112   3.107  -2.590  -2.206
  852   HG13  ILE 112          1HG1      ILE 112   1.671  -2.808  -1.214
  853   HG21  ILE 112          1HG2      ILE 112   3.352  -0.434  -3.571
  854   HG22  ILE 112          2HG2      ILE 112   2.059   0.763  -3.503
  855   HG23  ILE 112          3HG2      ILE 112   1.789  -0.780  -4.312
  856   HD11  ILE 112          3HD1      ILE 112   1.575  -4.212  -3.174
  857   HD12  ILE 112          1HD1      ILE 112   1.777  -2.806  -4.221
  858   HD13  ILE 112          2HD1      ILE 112   0.316  -2.981  -3.249
  859    H    ILE 113           HN       ILE 113   3.874   1.837  -1.437
  860    HA   ILE 113           HA       ILE 113   1.771   3.688  -0.567
  861    HB   ILE 113           HB       ILE 113   4.717   4.200  -0.920
  862   HG12  ILE 113          2HG1      ILE 113   3.205   3.721   1.654
  863   HG13  ILE 113          1HG1      ILE 113   4.215   2.523   0.856
  864   HG21  ILE 113          1HG2      ILE 113   2.562   5.824   0.444
  865   HG22  ILE 113          2HG2      ILE 113   3.347   6.214  -1.086
  866   HG23  ILE 113          3HG2      ILE 113   4.279   6.229   0.412
  867   HD11  ILE 113          3HD1      ILE 113   5.389   3.572   2.694
  868   HD12  ILE 113          1HD1      ILE 113   5.139   5.161   1.970
  869   HD13  ILE 113          2HD1      ILE 113   6.158   3.973   1.159
  870    H    LEU 114           HN       LEU 114   0.733   4.756  -2.100
  871    HA   LEU 114           HA       LEU 114   2.187   5.445  -4.563
  872    HB2  LEU 114           2HB      LEU 114   0.507   3.761  -5.072
  873    HB3  LEU 114           1HB      LEU 114  -0.726   4.707  -4.263
  874    HG   LEU 114           HG       LEU 114  -0.412   6.488  -5.992
  875   HD11  LEU 114          1HD1      LEU 114   1.264   4.395  -7.359
  876   HD12  LEU 114          2HD1      LEU 114   1.849   5.918  -6.690
  877   HD13  LEU 114          3HD1      LEU 114   0.738   5.924  -8.061
  878   HD21  LEU 114          3HD2      LEU 114  -1.188   3.757  -6.999
  879   HD22  LEU 114          1HD2      LEU 114  -1.610   5.291  -7.760
  880   HD23  LEU 114          2HD2      LEU 114  -2.237   4.900  -6.158
  881    H    ARG 115           HN       ARG 115   2.696   7.523  -4.220
  882    HA   ARG 115           HA       ARG 115   0.951   9.302  -2.802
  883    HB2  ARG 115           2HB      ARG 115   3.347   9.651  -2.659
  884    HB3  ARG 115           1HB      ARG 115   3.456   9.832  -4.406
  885    HG2  ARG 115           2HG      ARG 115   2.126  11.872  -4.291
  886    HG3  ARG 115           1HG      ARG 115   1.985  11.685  -2.542
  887    HD2  ARG 115           2HD      ARG 115   4.345  11.972  -2.263
  888    HD3  ARG 115           1HD      ARG 115   4.601  11.947  -4.008
  889    HE   ARG 115           HE       ARG 115   2.862  14.023  -3.585
  890   HH11  ARG 115          1HH1      ARG 115   6.034  13.183  -2.344
  891   HH12  ARG 115          2HH1      ARG 115   6.567  14.825  -2.222
  892   HH21  ARG 115          1HH2      ARG 115   3.554  16.191  -3.430
  893   HH22  ARG 115          2HH2      ARG 115   5.145  16.552  -2.859
  894    H    THR 116           HN       THR 116  -0.838  10.064  -3.668
  895    HA   THR 116           HA       THR 116  -1.094  10.222  -6.548
  896    HB   THR 116           HB       THR 116  -3.493  10.978  -5.815
  897    HG1  THR 116           1HG      THR 116  -3.581   9.564  -3.636
  898   HG21  THR 116          3HG2      THR 116  -2.478   8.170  -5.328
  899   HG22  THR 116          1HG2      THR 116  -2.967   8.833  -6.887
  900   HG23  THR 116          2HG2      THR 116  -4.160   8.623  -5.606
  901    H    GLU 117           HN       GLU 117  -0.855  12.341  -3.769
  902    HA   GLU 117           HA       GLU 117  -0.632  14.614  -5.604
  903    HB2  GLU 117           2HB      GLU 117  -2.225  14.619  -3.031
  904    HB3  GLU 117           1HB      GLU 117  -1.813  16.047  -3.948
  905    HG2  GLU 117           2HG      GLU 117  -3.134  15.325  -5.806
  906    HG3  GLU 117           1HG      GLU 117  -3.436  13.768  -5.039
  Start of MODEL    7
    1    H1   GLY   1           1HT      GLY   1  18.467  22.932  -8.156
    2    H2   GLY   1           2HT      GLY   1  17.373  24.208  -8.284
    3    H3   GLY   1           3HT      GLY   1  17.877  23.383  -9.673
    4    HA2  GLY   1           1HA      GLY   1  15.657  22.700  -9.059
    5    HA3  GLY   1           2HA      GLY   1  16.800  21.373  -8.920
    6    H    SER   2           HN       SER   2  15.616  24.076  -6.916
    7    HA   SER   2           HA       SER   2  16.090  22.749  -4.468
    8    HB2  SER   2           2HB      SER   2  14.147  25.005  -4.995
    9    HB3  SER   2           1HB      SER   2  14.896  24.588  -3.455
   10    HG   SER   2           HG       SER   2  15.854  26.376  -4.747
   11    H    HIS   3           HN       HIS   3  15.108  20.863  -4.046
   12    HA   HIS   3           HA       HIS   3  12.188  20.827  -4.047
   13    HB2  HIS   3           2HB      HIS   3  13.926  18.712  -5.330
   14    HB3  HIS   3           1HB      HIS   3  12.230  18.471  -4.937
   15    HD1  HIS   3           1HD      HIS   3  14.283  19.336  -7.691
   16    HD2  HIS   3           2HD      HIS   3  10.615  20.673  -6.270
   17    HE1  HIS   3           1HE      HIS   3  13.188  20.504  -9.631
   18    HE2  HIS   3           2HE      HIS   3  11.048  21.443  -8.693
   19    H    MET   4           HN       MET   4  11.310  19.769  -2.355
   20    HA   MET   4           HA       MET   4  13.004  18.100  -0.661
   21    HB2  MET   4           2HB      MET   4  12.421  19.365   1.360
   22    HB3  MET   4           1HB      MET   4  13.318  20.366   0.225
   23    HG2  MET   4           2HG      MET   4  11.208  21.382  -0.516
   24    HG3  MET   4           1HG      MET   4  10.337  20.407   0.663
   25    HE1  MET   4           3HE      MET   4  10.256  23.642   0.337
   26    HE2  MET   4           1HE      MET   4  10.210  24.115   2.037
   27    HE3  MET   4           2HE      MET   4   9.249  22.747   1.476
   28    H    GLU   5           HN       GLU   5  11.615  17.282   1.239
   29    HA   GLU   5           HA       GLU   5   9.275  16.065   0.172
   30    HB2  GLU   5           2HB      GLU   5  10.509  16.123   2.924
   31    HB3  GLU   5           1HB      GLU   5   8.982  15.316   2.615
   32    HG2  GLU   5           2HG      GLU   5  10.858  13.757   2.630
   33    HG3  GLU   5           1HG      GLU   5  10.060  13.802   1.063
   34    HA   PRO   6           HA       PRO   6   6.507  19.414   1.160
   35    HB2  PRO   6           2HB      PRO   6   4.176  18.007   0.831
   36    HB3  PRO   6           1HB      PRO   6   5.107  18.676  -0.513
   37    HG2  PRO   6           2HG      PRO   6   5.046  15.882   0.546
   38    HG3  PRO   6           1HG      PRO   6   5.092  16.443  -1.135
   39    HD2  PRO   6           2HD      PRO   6   7.286  15.526   0.141
   40    HD3  PRO   6           1HD      PRO   6   7.370  16.808  -1.083
   41    H    ALA   7           HN       ALA   7   5.140  19.991   2.886
   42    HA   ALA   7           HA       ALA   7   5.620  18.540   5.293
   43    HB1  ALA   7           1HB      ALA   7   4.313  20.280   6.377
   44    HB2  ALA   7           2HB      ALA   7   3.763  20.864   4.808
   45    HB3  ALA   7           3HB      ALA   7   5.465  20.989   5.247
   46    H    ARG   8           HN       ARG   8   3.046  18.721   2.993
   47    HA   ARG   8           HA       ARG   8   1.625  16.607   4.427
   48    HB2  ARG   8           2HB      ARG   8   0.590  18.833   4.957
   49    HB3  ARG   8           1HB      ARG   8   0.244  19.020   3.245
   50    HG2  ARG   8           2HG      ARG   8  -1.204  17.083   3.299
   51    HG3  ARG   8           1HG      ARG   8  -0.811  16.815   5.000
   52    HD2  ARG   8           2HD      ARG   8  -1.750  19.047   5.519
   53    HD3  ARG   8           1HD      ARG   8  -2.221  19.210   3.828
   54    HE   ARG   8           HE       ARG   8  -3.258  16.814   4.917
   55   HH11  ARG   8          1HH1      ARG   8  -3.743  20.282   5.043
   56   HH12  ARG   8          2HH1      ARG   8  -5.435  20.161   5.367
   57   HH21  ARG   8          1HH2      ARG   8  -5.482  16.644   5.350
   58   HH22  ARG   8          2HH2      ARG   8  -6.431  18.074   5.560
   59    H    VAL   9           HN       VAL   9   0.958  15.007   3.084
   60    HA   VAL   9           HA       VAL   9   0.807  15.577   0.211
   61    HB   VAL   9           HB       VAL   9   3.082  14.648   0.774
   62   HG11  VAL   9          1HG1      VAL   9   1.511  12.168   1.452
   63   HG12  VAL   9          2HG1      VAL   9   2.473  13.141   2.565
   64   HG13  VAL   9          3HG1      VAL   9   3.263  12.249   1.264
   65   HG21  VAL   9          3HG2      VAL   9   3.101  12.994  -1.039
   66   HG22  VAL   9          1HG2      VAL   9   2.184  14.438  -1.469
   67   HG23  VAL   9          2HG2      VAL   9   1.339  12.960  -1.011
   68    H    ARG  10           HN       ARG  10  -0.584  14.267  -0.949
   69    HA   ARG  10           HA       ARG  10  -2.368  12.581   0.664
   70    HB2  ARG  10           2HB      ARG  10  -3.443  14.418  -0.569
   71    HB3  ARG  10           1HB      ARG  10  -2.766  13.800  -2.068
   72    HG2  ARG  10           2HG      ARG  10  -4.060  11.728  -1.772
   73    HG3  ARG  10           1HG      ARG  10  -4.786  12.420  -0.319
   74    HD2  ARG  10           2HD      ARG  10  -5.644  14.284  -1.687
   75    HD3  ARG  10           1HD      ARG  10  -4.990  13.498  -3.120
   76    HE   ARG  10           HE       ARG  10  -6.613  11.634  -1.856
   77   HH11  ARG  10          1HH1      ARG  10  -6.917  14.743  -3.473
   78   HH12  ARG  10          2HH1      ARG  10  -8.585  14.501  -3.884
   79   HH21  ARG  10          1HH2      ARG  10  -8.819  11.324  -2.419
   80   HH22  ARG  10          2HH2      ARG  10  -9.666  12.563  -3.280
   81    H    CYS  11           HN       CYS  11  -1.889  10.487   0.561
   82    HA   CYS  11           HA       CYS  11  -1.012   9.424  -2.030
   83    HB2  CYS  11           2HB      CYS  11   0.073   8.656   0.682
   84    HB3  CYS  11           1HB      CYS  11   0.477   7.858  -0.833
   85    HG   CYS  11           HG       CYS  11   1.854  10.480   0.546
   86    H    SER  12           HN       SER  12  -1.495   7.245  -2.422
   87    HA   SER  12           HA       SER  12  -3.795   6.248  -0.903
   88    HB2  SER  12           2HB      SER  12  -2.874   5.470  -3.686
   89    HB3  SER  12           1HB      SER  12  -4.401   5.035  -2.915
   90    HG   SER  12           HG       SER  12  -3.535   7.597  -3.774
   91    H    HIS  13           HN       HIS  13  -3.814   3.939  -0.388
   92    HA   HIS  13           HA       HIS  13  -1.107   2.791  -0.344
   93    HB2  HIS  13           2HB      HIS  13  -1.231   2.211   1.971
   94    HB3  HIS  13           1HB      HIS  13  -1.631   3.915   1.830
   95    HD1  HIS  13           1HD      HIS  13  -2.531   1.418   3.934
   96    HD2  HIS  13           2HD      HIS  13  -4.835   3.792   1.426
   97    HE1  HIS  13           1HE      HIS  13  -4.850   1.362   4.895
   98    HE2  HIS  13           2HE      HIS  13  -6.139   3.021   3.511
   99    H    LEU  14           HN       LEU  14  -0.914   0.699  -0.671
  100    HA   LEU  14           HA       LEU  14  -3.344  -0.966  -0.676
  101    HB2  LEU  14           2HB      LEU  14  -2.304  -0.636  -2.929
  102    HB3  LEU  14           1HB      LEU  14  -0.822  -1.332  -2.303
  103    HG   LEU  14           HG       LEU  14  -2.131  -3.444  -1.840
  104   HD11  LEU  14          1HD1      LEU  14  -4.164  -2.115  -3.603
  105   HD12  LEU  14          2HD1      LEU  14  -4.343  -2.432  -1.879
  106   HD13  LEU  14          3HD1      LEU  14  -4.206  -3.777  -3.012
  107   HD21  LEU  14          3HD2      LEU  14  -2.113  -4.151  -4.211
  108   HD22  LEU  14          1HD2      LEU  14  -0.639  -3.327  -3.708
  109   HD23  LEU  14          2HD2      LEU  14  -1.840  -2.472  -4.673
  110    H    LEU  15           HN       LEU  15  -3.285  -2.685   0.684
  111    HA   LEU  15           HA       LEU  15  -0.670  -3.400   1.801
  112    HB2  LEU  15           2HB      LEU  15  -1.817  -1.986   3.414
  113    HB3  LEU  15           1HB      LEU  15  -3.227  -3.020   3.355
  114    HG   LEU  15           HG       LEU  15  -2.047  -4.808   4.469
  115   HD11  LEU  15          1HD1      LEU  15   0.365  -3.015   4.287
  116   HD12  LEU  15          2HD1      LEU  15   0.134  -4.565   3.474
  117   HD13  LEU  15          3HD1      LEU  15   0.275  -4.499   5.232
  118   HD21  LEU  15          3HD2      LEU  15  -1.582  -3.765   6.612
  119   HD22  LEU  15          1HD2      LEU  15  -3.011  -3.037   5.880
  120   HD23  LEU  15          2HD2      LEU  15  -1.471  -2.184   5.841
  121    H    VAL  16           HN       VAL  16  -0.203  -5.408   1.489
  122    HA   VAL  16           HA       VAL  16  -2.366  -7.394   1.213
  123    HB   VAL  16           HB       VAL  16   0.418  -7.466   0.012
  124   HG11  VAL  16          1HG1      VAL  16  -1.929  -9.319  -0.384
  125   HG12  VAL  16          2HG1      VAL  16  -0.440  -9.694   0.485
  126   HG13  VAL  16          3HG1      VAL  16  -0.396  -9.400  -1.254
  127   HG21  VAL  16          3HG2      VAL  16  -0.660  -7.097  -2.133
  128   HG22  VAL  16          1HG2      VAL  16  -0.996  -5.760  -1.034
  129   HG23  VAL  16          2HG2      VAL  16  -2.233  -6.980  -1.344
  130    H    LYS  17           HN       LYS  17  -2.329  -9.094   2.572
  131    HA   LYS  17           HA       LYS  17  -0.447  -9.048   4.776
  132    HB2  LYS  17           2HB      LYS  17  -2.803 -10.824   4.151
  133    HB3  LYS  17           1HB      LYS  17  -1.819 -10.980   5.596
  134    HG2  LYS  17           2HG      LYS  17  -3.207  -8.420   4.909
  135    HG3  LYS  17           1HG      LYS  17  -4.024  -9.722   5.771
  136    HD2  LYS  17           2HD      LYS  17  -2.176  -9.639   7.458
  137    HD3  LYS  17           1HD      LYS  17  -1.572  -8.198   6.635
  138    HE2  LYS  17           2HE      LYS  17  -2.953  -7.577   8.540
  139    HE3  LYS  17           1HE      LYS  17  -3.714  -7.081   7.031
  140    HZ1  LYS  17           3HZ      LYS  17  -5.339  -8.051   8.494
  141    HZ2  LYS  17           1HZ      LYS  17  -4.432  -9.467   8.655
  142    HZ3  LYS  17           2HZ      LYS  17  -5.135  -9.077   7.166
  143    H    HIS  18           HN       HIS  18   0.606 -11.028   5.541
  144    HA   HIS  18           HA       HIS  18   1.065 -13.089   3.557
  145    HB2  HIS  18           2HB      HIS  18   3.518 -13.033   3.790
  146    HB3  HIS  18           1HB      HIS  18   2.911 -11.536   3.109
  147    HD1  HIS  18           1HD      HIS  18   4.792 -12.914   5.993
  148    HD2  HIS  18           2HD      HIS  18   3.197  -9.267   4.815
  149    HE1  HIS  18           1HE      HIS  18   5.865 -11.204   7.476
  150    HE2  HIS  18           2HE      HIS  18   4.748  -9.040   6.886
  151    H    SER  19           HN       SER  19   2.174 -14.979   4.472
  152    HA   SER  19           HA       SER  19   0.904 -16.216   6.451
  153    HB2  SER  19           2HB      SER  19   2.550 -17.321   5.034
  154    HB3  SER  19           1HB      SER  19   3.860 -16.512   5.890
  155    HG   SER  19           HG       SER  19   2.002 -18.151   7.250
  156    H    GLN  20           HN       GLN  20   4.079 -14.710   7.193
  157    HA   GLN  20           HA       GLN  20   3.669 -14.909   9.991
  158    HB2  GLN  20           2HB      GLN  20   5.914 -14.771   8.964
  159    HB3  GLN  20           1HB      GLN  20   5.578 -13.119   8.471
  160    HG2  GLN  20           2HG      GLN  20   5.408 -12.444  10.805
  161    HG3  GLN  20           1HG      GLN  20   5.705 -14.104  11.313
  162   HE21  GLN  20          1HE2      GLN  20   7.691 -14.566   9.224
  163   HE22  GLN  20          2HE2      GLN  20   9.106 -13.715   9.717
  164    H    SER  21           HN       SER  21   1.774 -13.997  10.561
  165    HA   SER  21           HA       SER  21   1.679 -11.090  10.545
  166    HB2  SER  21           2HB      SER  21   0.372 -11.728   8.591
  167    HB3  SER  21           1HB      SER  21  -0.549 -12.886   9.549
  168    HG   SER  21           HG       SER  21  -1.822 -11.133   9.515
  169    H    ARG  22           HN       ARG  22   0.651 -10.221  12.301
  170    HA   ARG  22           HA       ARG  22   0.171 -11.985  14.515
  171    HB2  ARG  22           2HB      ARG  22  -0.701  -9.604  15.481
  172    HB3  ARG  22           1HB      ARG  22   0.977 -10.110  15.492
  173    HG2  ARG  22           2HG      ARG  22   0.906  -7.871  14.721
  174    HG3  ARG  22           1HG      ARG  22   1.281  -8.887  13.334
  175    HD2  ARG  22           2HD      ARG  22  -1.147  -8.805  12.729
  176    HD3  ARG  22           1HD      ARG  22  -1.366  -7.623  14.021
  177    HE   ARG  22           HE       ARG  22   0.714  -6.926  12.176
  178   HH11  ARG  22          1HH1      ARG  22  -2.737  -6.725  12.784
  179   HH12  ARG  22          2HH1      ARG  22  -2.971  -5.358  11.753
  180   HH21  ARG  22          1HH2      ARG  22   0.418  -5.114  10.798
  181   HH22  ARG  22          2HH2      ARG  22  -1.174  -4.449  10.611
  182    H    ARG  23           HN       ARG  23  -1.654 -11.065  11.945
  183    HA   ARG  23           HA       ARG  23  -3.979 -12.287  13.110
  184    HB2  ARG  23           2HB      ARG  23  -4.259  -9.852  13.650
  185    HB3  ARG  23           1HB      ARG  23  -4.252  -9.518  11.924
  186    HG2  ARG  23           2HG      ARG  23  -6.292 -10.657  11.590
  187    HG3  ARG  23           1HG      ARG  23  -6.224 -11.395  13.191
  188    HD2  ARG  23           2HD      ARG  23  -6.570  -8.455  12.610
  189    HD3  ARG  23           1HD      ARG  23  -7.841  -9.564  13.123
  190    HE   ARG  23           HE       ARG  23  -5.585  -9.437  14.912
  191   HH11  ARG  23          1HH1      ARG  23  -8.697  -8.046  14.109
  192   HH12  ARG  23          2HH1      ARG  23  -8.953  -7.395  15.692
  193   HH21  ARG  23          1HH2      ARG  23  -5.918  -8.557  17.008
  194   HH22  ARG  23          2HH2      ARG  23  -7.378  -7.689  17.336
  195    HA   PRO  24           HA       PRO  24  -3.457 -13.485   8.801
  196    HB2  PRO  24           2HB      PRO  24  -3.947 -16.067   9.115
  197    HB3  PRO  24           1HB      PRO  24  -2.457 -15.356   9.752
  198    HG2  PRO  24           2HG      PRO  24  -4.954 -16.129  11.201
  199    HG3  PRO  24           1HG      PRO  24  -3.264 -16.299  11.708
  200    HD2  PRO  24           2HD      PRO  24  -5.005 -14.236  12.458
  201    HD3  PRO  24           1HD      PRO  24  -3.239 -14.215  12.624
  202    H    SER  25           HN       SER  25  -6.059 -12.560  10.210
  203    HA   SER  25           HA       SER  25  -7.844 -13.847   8.283
  204    HB2  SER  25           2HB      SER  25  -8.594 -13.022  11.096
  205    HB3  SER  25           1HB      SER  25  -9.651 -13.794   9.913
  206    HG   SER  25           HG       SER  25  -8.665 -15.222  11.507
  207    H    SER  26           HN       SER  26  -7.775 -12.242   6.819
  208    HA   SER  26           HA       SER  26  -8.325  -9.502   7.637
  209    HB2  SER  26           2HB      SER  26  -7.660 -10.664   4.924
  210    HB3  SER  26           1HB      SER  26  -7.789  -8.946   5.302
  211    H    TRP  27           HN       TRP  27  -9.758  -8.381   5.722
  212    HA   TRP  27           HA       TRP  27 -12.390  -9.199   6.310
  213    HB2  TRP  27           2HB      TRP  27 -13.119  -7.351   5.050
  214    HB3  TRP  27           1HB      TRP  27 -11.544  -6.858   5.667
  215    HD1  TRP  27           1HD      TRP  27  -9.476  -6.905   3.828
  216    HE1  TRP  27           1HE      TRP  27  -9.513  -6.546   1.292
  217    HE3  TRP  27           3HE      TRP  27 -14.467  -7.635   2.983
  218    HZ2  TRP  27           2HZ      TRP  27 -11.404  -6.564  -0.799
  219    HZ3  TRP  27           3HZ      TRP  27 -15.306  -7.438   0.678
  220    HH2  TRP  27           2HH      TRP  27 -13.805  -6.914  -1.171
  221    H    ARG  28           HN       ARG  28 -10.243 -10.216   3.817
  222    HA   ARG  28           HA       ARG  28 -12.501 -11.406   2.336
  223    HB2  ARG  28           2HB      ARG  28 -11.236 -11.167   0.288
  224    HB3  ARG  28           1HB      ARG  28 -11.393  -9.603   1.079
  225    HG2  ARG  28           2HG      ARG  28  -9.139  -9.691   1.860
  226    HG3  ARG  28           1HG      ARG  28  -8.963 -11.359   1.318
  227    HD2  ARG  28           2HD      ARG  28  -9.357 -10.543  -1.017
  228    HD3  ARG  28           1HD      ARG  28  -9.282  -8.895  -0.388
  229    HE   ARG  28           HE       ARG  28  -6.988  -9.874   0.527
  230   HH11  ARG  28          1HH1      ARG  28  -8.417 -10.150  -2.675
  231   HH12  ARG  28          2HH1      ARG  28  -6.887 -10.308  -3.466
  232   HH21  ARG  28          1HH2      ARG  28  -4.985 -10.052  -0.530
  233   HH22  ARG  28          2HH2      ARG  28  -4.936 -10.247  -2.253
  234    H    GLN  29           HN       GLN  29 -10.046 -12.290   4.354
  235    HA   GLN  29           HA       GLN  29  -9.984 -14.936   3.249
  236    HB2  GLN  29           2HB      GLN  29  -8.036 -14.871   2.151
  237    HB3  GLN  29           1HB      GLN  29  -7.949 -13.154   2.457
  238    HG2  GLN  29           2HG      GLN  29  -6.845 -15.210   4.363
  239    HG3  GLN  29           1HG      GLN  29  -5.910 -14.543   3.028
  240   HE21  GLN  29          1HE2      GLN  29  -5.366 -12.317   3.083
  241   HE22  GLN  29          2HE2      GLN  29  -5.359 -11.446   4.578
  242    H    GLU  30           HN       GLU  30  -8.713 -16.470   4.592
  243    HA   GLU  30           HA       GLU  30  -8.225 -15.609   7.319
  244    HB2  GLU  30           2HB      GLU  30 -10.637 -16.297   7.206
  245    HB3  GLU  30           1HB      GLU  30 -10.110 -17.895   6.699
  246    HG2  GLU  30           2HG      GLU  30  -8.951 -18.208   8.805
  247    HG3  GLU  30           1HG      GLU  30  -9.406 -16.582   9.314
  248    H    LYS  31           HN       LYS  31  -6.865 -17.038   8.452
  249    HA   LYS  31           HA       LYS  31  -4.897 -18.133   8.528
  250    HB2  LYS  31           2HB      LYS  31  -5.030 -20.591   8.045
  251    HB3  LYS  31           1HB      LYS  31  -6.292 -19.987   9.096
  252    HG2  LYS  31           2HG      LYS  31  -7.877 -20.051   7.242
  253    HG3  LYS  31           1HG      LYS  31  -6.599 -20.617   6.164
  254    HD2  LYS  31           2HD      LYS  31  -6.326 -22.623   7.539
  255    HD3  LYS  31           1HD      LYS  31  -7.598 -22.054   8.623
  256    HE2  LYS  31           2HE      LYS  31  -9.211 -22.150   6.800
  257    HE3  LYS  31           1HE      LYS  31  -7.942 -22.665   5.691
  258    HZ1  LYS  31           3HZ      LYS  31  -9.263 -24.529   6.476
  259    HZ2  LYS  31           1HZ      LYS  31  -8.862 -24.172   8.076
  260    HZ3  LYS  31           2HZ      LYS  31  -7.664 -24.676   6.993
  261    H    ILE  32           HN       ILE  32  -3.772 -16.824   7.212
  262    HA   ILE  32           HA       ILE  32  -3.614 -17.005   4.407
  263    HB   ILE  32           HB       ILE  32  -1.537 -15.862   6.276
  264   HG12  ILE  32          2HG1      ILE  32  -3.933 -14.474   5.062
  265   HG13  ILE  32          1HG1      ILE  32  -3.839 -15.012   6.735
  266   HG21  ILE  32          1HG2      ILE  32  -2.226 -15.220   3.408
  267   HG22  ILE  32          2HG2      ILE  32  -0.793 -16.085   3.965
  268   HG23  ILE  32          3HG2      ILE  32  -1.019 -14.388   4.388
  269   HD11  ILE  32          3HD1      ILE  32  -3.386 -12.635   6.528
  270   HD12  ILE  32          1HD1      ILE  32  -2.046 -12.982   5.437
  271   HD13  ILE  32          2HD1      ILE  32  -1.969 -13.505   7.118
  272    H    THR  33           HN       THR  33  -2.461 -18.259   3.100
  273    HA   THR  33           HA       THR  33  -0.468 -20.071   4.233
  274    HB   THR  33           HB       THR  33  -0.595 -21.103   1.892
  275    HG1  THR  33           1HG      THR  33  -2.182 -20.436   0.566
  276   HG21  THR  33          3HG2      THR  33  -2.652 -22.319   2.397
  277   HG22  THR  33          1HG2      THR  33  -3.106 -21.080   3.566
  278   HG23  THR  33          2HG2      THR  33  -1.691 -22.092   3.859
  279    H    ARG  34           HN       ARG  34  -0.944 -17.717   1.639
  280    HA   ARG  34           HA       ARG  34   1.595 -17.774   0.495
  281    HB2  ARG  34           2HB      ARG  34   1.038 -15.329  -0.147
  282    HB3  ARG  34           1HB      ARG  34   0.007 -16.612  -0.757
  283    HG2  ARG  34           2HG      ARG  34  -1.661 -16.128   0.915
  284    HG3  ARG  34           1HG      ARG  34  -0.609 -14.925   1.659
  285    HD2  ARG  34           2HD      ARG  34  -0.861 -13.435  -0.113
  286    HD3  ARG  34           1HD      ARG  34  -1.400 -14.697  -1.219
  287    HE   ARG  34           HE       ARG  34  -3.507 -14.739  -0.029
  288   HH11  ARG  34          1HH1      ARG  34  -1.465 -11.951   0.677
  289   HH12  ARG  34          2HH1      ARG  34  -2.801 -10.927   1.094
  290   HH21  ARG  34          1HH2      ARG  34  -5.257 -13.370   0.538
  291   HH22  ARG  34          2HH2      ARG  34  -4.959 -11.731   1.028
  292    H    THR  35           HN       THR  35   3.441 -17.541   1.501
  293    HA   THR  35           HA       THR  35   3.650 -15.877   3.833
  294    HB   THR  35           HB       THR  35   4.803 -18.069   3.723
  295    HG1  THR  35           1HG      THR  35   7.034 -16.962   4.191
  296   HG21  THR  35          3HG2      THR  35   6.903 -18.246   2.417
  297   HG22  THR  35          1HG2      THR  35   6.506 -16.720   1.628
  298   HG23  THR  35          2HG2      THR  35   5.465 -18.129   1.411
  299    H    LYS  36           HN       LYS  36   6.034 -14.678   3.768
  300    HA   LYS  36           HA       LYS  36   5.478 -12.286   2.441
  301    HB2  LYS  36           2HB      LYS  36   6.842 -12.397   4.444
  302    HB3  LYS  36           1HB      LYS  36   8.083 -13.291   3.585
  303    HG2  LYS  36           2HG      LYS  36   8.635 -11.379   2.261
  304    HG3  LYS  36           1HG      LYS  36   7.259 -10.480   2.907
  305    HD2  LYS  36           2HD      LYS  36   8.223 -10.447   5.098
  306    HD3  LYS  36           1HD      LYS  36   9.511 -11.542   4.602
  307    HE2  LYS  36           2HE      LYS  36   9.085  -8.782   3.472
  308    HE3  LYS  36           1HE      LYS  36  10.207  -9.162   4.778
  309    HZ1  LYS  36           3HZ      LYS  36  11.375  -9.104   2.696
  310    HZ2  LYS  36           1HZ      LYS  36  10.320 -10.229   2.007
  311    HZ3  LYS  36           2HZ      LYS  36  11.341 -10.694   3.261
  312    H    GLU  37           HN       GLU  37   7.732 -14.877   1.534
  313    HA   GLU  37           HA       GLU  37   8.795 -13.563  -0.735
  314    HB2  GLU  37           2HB      GLU  37   8.587 -16.504  -0.100
  315    HB3  GLU  37           1HB      GLU  37   9.507 -15.845  -1.443
  316    HG2  GLU  37           2HG      GLU  37  10.920 -14.623   0.130
  317    HG3  GLU  37           1HG      GLU  37  10.006 -15.304   1.473
  318    H    GLU  38           HN       GLU  38   6.027 -15.679  -0.303
  319    HA   GLU  38           HA       GLU  38   5.508 -15.954  -3.107
  320    HB2  GLU  38           2HB      GLU  38   3.637 -16.529  -0.810
  321    HB3  GLU  38           1HB      GLU  38   3.526 -17.157  -2.448
  322    HG2  GLU  38           2HG      GLU  38   5.683 -17.770  -0.445
  323    HG3  GLU  38           1HG      GLU  38   4.374 -18.846  -0.931
  324    H    ALA  39           HN       ALA  39   4.482 -13.827  -0.552
  325    HA   ALA  39           HA       ALA  39   2.232 -12.699  -1.817
  326    HB1  ALA  39           1HB      ALA  39   2.463 -10.877  -0.212
  327    HB2  ALA  39           2HB      ALA  39   4.086 -11.434   0.201
  328    HB3  ALA  39           3HB      ALA  39   2.685 -12.438   0.577
  329    H    LEU  40           HN       LEU  40   5.628 -12.247  -2.239
  330    HA   LEU  40           HA       LEU  40   5.660  -9.708  -3.423
  331    HB2  LEU  40           2HB      LEU  40   7.461 -12.074  -3.896
  332    HB3  LEU  40           1HB      LEU  40   7.779 -10.454  -4.481
  333    HG   LEU  40           HG       LEU  40   7.547 -11.209  -1.577
  334   HD11  LEU  40          1HD1      LEU  40   9.992 -10.649  -3.248
  335   HD12  LEU  40          2HD1      LEU  40   9.502 -12.228  -2.634
  336   HD13  LEU  40          3HD1      LEU  40   9.969 -10.952  -1.512
  337   HD21  LEU  40          3HD2      LEU  40   8.513  -8.984  -1.191
  338   HD22  LEU  40          1HD2      LEU  40   6.949  -8.892  -2.002
  339   HD23  LEU  40          2HD2      LEU  40   8.434  -8.659  -2.922
  340    H    GLU  41           HN       GLU  41   4.857 -12.865  -4.705
  341    HA   GLU  41           HA       GLU  41   4.982 -12.168  -7.429
  342    HB2  GLU  41           2HB      GLU  41   3.329 -14.267  -6.026
  343    HB3  GLU  41           1HB      GLU  41   3.460 -14.120  -7.773
  344    HG2  GLU  41           2HG      GLU  41   5.910 -14.436  -7.562
  345    HG3  GLU  41           1HG      GLU  41   5.681 -14.726  -5.840
  346    H    LEU  42           HN       LEU  42   2.509 -11.799  -4.995
  347    HA   LEU  42           HA       LEU  42   0.511 -10.868  -6.824
  348    HB2  LEU  42           2HB      LEU  42   0.754 -10.682  -3.817
  349    HB3  LEU  42           1HB      LEU  42  -0.595 -10.005  -4.699
  350    HG   LEU  42           HG       LEU  42  -1.304 -12.076  -3.774
  351   HD11  LEU  42          1HD1      LEU  42  -0.737 -12.496  -6.697
  352   HD12  LEU  42          2HD1      LEU  42  -2.110 -11.628  -6.014
  353   HD13  LEU  42          3HD1      LEU  42  -1.934 -13.361  -5.733
  354   HD21  LEU  42          3HD2      LEU  42  -0.189 -14.211  -4.218
  355   HD22  LEU  42          1HD2      LEU  42   0.865 -13.094  -3.353
  356   HD23  LEU  42          2HD2      LEU  42   1.092 -13.361  -5.081
  357    H    ILE  43           HN       ILE  43   2.777  -9.382  -4.559
  358    HA   ILE  43           HA       ILE  43   2.095  -6.700  -4.915
  359    HB   ILE  43           HB       ILE  43   4.803  -7.907  -4.311
  360   HG12  ILE  43          2HG1      ILE  43   3.085  -8.485  -2.665
  361   HG13  ILE  43          1HG1      ILE  43   4.267  -7.380  -1.972
  362   HG21  ILE  43          1HG2      ILE  43   3.883  -5.058  -3.954
  363   HG22  ILE  43          2HG2      ILE  43   5.057  -5.630  -5.138
  364   HG23  ILE  43          3HG2      ILE  43   5.426  -5.721  -3.416
  365   HD11  ILE  43          3HD1      ILE  43   2.032  -6.794  -1.268
  366   HD12  ILE  43          1HD1      ILE  43   1.510  -6.660  -2.947
  367   HD13  ILE  43          2HD1      ILE  43   2.694  -5.525  -2.301
  368    H    ASN  44           HN       ASN  44   4.757  -8.486  -6.487
  369    HA   ASN  44           HA       ASN  44   5.517  -6.484  -8.278
  370    HB2  ASN  44           2HB      ASN  44   5.701  -9.494  -8.523
  371    HB3  ASN  44           1HB      ASN  44   6.438  -8.385  -9.672
  372   HD21  ASN  44          1HD2      ASN  44   8.484  -9.173  -9.196
  373   HD22  ASN  44          2HD2      ASN  44   9.305  -8.771  -7.725
  374    H    GLY  45           HN       GLY  45   3.083  -9.023  -8.581
  375    HA2  GLY  45           2HA      GLY  45   2.395  -8.644 -11.262
  376    HA3  GLY  45           1HA      GLY  45   1.314  -9.259 -10.017
  377    H    TYR  46           HN       TYR  46   1.089  -7.120  -8.334
  378    HA   TYR  46           HA       TYR  46  -0.806  -5.491  -9.614
  379    HB2  TYR  46           2HB      TYR  46   0.717  -4.994  -7.049
  380    HB3  TYR  46           1HB      TYR  46  -0.679  -4.071  -7.577
  381    HD1  TYR  46           2HD      TYR  46  -2.283  -6.485  -8.628
  382    HD2  TYR  46           1HD      TYR  46  -0.153  -5.795  -5.010
  383    HE1  TYR  46           2HE      TYR  46  -3.751  -8.075  -7.463
  384    HE2  TYR  46           1HE      TYR  46  -1.619  -7.380  -3.842
  385    HH   TYR  46           HH       TYR  46  -3.877  -8.300  -4.093
  386    H    ILE  47           HN       ILE  47   2.510  -4.785  -8.567
  387    HA   ILE  47           HA       ILE  47   2.690  -2.146  -9.368
  388    HB   ILE  47           HB       ILE  47   4.863  -4.255  -9.381
  389   HG12  ILE  47          2HG1      ILE  47   4.127  -2.163  -7.317
  390   HG13  ILE  47          1HG1      ILE  47   3.776  -3.882  -7.196
  391   HG21  ILE  47          1HG2      ILE  47   6.442  -2.353  -9.236
  392   HG22  ILE  47          2HG2      ILE  47   5.098  -1.251  -9.535
  393   HG23  ILE  47          3HG2      ILE  47   5.574  -2.418 -10.768
  394   HD11  ILE  47          3HD1      ILE  47   6.171  -4.365  -7.152
  395   HD12  ILE  47          1HD1      ILE  47   5.698  -3.277  -5.847
  396   HD13  ILE  47          2HD1      ILE  47   6.516  -2.641  -7.274
  397    H    GLN  48           HN       GLN  48   3.370  -5.049 -11.299
  398    HA   GLN  48           HA       GLN  48   4.181  -3.631 -13.612
  399    HB2  GLN  48           2HB      GLN  48   3.127  -6.453 -13.356
  400    HB3  GLN  48           1HB      GLN  48   3.902  -5.795 -14.791
  401    HG2  GLN  48           2HG      GLN  48   5.176  -6.135 -12.082
  402    HG3  GLN  48           1HG      GLN  48   5.450  -7.147 -13.496
  403   HE21  GLN  48          1HE2      GLN  48   6.762  -6.403 -15.139
  404   HE22  GLN  48          2HE2      GLN  48   7.739  -4.987 -14.984
  405    H    LYS  49           HN       LYS  49   1.050  -4.549 -12.400
  406    HA   LYS  49           HA       LYS  49  -0.277  -4.047 -14.925
  407    HB2  LYS  49           2HB      LYS  49  -1.212  -4.878 -12.203
  408    HB3  LYS  49           1HB      LYS  49  -2.353  -4.400 -13.452
  409    HG2  LYS  49           2HG      LYS  49  -1.634  -6.168 -14.884
  410    HG3  LYS  49           1HG      LYS  49  -0.305  -6.572 -13.796
  411    HD2  LYS  49           2HD      LYS  49  -1.705  -7.531 -12.233
  412    HD3  LYS  49           1HD      LYS  49  -3.112  -6.618 -12.784
  413    HE2  LYS  49           2HE      LYS  49  -1.757  -8.817 -14.338
  414    HE3  LYS  49           1HE      LYS  49  -3.226  -9.009 -13.378
  415    HZ1  LYS  49           3HZ      LYS  49  -3.931  -8.674 -15.581
  416    HZ2  LYS  49           1HZ      LYS  49  -2.866  -7.378 -15.834
  417    HZ3  LYS  49           2HZ      LYS  49  -4.189  -7.198 -14.796
  418    H    ILE  50           HN       ILE  50   0.214  -2.382 -11.889
  419    HA   ILE  50           HA       ILE  50  -1.679  -0.316 -12.288
  420    HB   ILE  50           HB       ILE  50   0.884  -0.313 -10.669
  421   HG12  ILE  50          2HG1      ILE  50  -1.947  -0.591  -9.671
  422   HG13  ILE  50          1HG1      ILE  50  -0.970  -1.983 -10.120
  423   HG21  ILE  50          1HG2      ILE  50  -1.441   1.610 -10.571
  424   HG22  ILE  50          2HG2      ILE  50   0.177   1.971 -11.172
  425   HG23  ILE  50          3HG2      ILE  50  -0.068   1.598  -9.465
  426   HD11  ILE  50          3HD1      ILE  50  -1.002  -1.466  -7.690
  427   HD12  ILE  50          1HD1      ILE  50  -0.154   0.036  -8.052
  428   HD13  ILE  50          2HD1      ILE  50   0.610  -1.514  -8.403
  429    H    LYS  51           HN       LYS  51   1.693  -0.698 -13.204
  430    HA   LYS  51           HA       LYS  51   2.009   1.959 -14.171
  431    HB2  LYS  51           2HB      LYS  51   3.637  -0.527 -14.663
  432    HB3  LYS  51           1HB      LYS  51   4.104   1.082 -15.198
  433    HG2  LYS  51           2HG      LYS  51   4.164   1.841 -12.872
  434    HG3  LYS  51           1HG      LYS  51   3.695   0.227 -12.335
  435    HD2  LYS  51           2HD      LYS  51   6.208   0.908 -13.864
  436    HD3  LYS  51           1HD      LYS  51   6.117   0.606 -12.128
  437    HE2  LYS  51           2HE      LYS  51   5.289  -1.664 -12.591
  438    HE3  LYS  51           1HE      LYS  51   5.432  -1.352 -14.317
  439    HZ1  LYS  51           3HZ      LYS  51   7.319  -2.589 -13.414
  440    HZ2  LYS  51           1HZ      LYS  51   7.698  -1.294 -12.400
  441    HZ3  LYS  51           2HZ      LYS  51   7.796  -1.108 -14.075
  442    H    SER  52           HN       SER  52   0.819  -0.995 -15.586
  443    HA   SER  52           HA       SER  52   1.000   0.053 -18.275
  444    HB2  SER  52           2HB      SER  52  -0.250  -2.102 -18.821
  445    HB3  SER  52           1HB      SER  52   1.356  -2.288 -18.115
  446    HG   SER  52           HG       SER  52  -0.345  -3.634 -17.174
  447    H    GLY  53           HN       GLY  53  -1.356  -0.253 -15.731
  448    HA2  GLY  53           2HA      GLY  53  -3.186   1.288 -15.625
  449    HA3  GLY  53           1HA      GLY  53  -3.221   1.314 -17.381
  450    H    GLU  54           HN       GLU  54  -2.742  -1.788 -16.295
  451    HA   GLU  54           HA       GLU  54  -5.201  -2.743 -17.271
  452    HB2  GLU  54           2HB      GLU  54  -3.153  -4.054 -15.484
  453    HB3  GLU  54           1HB      GLU  54  -4.501  -4.900 -16.230
  454    HG2  GLU  54           2HG      GLU  54  -3.637  -4.510 -18.409
  455    HG3  GLU  54           1HG      GLU  54  -2.405  -3.414 -17.785
  456    H    GLU  55           HN       GLU  55  -3.999  -2.877 -13.938
  457    HA   GLU  55           HA       GLU  55  -6.776  -2.800 -13.018
  458    HB2  GLU  55           2HB      GLU  55  -4.278  -4.019 -11.940
  459    HB3  GLU  55           1HB      GLU  55  -5.478  -3.460 -10.789
  460    HG2  GLU  55           2HG      GLU  55  -5.672  -5.863 -11.320
  461    HG3  GLU  55           1HG      GLU  55  -7.130  -4.950 -11.690
  462    H    ASP  56           HN       ASP  56  -7.468  -0.902 -12.327
  463    HA   ASP  56           HA       ASP  56  -5.741   1.298 -11.843
  464    HB2  ASP  56           2HB      ASP  56  -8.667   0.929 -11.153
  465    HB3  ASP  56           1HB      ASP  56  -7.794   2.450 -11.016
  466    H    PHE  57           HN       PHE  57  -4.762   1.935 -10.037
  467    HA   PHE  57           HA       PHE  57  -4.383   0.259  -7.877
  468    HB2  PHE  57           2HB      PHE  57  -2.946   2.209  -8.504
  469    HB3  PHE  57           1HB      PHE  57  -4.148   3.269  -7.779
  470    HD1  PHE  57           2HD      PHE  57  -1.699   0.620  -7.087
  471    HD2  PHE  57           1HD      PHE  57  -4.252   3.577  -5.422
  472    HE1  PHE  57           2HE      PHE  57  -0.595   0.333  -4.907
  473    HE2  PHE  57           1HE      PHE  57  -3.155   3.295  -3.237
  474    HZ   PHE  57           HZ       PHE  57  -1.327   1.673  -2.979
  475    H    GLU  58           HN       GLU  58  -6.749   2.852  -8.216
  476    HA   GLU  58           HA       GLU  58  -7.670   2.863  -5.560
  477    HB2  GLU  58           2HB      GLU  58  -9.148   3.552  -8.102
  478    HB3  GLU  58           1HB      GLU  58  -9.688   3.953  -6.476
  479    HG2  GLU  58           2HG      GLU  58  -7.811   5.401  -6.144
  480    HG3  GLU  58           1HG      GLU  58  -7.094   4.890  -7.673
  481    H    SER  59           HN       SER  59  -9.023   1.221  -8.425
  482    HA   SER  59           HA       SER  59 -11.019  -0.174  -6.977
  483    HB2  SER  59           2HB      SER  59 -11.185   0.221  -9.407
  484    HB3  SER  59           1HB      SER  59  -9.786  -0.817  -9.673
  485    HG   SER  59           HG       SER  59 -11.110  -2.419  -9.699
  486    H    LEU  60           HN       LEU  60  -7.698  -0.810  -7.747
  487    HA   LEU  60           HA       LEU  60  -7.611  -3.557  -7.134
  488    HB2  LEU  60           2HB      LEU  60  -5.884  -2.269  -8.389
  489    HB3  LEU  60           1HB      LEU  60  -5.425  -1.495  -6.888
  490    HG   LEU  60           HG       LEU  60  -4.846  -3.780  -6.001
  491   HD11  LEU  60          1HD1      LEU  60  -5.164  -4.531  -8.900
  492   HD12  LEU  60          2HD1      LEU  60  -6.157  -5.106  -7.561
  493   HD13  LEU  60          3HD1      LEU  60  -4.451  -5.542  -7.645
  494   HD21  LEU  60          3HD2      LEU  60  -3.353  -2.790  -8.425
  495   HD22  LEU  60          1HD2      LEU  60  -2.711  -3.861  -7.180
  496   HD23  LEU  60          2HD2      LEU  60  -3.157  -2.203  -6.773
  497    H    ALA  61           HN       ALA  61  -6.841  -0.662  -5.225
  498    HA   ALA  61           HA       ALA  61  -6.219  -2.065  -2.846
  499    HB1  ALA  61           1HB      ALA  61  -5.412   0.201  -3.300
  500    HB2  ALA  61           2HB      ALA  61  -6.278   0.115  -1.766
  501    HB3  ALA  61           3HB      ALA  61  -7.063   0.809  -3.184
  502    H    SER  62           HN       SER  62  -9.179  -1.038  -4.261
  503    HA   SER  62           HA       SER  62 -10.708  -1.066  -1.856
  504    HB2  SER  62           2HB      SER  62 -11.593  -1.030  -4.737
  505    HB3  SER  62           1HB      SER  62 -12.645  -0.777  -3.343
  506    HG   SER  62           HG       SER  62 -10.443   0.828  -4.165
  507    H    GLN  63           HN       GLN  63  -9.400  -3.579  -3.623
  508    HA   GLN  63           HA       GLN  63 -11.397  -5.464  -2.568
  509    HB2  GLN  63           2HB      GLN  63 -10.442  -5.481  -5.433
  510    HB3  GLN  63           1HB      GLN  63 -11.417  -6.732  -4.685
  511    HG2  GLN  63           2HG      GLN  63 -13.265  -5.245  -4.453
  512    HG3  GLN  63           1HG      GLN  63 -12.283  -3.871  -4.963
  513   HE21  GLN  63          1HE2      GLN  63 -11.717  -3.665  -7.113
  514   HE22  GLN  63          2HE2      GLN  63 -12.527  -4.537  -8.369
  515    H    PHE  64           HN       PHE  64  -8.378  -5.292  -4.438
  516    HA   PHE  64           HA       PHE  64  -7.568  -7.904  -3.562
  517    HB2  PHE  64           2HB      PHE  64  -6.167  -5.828  -5.241
  518    HB3  PHE  64           1HB      PHE  64  -5.525  -7.434  -4.914
  519    HD1  PHE  64           1HD      PHE  64  -8.201  -5.556  -6.613
  520    HD2  PHE  64           2HD      PHE  64  -6.366  -9.355  -6.048
  521    HE1  PHE  64           1HE      PHE  64  -9.455  -6.443  -8.534
  522    HE2  PHE  64           2HE      PHE  64  -7.616 -10.248  -7.968
  523    HZ   PHE  64           HZ       PHE  64  -9.163  -8.791  -9.214
  524    H    SER  65           HN       SER  65  -7.665  -5.289  -1.816
  525    HA   SER  65           HA       SER  65  -5.031  -5.646  -0.599
  526    HB2  SER  65           2HB      SER  65  -5.914  -3.301  -1.113
  527    HB3  SER  65           1HB      SER  65  -7.118  -3.580   0.141
  528    HG   SER  65           HG       SER  65  -4.601  -4.197   0.992
  529    H    ASP  66           HN       ASP  66  -4.860  -6.670   1.315
  530    HA   ASP  66           HA       ASP  66  -7.180  -8.065   2.301
  531    HB2  ASP  66           2HB      ASP  66  -4.336  -7.990   3.318
  532    HB3  ASP  66           1HB      ASP  66  -5.590  -9.060   3.928
  533    H    ALA  67           HN       ALA  67  -5.758  -5.096   2.914
  534    HA   ALA  67           HA       ALA  67  -6.496  -5.010   5.722
  535    HB1  ALA  67           1HB      ALA  67  -5.327  -2.953   5.820
  536    HB2  ALA  67           2HB      ALA  67  -5.283  -2.828   4.062
  537    HB3  ALA  67           3HB      ALA  67  -4.352  -4.083   4.882
  538    H    SER  68           HN       SER  68  -7.237  -2.490   6.178
  539    HA   SER  68           HA       SER  68  -9.977  -2.491   5.442
  540    HB2  SER  68           2HB      SER  68  -8.370  -0.323   6.813
  541    HB3  SER  68           1HB      SER  68 -10.126  -0.468   6.798
  542    HG   SER  68           HG       SER  68 -10.008  -2.264   8.052
  543    H    SER  69           HN       SER  69  -7.262  -1.451   3.799
  544    HA   SER  69           HA       SER  69  -7.908   0.933   2.566
  545    HB2  SER  69           2HB      SER  69  -6.737  -1.366   1.019
  546    HB3  SER  69           1HB      SER  69  -6.333   0.348   0.925
  547    HG   SER  69           HG       SER  69  -5.053  -1.433   2.261
  548    H    ALA  70           HN       ALA  70  -9.074  -2.305   1.980
  549    HA   ALA  70           HA       ALA  70 -10.305  -2.073  -0.453
  550    HB1  ALA  70           1HB      ALA  70 -11.678  -3.946   0.231
  551    HB2  ALA  70           2HB      ALA  70 -11.228  -3.669   1.914
  552    HB3  ALA  70           3HB      ALA  70 -10.005  -4.162   0.742
  553    H    LYS  71           HN       LYS  71 -11.544  -1.197   2.739
  554    HA   LYS  71           HA       LYS  71 -14.043  -0.302   1.500
  555    HB2  LYS  71           2HB      LYS  71 -13.427  -0.510   4.448
  556    HB3  LYS  71           1HB      LYS  71 -15.005  -0.307   3.704
  557    HG2  LYS  71           2HG      LYS  71 -13.244  -2.754   3.580
  558    HG3  LYS  71           1HG      LYS  71 -14.761  -2.580   4.460
  559    HD2  LYS  71           2HD      LYS  71 -14.480  -2.414   1.455
  560    HD3  LYS  71           1HD      LYS  71 -14.992  -3.851   2.338
  561    HE2  LYS  71           2HE      LYS  71 -16.920  -2.625   3.208
  562    HE3  LYS  71           1HE      LYS  71 -16.407  -1.184   2.332
  563    HZ1  LYS  71           3HZ      LYS  71 -18.146  -2.412   1.165
  564    HZ2  LYS  71           1HZ      LYS  71 -17.152  -3.773   1.080
  565    HZ3  LYS  71           2HZ      LYS  71 -16.722  -2.361   0.256
  566    H    ALA  72           HN       ALA  72 -11.241   1.021   1.711
  567    HA   ALA  72           HA       ALA  72 -12.268   3.648   2.569
  568    HB1  ALA  72           1HB      ALA  72 -10.023   4.241   3.299
  569    HB2  ALA  72           2HB      ALA  72  -9.429   2.654   2.814
  570    HB3  ALA  72           3HB      ALA  72 -10.583   2.795   4.141
  571    H    ARG  73           HN       ARG  73 -11.594   1.891  -0.010
  572    HA   ARG  73           HA       ARG  73 -11.318   2.319  -2.209
  573    HB2  ARG  73           2HB      ARG  73 -12.589   4.453  -1.644
  574    HB3  ARG  73           1HB      ARG  73 -11.029   5.256  -1.569
  575    HG2  ARG  73           2HG      ARG  73 -11.894   5.686  -3.718
  576    HG3  ARG  73           1HG      ARG  73 -10.642   4.461  -3.932
  577    HD2  ARG  73           2HD      ARG  73 -12.438   2.724  -3.876
  578    HD3  ARG  73           1HD      ARG  73 -13.625   4.025  -3.857
  579    HE   ARG  73           HE       ARG  73 -12.132   3.062  -6.100
  580   HH11  ARG  73          1HH1      ARG  73 -13.799   5.864  -4.798
  581   HH12  ARG  73          2HH1      ARG  73 -14.115   6.558  -6.344
  582   HH21  ARG  73          1HH2      ARG  73 -12.561   3.966  -8.153
  583   HH22  ARG  73          2HH2      ARG  73 -13.395   5.475  -8.279
  584    H    GLY  74           HN       GLY  74  -9.033   2.893   0.089
  585    HA2  GLY  74           2HA      GLY  74  -6.746   2.369  -0.212
  586    HA3  GLY  74           1HA      GLY  74  -6.904   2.783  -1.912
  587    H    ASP  75           HN       ASP  75  -8.367   5.295  -1.006
  588    HA   ASP  75           HA       ASP  75  -6.038   6.973  -1.008
  589    HB2  ASP  75           2HB      ASP  75  -7.989   7.702  -2.238
  590    HB3  ASP  75           1HB      ASP  75  -8.985   7.628  -0.791
  591    H    LEU  76           HN       LEU  76  -4.958   7.730   0.679
  592    HA   LEU  76           HA       LEU  76  -6.035   7.378   3.363
  593    HB2  LEU  76           2HB      LEU  76  -3.346   8.197   2.294
  594    HB3  LEU  76           1HB      LEU  76  -3.742   8.347   3.991
  595    HG   LEU  76           HG       LEU  76  -3.814   5.737   2.483
  596   HD11  LEU  76          1HD1      LEU  76  -1.662   6.896   4.251
  597   HD12  LEU  76          2HD1      LEU  76  -1.544   6.618   2.513
  598   HD13  LEU  76          3HD1      LEU  76  -1.693   5.251   3.619
  599   HD21  LEU  76          3HD2      LEU  76  -3.826   4.769   4.730
  600   HD22  LEU  76          1HD2      LEU  76  -5.224   5.813   4.477
  601   HD23  LEU  76          2HD2      LEU  76  -3.858   6.389   5.430
  602    H    GLY  77           HN       GLY  77  -5.349   9.858   1.056
  603    HA2  GLY  77           2HA      GLY  77  -6.381  11.981   1.104
  604    HA3  GLY  77           1HA      GLY  77  -6.558  11.826   2.850
  605    H    ALA  78           HN       ALA  78  -5.634  14.120   2.372
  606    HA   ALA  78           HA       ALA  78  -2.776  14.156   2.000
  607    HB1  ALA  78           1HB      ALA  78  -2.975  16.566   2.231
  608    HB2  ALA  78           2HB      ALA  78  -4.647  16.396   2.763
  609    HB3  ALA  78           3HB      ALA  78  -4.198  15.958   1.114
  610    H    PHE  79           HN       PHE  79  -1.560  13.437   3.602
  611    HA   PHE  79           HA       PHE  79  -2.244  14.259   6.343
  612    HB2  PHE  79           2HB      PHE  79  -0.981  12.218   7.091
  613    HB3  PHE  79           1HB      PHE  79  -2.466  11.876   6.217
  614    HD1  PHE  79           1HD      PHE  79   1.195  11.738   6.103
  615    HD2  PHE  79           2HD      PHE  79  -2.417  10.823   4.048
  616    HE1  PHE  79           1HE      PHE  79   2.443  10.280   4.564
  617    HE2  PHE  79           2HE      PHE  79  -1.176   9.364   2.506
  618    HZ   PHE  79           HZ       PHE  79   1.257   9.090   2.763
  619    H    SER  80           HN       SER  80  -0.449  14.638   7.779
  620    HA   SER  80           HA       SER  80   1.825  15.800   6.344
  621    HB2  SER  80           2HB      SER  80   0.399  17.318   7.737
  622    HB3  SER  80           1HB      SER  80   0.848  16.376   9.157
  623    HG   SER  80           HG       SER  80   2.795  17.537   7.464
  624    H    ARG  81           HN       ARG  81   3.946  15.610   7.375
  625    HA   ARG  81           HA       ARG  81   4.626  12.964   8.010
  626    HB2  ARG  81           2HB      ARG  81   6.208  15.478   8.583
  627    HB3  ARG  81           1HB      ARG  81   6.849  13.843   8.566
  628    HG2  ARG  81           2HG      ARG  81   6.349  13.660   6.193
  629    HG3  ARG  81           1HG      ARG  81   5.671  15.288   6.207
  630    HD2  ARG  81           2HD      ARG  81   8.527  14.531   6.804
  631    HD3  ARG  81           1HD      ARG  81   7.939  15.314   5.341
  632    HE   ARG  81           HE       ARG  81   7.945  16.535   8.025
  633   HH11  ARG  81          1HH1      ARG  81   8.014  16.835   4.533
  634   HH12  ARG  81          2HH1      ARG  81   8.285  18.539   4.558
  635   HH21  ARG  81          1HH2      ARG  81   8.313  18.804   8.047
  636   HH22  ARG  81          2HH2      ARG  81   8.464  19.656   6.548
  637    H    GLY  82           HN       GLY  82   4.198  11.884   9.787
  638    HA2  GLY  82           2HA      GLY  82   4.810  11.705  12.172
  639    HA3  GLY  82           1HA      GLY  82   4.218  13.352  12.352
  640    H    GLN  83           HN       GLN  83   2.596  11.058  10.303
  641    HA   GLN  83           HA       GLN  83   0.484  10.759  12.346
  642    HB2  GLN  83           2HB      GLN  83   0.056  11.231   9.389
  643    HB3  GLN  83           1HB      GLN  83  -1.208  10.915  10.568
  644    HG2  GLN  83           2HG      GLN  83  -0.595  12.996  11.738
  645    HG3  GLN  83           1HG      GLN  83   0.606  13.316  10.489
  646   HE21  GLN  83          1HE2      GLN  83  -2.525  11.893   9.865
  647   HE22  GLN  83          2HE2      GLN  83  -3.176  13.238   9.001
  648    H    MET  84           HN       MET  84   2.362   9.376   9.786
  649    HA   MET  84           HA       MET  84   0.995   6.793  10.186
  650    HB2  MET  84           2HB      MET  84   0.775   7.756   7.902
  651    HB3  MET  84           1HB      MET  84   2.524   7.776   7.764
  652    HG2  MET  84           2HG      MET  84   1.589   5.899   6.570
  653    HG3  MET  84           1HG      MET  84   2.569   5.346   7.925
  654    HE1  MET  84           3HE      MET  84  -2.047   5.340   7.868
  655    HE2  MET  84           1HE      MET  84  -1.040   5.876   6.524
  656    HE3  MET  84           2HE      MET  84  -1.102   6.820   8.012
  657    H    GLN  85           HN       GLN  85   2.469   4.887   9.911
  658    HA   GLN  85           HA       GLN  85   4.678   4.936  11.607
  659    HB2  GLN  85           2HB      GLN  85   4.104   3.025   9.330
  660    HB3  GLN  85           1HB      GLN  85   5.267   2.740  10.616
  661    HG2  GLN  85           2HG      GLN  85   2.301   3.083  10.993
  662    HG3  GLN  85           1HG      GLN  85   3.160   1.544  10.970
  663   HE21  GLN  85          1HE2      GLN  85   1.562   2.816  13.069
  664   HE22  GLN  85          2HE2      GLN  85   2.597   2.910  14.449
  665    H    LYS  86           HN       LYS  86   6.849   5.241  11.316
  666    HA   LYS  86           HA       LYS  86   7.689   7.079   9.466
  667    HB2  LYS  86           2HB      LYS  86   8.889   6.633  11.543
  668    HB3  LYS  86           1HB      LYS  86   9.439   5.090  10.907
  669    HG2  LYS  86           2HG      LYS  86  11.180   6.806  10.788
  670    HG3  LYS  86           1HG      LYS  86  10.724   6.226   9.186
  671    HD2  LYS  86           2HD      LYS  86   9.320   8.199   8.859
  672    HD3  LYS  86           1HD      LYS  86   9.728   8.770  10.477
  673    HE2  LYS  86           2HE      LYS  86  11.728   8.312   8.264
  674    HE3  LYS  86           1HE      LYS  86  11.017   9.875   8.654
  675    HZ1  LYS  86           3HZ      LYS  86  13.204   9.570   9.659
  676    HZ2  LYS  86           1HZ      LYS  86  12.641   8.232  10.525
  677    HZ3  LYS  86           2HZ      LYS  86  12.013   9.773  10.833
  678    HA   PRO  87           HA       PRO  87   9.796   3.484   6.767
  679    HB2  PRO  87           2HB      PRO  87   8.074   1.282   6.688
  680    HB3  PRO  87           1HB      PRO  87   9.608   1.353   7.560
  681    HG2  PRO  87           2HG      PRO  87   6.830   1.781   8.572
  682    HG3  PRO  87           1HG      PRO  87   8.192   0.950   9.347
  683    HD2  PRO  87           2HD      PRO  87   7.493   3.400  10.106
  684    HD3  PRO  87           1HD      PRO  87   9.208   2.953   9.977
  685    H    PHE  88           HN       PHE  88   6.332   3.881   7.204
  686    HA   PHE  88           HA       PHE  88   5.809   3.737   4.348
  687    HB2  PHE  88           2HB      PHE  88   4.259   2.772   6.094
  688    HB3  PHE  88           1HB      PHE  88   3.909   4.416   6.606
  689    HD1  PHE  88           2HD      PHE  88   2.828   5.988   4.930
  690    HD2  PHE  88           1HD      PHE  88   3.117   1.787   4.319
  691    HE1  PHE  88           2HE      PHE  88   1.029   6.110   3.263
  692    HE2  PHE  88           1HE      PHE  88   1.314   1.908   2.649
  693    HZ   PHE  88           HZ       PHE  88   0.274   4.070   2.122
  694    H    GLU  89           HN       GLU  89   5.759   6.059   6.989
  695    HA   GLU  89           HA       GLU  89   4.759   8.330   5.739
  696    HB2  GLU  89           2HB      GLU  89   5.372   7.884   8.212
  697    HB3  GLU  89           1HB      GLU  89   6.990   8.395   7.764
  698    HG2  GLU  89           2HG      GLU  89   6.060  10.324   8.608
  699    HG3  GLU  89           1HG      GLU  89   5.814  10.515   6.871
  700    H    ASP  90           HN       ASP  90   8.153   7.414   6.242
  701    HA   ASP  90           HA       ASP  90   9.306   9.546   4.839
  702    HB2  ASP  90           2HB      ASP  90  10.608   8.234   6.392
  703    HB3  ASP  90           1HB      ASP  90  10.376   6.782   5.427
  704    H    ALA  91           HN       ALA  91   8.208   6.400   3.743
  705    HA   ALA  91           HA       ALA  91   9.387   6.584   1.160
  706    HB1  ALA  91           1HB      ALA  91   8.013   4.648   0.603
  707    HB2  ALA  91           2HB      ALA  91   7.095   4.861   2.093
  708    HB3  ALA  91           3HB      ALA  91   8.803   4.433   2.165
  709    H    SER  92           HN       SER  92   6.204   7.374   2.469
  710    HA   SER  92           HA       SER  92   4.893   7.862   0.033
  711    HB2  SER  92           2HB      SER  92   4.378   9.130   2.732
  712    HB3  SER  92           1HB      SER  92   3.251   9.088   1.375
  713    HG   SER  92           HG       SER  92   4.204   6.931   2.942
  714    H    PHE  93           HN       PHE  93   6.579  10.085   2.231
  715    HA   PHE  93           HA       PHE  93   6.117  12.351   0.544
  716    HB2  PHE  93           2HB      PHE  93   7.896  11.956   2.950
  717    HB3  PHE  93           1HB      PHE  93   7.739  13.490   2.104
  718    HD1  PHE  93           2HD      PHE  93   6.019  11.039   4.225
  719    HD2  PHE  93           1HD      PHE  93   5.768  14.830   2.323
  720    HE1  PHE  93           2HE      PHE  93   4.041  11.582   5.581
  721    HE2  PHE  93           1HE      PHE  93   3.789  15.383   3.678
  722    HZ   PHE  93           HZ       PHE  93   2.922  13.758   5.310
  723    H    ALA  94           HN       ALA  94   8.169   9.783   0.205
  724    HA   ALA  94           HA       ALA  94  10.364  11.303  -0.979
  725    HB1  ALA  94           1HB      ALA  94  11.494   9.168  -1.186
  726    HB2  ALA  94           2HB      ALA  94  10.028   8.321  -0.694
  727    HB3  ALA  94           3HB      ALA  94  10.871   9.360   0.452
  728    H    LEU  95           HN       LEU  95   7.426  10.033  -1.915
  729    HA   LEU  95           HA       LEU  95   8.263   9.231  -4.572
  730    HB2  LEU  95           2HB      LEU  95   5.527   9.375  -3.319
  731    HB3  LEU  95           1HB      LEU  95   5.867   8.750  -4.920
  732    HG   LEU  95           HG       LEU  95   6.852   7.567  -2.326
  733   HD11  LEU  95          1HD1      LEU  95   4.747   6.633  -4.266
  734   HD12  LEU  95          2HD1      LEU  95   4.467   7.261  -2.640
  735   HD13  LEU  95          3HD1      LEU  95   5.326   5.735  -2.862
  736   HD21  LEU  95          3HD2      LEU  95   7.614   5.704  -3.734
  737   HD22  LEU  95          1HD2      LEU  95   8.444   7.208  -4.130
  738   HD23  LEU  95          2HD2      LEU  95   7.154   6.613  -5.172
  739    H    ARG  96           HN       ARG  96   7.759  10.237  -6.435
  740    HA   ARG  96           HA       ARG  96   7.349  13.076  -6.384
  741    HB2  ARG  96           2HB      ARG  96   8.776  11.934  -8.070
  742    HB3  ARG  96           1HB      ARG  96   7.363  11.112  -8.701
  743    HG2  ARG  96           2HG      ARG  96   6.422  13.352  -9.284
  744    HG3  ARG  96           1HG      ARG  96   7.975  14.051  -8.816
  745    HD2  ARG  96           2HD      ARG  96   9.087  12.616 -10.487
  746    HD3  ARG  96           1HD      ARG  96   7.509  12.008 -10.982
  747    HE   ARG  96           HE       ARG  96   7.593  14.838 -11.100
  748   HH11  ARG  96          1HH1      ARG  96   8.620  11.970 -12.843
  749   HH12  ARG  96          2HH1      ARG  96   8.714  12.780 -14.367
  750   HH21  ARG  96          1HH2      ARG  96   7.716  15.907 -13.098
  751   HH22  ARG  96          2HH2      ARG  96   8.201  15.045 -14.516
  752    H    THR  97           HN       THR  97   5.513  14.149  -7.554
  753    HA   THR  97           HA       THR  97   3.008  13.187  -6.752
  754    HB   THR  97           HB       THR  97   3.576  15.159  -8.984
  755    HG1  THR  97           1HG      THR  97   2.831  16.097  -6.485
  756   HG21  THR  97          3HG2      THR  97   1.254  14.361  -8.942
  757   HG22  THR  97          1HG2      THR  97   1.348  16.048  -8.435
  758   HG23  THR  97          2HG2      THR  97   1.138  14.776  -7.233
  759    H    GLY  98           HN       GLY  98   2.001  11.420  -7.491
  760    HA2  GLY  98           2HA      GLY  98   0.867  10.168  -9.112
  761    HA3  GLY  98           1HA      GLY  98   1.784  10.996 -10.363
  762    H    GLU  99           HN       GLU  99   3.714   9.911  -7.824
  763    HA   GLU  99           HA       GLU  99   4.686   7.708  -9.492
  764    HB2  GLU  99           2HB      GLU  99   6.299   9.463  -9.001
  765    HB3  GLU  99           1HB      GLU  99   6.031   9.265  -7.279
  766    HG2  GLU  99           2HG      GLU  99   6.994   7.037  -7.377
  767    HG3  GLU  99           1HG      GLU  99   7.216   7.204  -9.119
  768    H    MET 100           HN       MET 100   5.167   5.702  -8.584
  769    HA   MET 100           HA       MET 100   3.789   5.130  -6.046
  770    HB2  MET 100           2HB      MET 100   2.631   4.210  -8.024
  771    HB3  MET 100           1HB      MET 100   4.099   3.362  -8.480
  772    HG2  MET 100           2HG      MET 100   3.964   2.059  -6.398
  773    HG3  MET 100           1HG      MET 100   2.455   2.881  -6.007
  774    HE1  MET 100           3HE      MET 100   3.673   1.687  -9.581
  775    HE2  MET 100           1HE      MET 100   3.009   0.055  -9.610
  776    HE3  MET 100           2HE      MET 100   4.288   0.465  -8.466
  777    H    SER 101           HN       SER 101   4.756   3.601  -4.664
  778    HA   SER 101           HA       SER 101   7.640   3.367  -4.969
  779    HB2  SER 101           2HB      SER 101   7.581   2.589  -2.632
  780    HB3  SER 101           1HB      SER 101   6.698   4.105  -2.806
  781    HG   SER 101           HG       SER 101   5.753   1.526  -2.293
  782    H    GLY 102           HN       GLY 102   8.309   1.100  -3.762
  783    HA2  GLY 102           2HA      GLY 102   7.094  -1.000  -5.416
  784    HA3  GLY 102           1HA      GLY 102   8.707  -1.055  -4.703
  785    HA   PRO 103           HA       PRO 103   6.107  -3.454  -1.807
  786    HB2  PRO 103           2HB      PRO 103   8.484  -5.064  -1.357
  787    HB3  PRO 103           1HB      PRO 103   6.936  -5.556  -2.047
  788    HG2  PRO 103           2HG      PRO 103   9.245  -5.403  -3.494
  789    HG3  PRO 103           1HG      PRO 103   7.634  -5.182  -4.199
  790    HD2  PRO 103           2HD      PRO 103   9.654  -3.126  -3.396
  791    HD3  PRO 103           1HD      PRO 103   8.595  -3.171  -4.823
  792    H    VAL 104           HN       VAL 104   6.130  -1.706  -0.318
  793    HA   VAL 104           HA       VAL 104   8.488  -1.258   1.288
  794    HB   VAL 104           HB       VAL 104   5.694  -0.133   1.622
  795   HG11  VAL 104          1HG1      VAL 104   8.312   0.736   2.849
  796   HG12  VAL 104          2HG1      VAL 104   6.979  -0.049   3.694
  797   HG13  VAL 104          3HG1      VAL 104   6.767   1.568   3.025
  798   HG21  VAL 104          3HG2      VAL 104   6.597   1.900   0.585
  799   HG22  VAL 104          1HG2      VAL 104   6.671   0.521  -0.512
  800   HG23  VAL 104          2HG2      VAL 104   8.131   1.072   0.312
  801    H    PHE 105           HN       PHE 105   8.986  -2.772   2.693
  802    HA   PHE 105           HA       PHE 105   6.983  -4.433   3.924
  803    HB2  PHE 105           2HB      PHE 105   9.963  -4.301   4.426
  804    HB3  PHE 105           1HB      PHE 105   8.878  -5.582   4.954
  805    HD1  PHE 105           2HD      PHE 105   7.549  -6.776   3.045
  806    HD2  PHE 105           1HD      PHE 105  11.124  -4.550   2.459
  807    HE1  PHE 105           2HE      PHE 105   7.938  -7.966   0.928
  808    HE2  PHE 105           1HE      PHE 105  11.519  -5.732   0.340
  809    HZ   PHE 105           HZ       PHE 105   9.927  -7.443  -0.427
  810    H    THR 106           HN       THR 106   6.444  -4.474   6.104
  811    HA   THR 106           HA       THR 106   7.565  -2.405   7.811
  812    HB   THR 106           HB       THR 106   4.571  -2.575   7.391
  813    HG1  THR 106           1HG      THR 106   6.530  -1.265   6.007
  814   HG21  THR 106          3HG2      THR 106   4.549  -0.494   8.693
  815   HG22  THR 106          1HG2      THR 106   6.300  -0.592   8.883
  816   HG23  THR 106          2HG2      THR 106   5.262  -1.813   9.620
  817    H    ASP 107           HN       ASP 107   4.877  -4.799   7.744
  818    HA   ASP 107           HA       ASP 107   6.094  -6.173   9.948
  819    HB2  ASP 107           2HB      ASP 107   4.040  -6.029  11.428
  820    HB3  ASP 107           1HB      ASP 107   4.998  -4.561  11.311
  821    H    SER 108           HN       SER 108   2.677  -6.513   9.769
  822    HA   SER 108           HA       SER 108   3.045  -9.247   8.900
  823    HB2  SER 108           2HB      SER 108   0.576  -7.754   9.778
  824    HB3  SER 108           1HB      SER 108   0.673  -9.492   9.489
  825    HG   SER 108           HG       SER 108   2.591  -9.166  11.099
  826    H    GLY 109           HN       GLY 109   2.688  -6.441   7.262
  827    HA2  GLY 109           2HA      GLY 109   1.639  -7.881   4.960
  828    HA3  GLY 109           1HA      GLY 109   0.782  -6.433   5.461
  829    H    ILE 110           HN       ILE 110   2.041  -6.881   2.966
  830    HA   ILE 110           HA       ILE 110   4.376  -5.119   3.007
  831    HB   ILE 110           HB       ILE 110   3.109  -6.553   0.652
  832   HG12  ILE 110          2HG1      ILE 110   5.534  -7.337   2.292
  833   HG13  ILE 110          1HG1      ILE 110   3.965  -8.128   2.365
  834   HG21  ILE 110          1HG2      ILE 110   5.794  -5.202   0.954
  835   HG22  ILE 110          2HG2      ILE 110   4.428  -4.605   0.011
  836   HG23  ILE 110          3HG2      ILE 110   5.248  -6.091  -0.468
  837   HD11  ILE 110          3HD1      ILE 110   5.548  -9.397   1.026
  838   HD12  ILE 110          1HD1      ILE 110   5.769  -8.012  -0.042
  839   HD13  ILE 110          2HD1      ILE 110   4.205  -8.821   0.039
  840    H    HIS 111           HN       HIS 111   4.295  -3.053   2.245
  841    HA   HIS 111           HA       HIS 111   1.600  -2.061   1.599
  842    HB2  HIS 111           2HB      HIS 111   3.933  -0.551   2.792
  843    HB3  HIS 111           1HB      HIS 111   2.326   0.092   2.501
  844    HD1  HIS 111           1HD      HIS 111   0.818   0.043   4.475
  845    HD2  HIS 111           2HD      HIS 111   3.856  -2.772   4.784
  846    HE1  HIS 111           1HE      HIS 111   0.576  -0.963   6.759
  847    HE2  HIS 111           2HE      HIS 111   2.260  -2.824   6.812
  848    H    ILE 112           HN       ILE 112   1.257  -0.980  -0.243
  849    HA   ILE 112           HA       ILE 112   3.605  -0.056  -1.770
  850    HB   ILE 112           HB       ILE 112   0.926  -0.781  -2.971
  851   HG12  ILE 112          2HG1      ILE 112   3.471  -2.420  -2.846
  852   HG13  ILE 112          1HG1      ILE 112   1.913  -2.839  -2.142
  853   HG21  ILE 112          1HG2      ILE 112   2.190   0.858  -4.239
  854   HG22  ILE 112          2HG2      ILE 112   2.138  -0.677  -5.105
  855   HG23  ILE 112          3HG2      ILE 112   3.600  -0.203  -4.240
  856   HD11  ILE 112          3HD1      ILE 112   2.117  -4.147  -4.088
  857   HD12  ILE 112          1HD1      ILE 112   2.686  -2.774  -5.040
  858   HD13  ILE 112          2HD1      ILE 112   1.013  -2.841  -4.510
  859    H    ILE 113           HN       ILE 113   3.603   2.065  -2.310
  860    HA   ILE 113           HA       ILE 113   1.272   3.621  -1.414
  861    HB   ILE 113           HB       ILE 113   4.131   4.547  -1.502
  862   HG12  ILE 113          2HG1      ILE 113   2.598   3.582   0.919
  863   HG13  ILE 113          1HG1      ILE 113   3.826   2.643   0.076
  864   HG21  ILE 113          1HG2      ILE 113   1.678   5.664  -0.132
  865   HG22  ILE 113          2HG2      ILE 113   2.469   6.332  -1.560
  866   HG23  ILE 113          3HG2      ILE 113   3.307   6.330  -0.007
  867   HD11  ILE 113          3HD1      ILE 113   4.719   3.677   2.078
  868   HD12  ILE 113          1HD1      ILE 113   4.261   5.270   1.474
  869   HD13  ILE 113          2HD1      ILE 113   5.494   4.328   0.634
  870    H    LEU 114           HN       LEU 114   0.424   5.056  -2.805
  871    HA   LEU 114           HA       LEU 114   1.969   5.772  -5.195
  872    HB2  LEU 114           2HB      LEU 114   0.149   4.041  -5.641
  873    HB3  LEU 114           1HB      LEU 114  -1.014   5.272  -5.206
  874    HG   LEU 114           HG       LEU 114   0.949   5.715  -7.451
  875   HD11  LEU 114          1HD1      LEU 114  -1.767   4.424  -7.636
  876   HD12  LEU 114          2HD1      LEU 114  -0.217   3.639  -7.940
  877   HD13  LEU 114          3HD1      LEU 114  -0.773   4.934  -9.000
  878   HD21  LEU 114          3HD2      LEU 114  -0.778   7.256  -8.248
  879   HD22  LEU 114          1HD2      LEU 114  -0.259   7.674  -6.615
  880   HD23  LEU 114          2HD2      LEU 114  -1.794   6.840  -6.868
  881    H    ARG 115           HN       ARG 115   2.332   7.873  -5.127
  882    HA   ARG 115           HA       ARG 115   0.847   9.557  -3.348
  883    HB2  ARG 115           2HB      ARG 115   3.230   9.913  -3.613
  884    HB3  ARG 115           1HB      ARG 115   3.024  10.226  -5.331
  885    HG2  ARG 115           2HG      ARG 115   1.742  12.229  -4.833
  886    HG3  ARG 115           1HG      ARG 115   1.882  11.904  -3.106
  887    HD2  ARG 115           2HD      ARG 115   4.285  12.163  -3.222
  888    HD3  ARG 115           1HD      ARG 115   4.200  12.379  -4.972
  889    HE   ARG 115           HE       ARG 115   2.555  14.309  -3.824
  890   HH11  ARG 115          1HH1      ARG 115   5.986  13.507  -3.868
  891   HH12  ARG 115          2HH1      ARG 115   6.490  15.147  -3.635
  892   HH21  ARG 115          1HH2      ARG 115   3.229  16.448  -3.495
  893   HH22  ARG 115          2HH2      ARG 115   4.921  16.825  -3.420
  894    H    THR 116           HN       THR 116  -0.936  10.591  -3.771
  895    HA   THR 116           HA       THR 116  -1.876  10.827  -6.498
  896    HB   THR 116           HB       THR 116  -3.276  11.684  -3.955
  897    HG1  THR 116           1HG      THR 116  -4.335   9.458  -4.703
  898   HG21  THR 116          3HG2      THR 116  -5.303  11.417  -5.296
  899   HG22  THR 116          1HG2      THR 116  -4.335  10.920  -6.685
  900   HG23  THR 116          2HG2      THR 116  -4.206  12.565  -6.063
  901    H    GLU 117           HN       GLU 117  -1.438  12.975  -3.672
  902    HA   GLU 117           HA       GLU 117  -0.799  15.164  -5.508
  903    HB2  GLU 117           2HB      GLU 117  -2.704  15.417  -3.165
  904    HB3  GLU 117           1HB      GLU 117  -2.156  16.732  -4.188
  905    HG2  GLU 117           2HG      GLU 117  -3.243  15.631  -6.118
  906    HG3  GLU 117           1HG      GLU 117  -3.867  14.402  -5.020
  Start of MODEL    8
    1    H1   GLY   1           1HT      GLY   1  18.436  17.415  -0.338
    2    H2   GLY   1           2HT      GLY   1  19.396  18.721   0.122
    3    H3   GLY   1           3HT      GLY   1  20.066  17.462  -0.784
    4    HA2  GLY   1           1HA      GLY   1  19.681  19.365  -2.182
    5    HA3  GLY   1           2HA      GLY   1  18.646  18.022  -2.652
    6    H    SER   2           HN       SER   2  17.631  20.144  -3.601
    7    HA   SER   2           HA       SER   2  16.068  21.632  -1.701
    8    HB2  SER   2           2HB      SER   2  17.006  22.604  -3.846
    9    HB3  SER   2           1HB      SER   2  15.809  21.649  -4.719
   10    HG   SER   2           HG       SER   2  15.505  23.935  -3.191
   11    H    HIS   3           HN       HIS   3  14.637  20.336  -0.701
   12    HA   HIS   3           HA       HIS   3  12.512  19.199  -2.363
   13    HB2  HIS   3           2HB      HIS   3  14.084  17.374  -1.715
   14    HB3  HIS   3           1HB      HIS   3  13.783  17.751  -0.026
   15    HD1  HIS   3           1HD      HIS   3  12.198  16.162  -3.029
   16    HD2  HIS   3           2HD      HIS   3  11.361  16.789   0.989
   17    HE1  HIS   3           1HE      HIS   3  10.243  14.683  -2.515
   18    HE2  HIS   3           2HE      HIS   3   9.969  14.866  -0.026
   19    H    MET   4           HN       MET   4  10.589  19.863  -1.685
   20    HA   MET   4           HA       MET   4  10.417  21.352   0.796
   21    HB2  MET   4           2HB      MET   4   8.389  20.855  -1.384
   22    HB3  MET   4           1HB      MET   4   8.092  21.850   0.032
   23    HG2  MET   4           2HG      MET   4  10.131  22.350  -2.121
   24    HG3  MET   4           1HG      MET   4   8.627  23.231  -1.869
   25    HE1  MET   4           3HE      MET   4   9.334  25.021   1.564
   26    HE2  MET   4           1HE      MET   4   8.620  23.420   1.375
   27    HE3  MET   4           2HE      MET   4   8.152  24.727   0.288
   28    H    GLU   5           HN       GLU   5   9.257  20.804   2.577
   29    HA   GLU   5           HA       GLU   5   8.354  18.019   2.723
   30    HB2  GLU   5           2HB      GLU   5   8.888  20.006   4.937
   31    HB3  GLU   5           1HB      GLU   5   8.486  18.310   5.148
   32    HG2  GLU   5           2HG      GLU   5  10.950  19.312   3.754
   33    HG3  GLU   5           1HG      GLU   5  10.886  18.834   5.448
   34    HA   PRO   6           HA       PRO   6   4.259  19.997   2.673
   35    HB2  PRO   6           2HB      PRO   6   3.294  17.291   2.113
   36    HB3  PRO   6           1HB      PRO   6   3.165  18.741   1.114
   37    HG2  PRO   6           2HG      PRO   6   4.764  16.651   0.456
   38    HG3  PRO   6           1HG      PRO   6   5.148  18.326   0.023
   39    HD2  PRO   6           2HD      PRO   6   6.227  16.650   2.256
   40    HD3  PRO   6           1HD      PRO   6   7.078  17.775   1.175
   41    H    ALA   7           HN       ALA   7   2.940  20.180   4.402
   42    HA   ALA   7           HA       ALA   7   3.395  18.747   6.786
   43    HB1  ALA   7           1HB      ALA   7   1.386  19.890   7.626
   44    HB2  ALA   7           2HB      ALA   7   0.998  20.404   5.985
   45    HB3  ALA   7           3HB      ALA   7   2.456  21.003   6.776
   46    H    ARG   8           HN       ARG   8   0.908  18.517   4.311
   47    HA   ARG   8           HA       ARG   8   0.321  15.797   5.233
   48    HB2  ARG   8           2HB      ARG   8  -1.691  17.804   4.187
   49    HB3  ARG   8           1HB      ARG   8  -2.032  16.121   4.549
   50    HG2  ARG   8           2HG      ARG   8  -1.469  16.543   6.909
   51    HG3  ARG   8           1HG      ARG   8  -1.221  18.246   6.517
   52    HD2  ARG   8           2HD      ARG   8  -3.568  18.317   5.676
   53    HD3  ARG   8           1HD      ARG   8  -3.779  16.672   6.270
   54    HE   ARG   8           HE       ARG   8  -2.857  18.596   8.226
   55   HH11  ARG   8          1HH1      ARG   8  -5.616  16.965   6.800
   56   HH12  ARG   8          2HH1      ARG   8  -6.664  17.273   8.136
   57   HH21  ARG   8          1HH2      ARG   8  -4.256  19.028   9.996
   58   HH22  ARG   8          2HH2      ARG   8  -5.890  18.463   9.958
   59    H    VAL   9           HN       VAL   9   0.341  14.310   3.665
   60    HA   VAL   9           HA       VAL   9   0.504  15.264   0.891
   61    HB   VAL   9           HB       VAL   9   2.730  14.532   1.664
   62   HG11  VAL   9          1HG1      VAL   9   1.429  11.865   2.179
   63   HG12  VAL   9          2HG1      VAL   9   2.073  12.970   3.393
   64   HG13  VAL   9          3HG1      VAL   9   3.161  12.193   2.242
   65   HG21  VAL   9          3HG2      VAL   9   2.171  14.194  -0.679
   66   HG22  VAL   9          1HG2      VAL   9   1.484  12.613  -0.306
   67   HG23  VAL   9          2HG2      VAL   9   3.213  12.895  -0.104
   68    H    ARG  10           HN       ARG  10  -0.595  14.043  -0.650
   69    HA   ARG  10           HA       ARG  10  -2.438  12.086   0.514
   70    HB2  ARG  10           2HB      ARG  10  -3.457  14.009  -0.646
   71    HB3  ARG  10           1HB      ARG  10  -2.628  13.528  -2.122
   72    HG2  ARG  10           2HG      ARG  10  -3.833  11.420  -2.135
   73    HG3  ARG  10           1HG      ARG  10  -4.651  11.873  -0.640
   74    HD2  ARG  10           2HD      ARG  10  -5.527  13.878  -1.859
   75    HD3  ARG  10           1HD      ARG  10  -4.890  13.164  -3.341
   76    HE   ARG  10           HE       ARG  10  -6.427  11.209  -2.145
   77   HH11  ARG  10          1HH1      ARG  10  -6.893  14.417  -3.491
   78   HH12  ARG  10          2HH1      ARG  10  -8.570  14.160  -3.852
   79   HH21  ARG  10          1HH2      ARG  10  -8.627  10.865  -2.596
   80   HH22  ARG  10          2HH2      ARG  10  -9.566  12.118  -3.355
   81    H    CYS  11           HN       CYS  11  -2.003  10.055   0.203
   82    HA   CYS  11           HA       CYS  11  -0.911   9.208  -2.372
   83    HB2  CYS  11           2HB      CYS  11   0.116   8.241   0.308
   84    HB3  CYS  11           1HB      CYS  11   0.624   7.650  -1.267
   85    HG   CYS  11           HG       CYS  11   2.468   9.429   0.169
   86    H    SER  12           HN       SER  12  -1.420   7.043  -2.905
   87    HA   SER  12           HA       SER  12  -3.754   6.017  -1.484
   88    HB2  SER  12           2HB      SER  12  -2.527   5.125  -4.108
   89    HB3  SER  12           1HB      SER  12  -4.089   4.623  -3.460
   90    HG   SER  12           HG       SER  12  -3.901   7.328  -3.575
   91    H    HIS  13           HN       HIS  13  -3.774   3.886  -0.628
   92    HA   HIS  13           HA       HIS  13  -1.115   2.668  -0.423
   93    HB2  HIS  13           2HB      HIS  13  -1.320   2.330   1.969
   94    HB3  HIS  13           1HB      HIS  13  -1.484   4.035   1.591
   95    HD1  HIS  13           1HD      HIS  13  -2.663   2.075   4.043
   96    HD2  HIS  13           2HD      HIS  13  -4.717   4.215   1.133
   97    HE1  HIS  13           1HE      HIS  13  -4.958   2.447   4.978
   98    HE2  HIS  13           2HE      HIS  13  -6.062   3.984   3.332
   99    H    LEU  14           HN       LEU  14  -1.086   0.658  -0.945
  100    HA   LEU  14           HA       LEU  14  -3.531  -0.963  -0.689
  101    HB2  LEU  14           2HB      LEU  14  -2.321  -0.606  -2.958
  102    HB3  LEU  14           1HB      LEU  14  -1.074  -1.645  -2.310
  103    HG   LEU  14           HG       LEU  14  -3.935  -2.563  -2.529
  104   HD11  LEU  14          1HD1      LEU  14  -1.757  -2.804  -4.599
  105   HD12  LEU  14          2HD1      LEU  14  -3.234  -1.854  -4.745
  106   HD13  LEU  14          3HD1      LEU  14  -3.322  -3.613  -4.655
  107   HD21  LEU  14          3HD2      LEU  14  -2.907  -4.781  -2.549
  108   HD22  LEU  14          1HD2      LEU  14  -2.448  -3.885  -1.100
  109   HD23  LEU  14          2HD2      LEU  14  -1.308  -4.047  -2.435
  110    H    LEU  15           HN       LEU  15  -3.475  -2.724   0.669
  111    HA   LEU  15           HA       LEU  15  -0.910  -3.220   2.037
  112    HB2  LEU  15           2HB      LEU  15  -2.744  -2.087   3.378
  113    HB3  LEU  15           1HB      LEU  15  -3.654  -3.571   3.241
  114    HG   LEU  15           HG       LEU  15  -2.509  -3.261   5.439
  115   HD11  LEU  15          1HD1      LEU  15  -1.535  -5.660   3.905
  116   HD12  LEU  15          2HD1      LEU  15  -3.117  -5.502   4.664
  117   HD13  LEU  15          3HD1      LEU  15  -1.660  -5.513   5.658
  118   HD21  LEU  15          3HD2      LEU  15  -0.110  -3.582   5.599
  119   HD22  LEU  15          1HD2      LEU  15  -0.493  -2.160   4.629
  120   HD23  LEU  15          2HD2      LEU  15   0.012  -3.656   3.842
  121    H    VAL  16           HN       VAL  16  -0.109  -5.158   1.783
  122    HA   VAL  16           HA       VAL  16  -1.913  -7.386   1.105
  123    HB   VAL  16           HB       VAL  16   1.039  -7.111   0.474
  124   HG11  VAL  16          1HG1      VAL  16  -0.944  -9.237  -0.337
  125   HG12  VAL  16          2HG1      VAL  16   0.378  -9.431   0.813
  126   HG13  VAL  16          3HG1      VAL  16   0.727  -9.125  -0.888
  127   HG21  VAL  16          3HG2      VAL  16  -0.271  -5.589  -0.871
  128   HG22  VAL  16          1HG2      VAL  16  -1.378  -6.890  -1.310
  129   HG23  VAL  16          2HG2      VAL  16   0.297  -6.931  -1.866
  130    H    LYS  17           HN       LYS  17  -2.073  -8.967   2.538
  131    HA   LYS  17           HA       LYS  17  -0.300  -8.952   4.856
  132    HB2  LYS  17           2HB      LYS  17  -2.984 -10.109   4.265
  133    HB3  LYS  17           1HB      LYS  17  -2.009 -10.845   5.525
  134    HG2  LYS  17           2HG      LYS  17  -2.820  -7.943   5.442
  135    HG3  LYS  17           1HG      LYS  17  -3.627  -9.203   6.381
  136    HD2  LYS  17           2HD      LYS  17  -1.314  -9.632   7.420
  137    HD3  LYS  17           1HD      LYS  17  -0.865  -8.069   6.737
  138    HE2  LYS  17           2HE      LYS  17  -3.133  -8.582   8.663
  139    HE3  LYS  17           1HE      LYS  17  -1.582  -7.850   9.062
  140    HZ1  LYS  17           3HZ      LYS  17  -3.378  -6.232   8.751
  141    HZ2  LYS  17           1HZ      LYS  17  -3.539  -6.716   7.143
  142    HZ3  LYS  17           2HZ      LYS  17  -2.102  -5.982   7.672
  143    H    HIS  18           HN       HIS  18   0.114 -11.187   5.777
  144    HA   HIS  18           HA       HIS  18   0.569 -13.273   3.851
  145    HB2  HIS  18           2HB      HIS  18   3.001 -13.512   4.801
  146    HB3  HIS  18           1HB      HIS  18   2.696 -12.384   3.493
  147    HD1  HIS  18           1HD      HIS  18   3.834 -12.549   7.040
  148    HD2  HIS  18           2HD      HIS  18   2.885  -9.641   4.225
  149    HE1  HIS  18           1HE      HIS  18   4.736 -10.408   7.958
  150    HE2  HIS  18           2HE      HIS  18   4.418  -8.747   6.115
  151    H    SER  19           HN       SER  19   1.172 -15.321   4.941
  152    HA   SER  19           HA       SER  19  -0.584 -15.749   7.068
  153    HB2  SER  19           2HB      SER  19   0.343 -17.448   5.382
  154    HB3  SER  19           1HB      SER  19   1.725 -17.581   6.470
  155    HG   SER  19           HG       SER  19  -0.983 -17.951   7.239
  156    H    GLN  20           HN       GLN  20   2.948 -15.383   7.095
  157    HA   GLN  20           HA       GLN  20   3.000 -15.644   9.964
  158    HB2  GLN  20           2HB      GLN  20   5.187 -14.957   8.001
  159    HB3  GLN  20           1HB      GLN  20   5.428 -15.153   9.728
  160    HG2  GLN  20           2HG      GLN  20   4.361 -17.306   7.917
  161    HG3  GLN  20           1HG      GLN  20   6.055 -17.132   8.372
  162   HE21  GLN  20          1HE2      GLN  20   6.099 -19.121   9.370
  163   HE22  GLN  20          2HE2      GLN  20   5.324 -19.425  10.887
  164    H    SER  21           HN       SER  21   1.569 -13.940  10.432
  165    HA   SER  21           HA       SER  21   2.938 -11.362  10.630
  166    HB2  SER  21           2HB      SER  21   0.019 -11.657   9.850
  167    HB3  SER  21           1HB      SER  21   0.912 -10.150  10.033
  168    HG   SER  21           HG       SER  21   1.025 -12.077   8.009
  169    H    ARG  22           HN       ARG  22   1.442  -9.950  12.185
  170    HA   ARG  22           HA       ARG  22   1.202 -11.496  14.579
  171    HB2  ARG  22           2HB      ARG  22   0.308  -8.641  14.129
  172    HB3  ARG  22           1HB      ARG  22   0.627  -9.416  15.674
  173    HG2  ARG  22           2HG      ARG  22   3.017  -9.731  14.806
  174    HG3  ARG  22           1HG      ARG  22   2.579  -8.544  13.577
  175    HD2  ARG  22           2HD      ARG  22   3.615  -7.369  15.372
  176    HD3  ARG  22           1HD      ARG  22   1.888  -7.012  15.434
  177    HE   ARG  22           HE       ARG  22   2.339  -9.208  17.079
  178   HH11  ARG  22          1HH1      ARG  22   3.208  -5.804  16.969
  179   HH12  ARG  22          2HH1      ARG  22   3.396  -5.664  18.682
  180   HH21  ARG  22          1HH2      ARG  22   2.601  -9.030  19.350
  181   HH22  ARG  22          2HH2      ARG  22   3.047  -7.508  20.042
  182    H    ARG  23           HN       ARG  23  -1.022  -9.793  12.432
  183    HA   ARG  23           HA       ARG  23  -3.134 -11.611  13.346
  184    HB2  ARG  23           2HB      ARG  23  -3.422  -8.668  12.714
  185    HB3  ARG  23           1HB      ARG  23  -4.787  -9.760  12.837
  186    HG2  ARG  23           2HG      ARG  23  -4.747  -8.751  14.915
  187    HG3  ARG  23           1HG      ARG  23  -3.877 -10.254  15.211
  188    HD2  ARG  23           2HD      ARG  23  -2.696  -8.448  16.269
  189    HD3  ARG  23           1HD      ARG  23  -1.748  -9.019  14.898
  190    HE   ARG  23           HE       ARG  23  -3.087  -7.011  13.785
  191   HH11  ARG  23          1HH1      ARG  23  -1.383  -7.151  16.853
  192   HH12  ARG  23          2HH1      ARG  23  -0.978  -5.471  16.855
  193   HH21  ARG  23          1HH2      ARG  23  -2.546  -4.767  13.785
  194   HH22  ARG  23          2HH2      ARG  23  -1.641  -4.114  15.105
  195    HA   PRO  24           HA       PRO  24  -2.700 -12.188   8.850
  196    HB2  PRO  24           2HB      PRO  24  -3.240 -14.812   8.820
  197    HB3  PRO  24           1HB      PRO  24  -1.670 -14.204   9.359
  198    HG2  PRO  24           2HG      PRO  24  -4.006 -15.123  10.987
  199    HG3  PRO  24           1HG      PRO  24  -2.278 -15.440  11.229
  200    HD2  PRO  24           2HD      PRO  24  -3.701 -13.520  12.587
  201    HD3  PRO  24           1HD      PRO  24  -1.949 -13.456  12.322
  202    H    SER  25           HN       SER  25  -5.036 -11.075  10.076
  203    HA   SER  25           HA       SER  25  -7.265 -12.630   9.025
  204    HB2  SER  25           2HB      SER  25  -7.303 -10.033  10.578
  205    HB3  SER  25           1HB      SER  25  -8.678 -11.092  10.253
  206    HG   SER  25           HG       SER  25  -7.289 -12.737  11.388
  207    H    SER  26           HN       SER  26  -8.565 -11.924   7.365
  208    HA   SER  26           HA       SER  26  -7.855  -9.387   6.070
  209    HB2  SER  26           2HB      SER  26  -8.046 -10.460   3.869
  210    HB3  SER  26           1HB      SER  26  -6.783 -11.228   4.829
  211    H    TRP  27           HN       TRP  27  -9.581  -8.454   4.821
  212    HA   TRP  27           HA       TRP  27 -12.202  -9.186   5.865
  213    HB2  TRP  27           2HB      TRP  27 -12.943  -7.047   5.206
  214    HB3  TRP  27           1HB      TRP  27 -11.274  -6.759   5.678
  215    HD1  TRP  27           1HD      TRP  27  -9.486  -6.443   3.596
  216    HE1  TRP  27           1HE      TRP  27  -9.846  -5.530   1.237
  217    HE3  TRP  27           3HE      TRP  27 -14.579  -6.827   3.357
  218    HZ2  TRP  27           2HZ      TRP  27 -12.008  -5.018  -0.510
  219    HZ3  TRP  27           3HZ      TRP  27 -15.714  -6.101   1.300
  220    HH2  TRP  27           2HH      TRP  27 -14.452  -5.215  -0.591
  221    H    ARG  28           HN       ARG  28 -10.342  -9.285   2.959
  222    HA   ARG  28           HA       ARG  28 -12.521  -9.724   1.160
  223    HB2  ARG  28           2HB      ARG  28 -10.714 -10.208  -0.491
  224    HB3  ARG  28           1HB      ARG  28 -10.560  -8.648   0.308
  225    HG2  ARG  28           2HG      ARG  28  -8.932  -9.744   1.883
  226    HG3  ARG  28           1HG      ARG  28  -8.971 -11.147   0.814
  227    HD2  ARG  28           2HD      ARG  28  -8.232  -8.352  -0.031
  228    HD3  ARG  28           1HD      ARG  28  -7.078  -9.616   0.375
  229    HE   ARG  28           HE       ARG  28  -8.967  -9.793  -1.880
  230   HH11  ARG  28          1HH1      ARG  28  -5.795 -10.347  -0.456
  231   HH12  ARG  28          2HH1      ARG  28  -5.140 -11.030  -1.913
  232   HH21  ARG  28          1HH2      ARG  28  -8.083 -10.706  -3.785
  233   HH22  ARG  28          2HH2      ARG  28  -6.435 -11.235  -3.796
  234    H    GLN  29           HN       GLN  29 -10.761 -11.707   3.278
  235    HA   GLN  29           HA       GLN  29 -12.145 -14.013   2.161
  236    HB2  GLN  29           2HB      GLN  29  -9.802 -14.114   1.349
  237    HB3  GLN  29           1HB      GLN  29  -9.241 -14.085   3.014
  238    HG2  GLN  29           2HG      GLN  29  -9.224 -16.343   2.054
  239    HG3  GLN  29           1HG      GLN  29 -10.291 -16.215   3.452
  240   HE21  GLN  29          1HE2      GLN  29 -12.507 -16.377   3.168
  241   HE22  GLN  29          2HE2      GLN  29 -13.215 -16.953   1.703
  242    H    GLU  30           HN       GLU  30  -9.765 -13.691   4.758
  243    HA   GLU  30           HA       GLU  30 -11.263 -13.278   6.972
  244    HB2  GLU  30           2HB      GLU  30 -12.538 -15.370   6.169
  245    HB3  GLU  30           1HB      GLU  30 -11.105 -16.274   6.645
  246    HG2  GLU  30           2HG      GLU  30 -12.821 -16.293   8.381
  247    HG3  GLU  30           1HG      GLU  30 -11.339 -15.503   8.926
  248    H    LYS  31           HN       LYS  31  -9.110 -15.884   5.906
  249    HA   LYS  31           HA       LYS  31  -7.081 -14.875   7.757
  250    HB2  LYS  31           2HB      LYS  31  -6.425 -17.224   8.244
  251    HB3  LYS  31           1HB      LYS  31  -8.032 -16.819   8.831
  252    HG2  LYS  31           2HG      LYS  31  -9.050 -17.995   6.984
  253    HG3  LYS  31           1HG      LYS  31  -7.465 -18.304   6.275
  254    HD2  LYS  31           2HD      LYS  31  -6.847 -19.675   8.176
  255    HD3  LYS  31           1HD      LYS  31  -8.378 -19.304   8.970
  256    HE2  LYS  31           2HE      LYS  31  -8.432 -21.514   7.925
  257    HE3  LYS  31           1HE      LYS  31  -9.593 -20.423   7.175
  258    HZ1  LYS  31           3HZ      LYS  31  -8.406 -21.708   5.524
  259    HZ2  LYS  31           1HZ      LYS  31  -6.920 -21.133   6.082
  260    HZ3  LYS  31           2HZ      LYS  31  -8.025 -20.075   5.358
  261    H    ILE  32           HN       ILE  32  -5.028 -14.919   7.014
  262    HA   ILE  32           HA       ILE  32  -4.726 -15.551   4.173
  263    HB   ILE  32           HB       ILE  32  -2.987 -13.866   5.987
  264   HG12  ILE  32          2HG1      ILE  32  -5.140 -12.815   5.525
  265   HG13  ILE  32          1HG1      ILE  32  -3.855 -11.971   4.671
  266   HG21  ILE  32          1HG2      ILE  32  -2.805 -14.317   3.012
  267   HG22  ILE  32          2HG2      ILE  32  -1.675 -14.917   4.228
  268   HG23  ILE  32          3HG2      ILE  32  -1.829 -13.182   3.945
  269   HD11  ILE  32          3HD1      ILE  32  -5.781 -12.174   3.246
  270   HD12  ILE  32          1HD1      ILE  32  -5.819 -13.922   3.487
  271   HD13  ILE  32          2HD1      ILE  32  -4.480 -13.182   2.613
  272    H    THR  33           HN       THR  33  -3.701 -17.326   3.599
  273    HA   THR  33           HA       THR  33  -1.855 -18.563   5.516
  274    HB   THR  33           HB       THR  33  -2.360 -20.691   4.206
  275    HG1  THR  33           1HG      THR  33  -3.437 -20.152   2.421
  276   HG21  THR  33          3HG2      THR  33  -4.437 -21.103   5.439
  277   HG22  THR  33          1HG2      THR  33  -4.629 -19.370   5.708
  278   HG23  THR  33          2HG2      THR  33  -3.278 -20.233   6.441
  279    H    ARG  34           HN       ARG  34  -1.715 -16.687   2.913
  280    HA   ARG  34           HA       ARG  34   0.082 -18.152   1.232
  281    HB2  ARG  34           2HB      ARG  34   0.227 -16.215  -0.102
  282    HB3  ARG  34           1HB      ARG  34  -1.406 -16.184   0.535
  283    HG2  ARG  34           2HG      ARG  34  -0.696 -14.565   2.240
  284    HG3  ARG  34           1HG      ARG  34   0.924 -14.572   1.546
  285    HD2  ARG  34           2HD      ARG  34  -0.200 -12.669   0.680
  286    HD3  ARG  34           1HD      ARG  34  -0.104 -13.851  -0.622
  287    HE   ARG  34           HE       ARG  34  -2.449 -14.376  -0.194
  288   HH11  ARG  34          1HH1      ARG  34  -1.205 -11.372   1.148
  289   HH12  ARG  34          2HH1      ARG  34  -2.765 -10.614   1.230
  290   HH21  ARG  34          1HH2      ARG  34  -4.524 -13.346  -0.060
  291   HH22  ARG  34          2HH2      ARG  34  -4.634 -11.733   0.577
  292    H    THR  35           HN       THR  35   2.294 -18.064   1.130
  293    HA   THR  35           HA       THR  35   3.617 -17.202   3.547
  294    HB   THR  35           HB       THR  35   4.260 -19.351   2.507
  295    HG1  THR  35           1HG      THR  35   6.057 -18.850   3.499
  296   HG21  THR  35          3HG2      THR  35   5.562 -19.375   0.421
  297   HG22  THR  35          1HG2      THR  35   5.292 -17.643   0.238
  298   HG23  THR  35          2HG2      THR  35   3.931 -18.760   0.160
  299    H    LYS  36           HN       LYS  36   5.968 -16.231   2.986
  300    HA   LYS  36           HA       LYS  36   5.525 -13.534   2.311
  301    HB2  LYS  36           2HB      LYS  36   7.320 -14.323   3.802
  302    HB3  LYS  36           1HB      LYS  36   8.131 -15.061   2.431
  303    HG2  LYS  36           2HG      LYS  36   8.367 -12.808   1.419
  304    HG3  LYS  36           1HG      LYS  36   7.670 -12.117   2.886
  305    HD2  LYS  36           2HD      LYS  36  10.193 -13.775   2.743
  306    HD3  LYS  36           1HD      LYS  36  10.126 -12.021   2.914
  307    HE2  LYS  36           2HE      LYS  36   9.040 -12.225   5.056
  308    HE3  LYS  36           1HE      LYS  36   8.920 -13.973   4.876
  309    HZ1  LYS  36           3HZ      LYS  36  10.735 -13.408   6.307
  310    HZ2  LYS  36           1HZ      LYS  36  11.421 -12.404   5.130
  311    HZ3  LYS  36           2HZ      LYS  36  11.343 -14.074   4.877
  312    H    GLU  37           HN       GLU  37   6.821 -16.251   0.502
  313    HA   GLU  37           HA       GLU  37   7.800 -14.940  -1.755
  314    HB2  GLU  37           2HB      GLU  37   6.392 -17.603  -1.816
  315    HB3  GLU  37           1HB      GLU  37   7.683 -17.045  -2.869
  316    HG2  GLU  37           2HG      GLU  37   9.236 -17.103  -0.990
  317    HG3  GLU  37           1HG      GLU  37   7.938 -17.656   0.065
  318    H    GLU  38           HN       GLU  38   4.594 -16.274  -1.118
  319    HA   GLU  38           HA       GLU  38   3.428 -15.615  -3.586
  320    HB2  GLU  38           2HB      GLU  38   2.174 -16.056  -0.881
  321    HB3  GLU  38           1HB      GLU  38   1.273 -15.948  -2.385
  322    HG2  GLU  38           2HG      GLU  38   2.395 -17.922  -3.227
  323    HG3  GLU  38           1HG      GLU  38   3.373 -18.008  -1.763
  324    H    ALA  39           HN       ALA  39   3.641 -13.890  -0.526
  325    HA   ALA  39           HA       ALA  39   1.910 -11.767  -1.224
  326    HB1  ALA  39           1HB      ALA  39   2.866 -10.605   0.695
  327    HB2  ALA  39           2HB      ALA  39   4.176 -11.784   0.772
  328    HB3  ALA  39           3HB      ALA  39   2.516 -12.286   1.096
  329    H    LEU  40           HN       LEU  40   5.422 -12.181  -1.447
  330    HA   LEU  40           HA       LEU  40   6.014  -9.589  -2.365
  331    HB2  LEU  40           2HB      LEU  40   7.708 -11.120  -1.487
  332    HB3  LEU  40           1HB      LEU  40   7.487 -12.175  -2.868
  333    HG   LEU  40           HG       LEU  40   8.329 -10.376  -4.349
  334   HD11  LEU  40          1HD1      LEU  40   7.729  -8.444  -3.011
  335   HD12  LEU  40          2HD1      LEU  40   9.459  -8.443  -3.350
  336   HD13  LEU  40          3HD1      LEU  40   8.873  -8.929  -1.759
  337   HD21  LEU  40          3HD2      LEU  40  10.669 -10.554  -3.675
  338   HD22  LEU  40          1HD2      LEU  40   9.835 -12.101  -3.511
  339   HD23  LEU  40          2HD2      LEU  40  10.171 -11.124  -2.081
  340    H    GLU  41           HN       GLU  41   5.208 -12.565  -4.109
  341    HA   GLU  41           HA       GLU  41   5.640 -11.517  -6.691
  342    HB2  GLU  41           2HB      GLU  41   3.830 -13.760  -5.803
  343    HB3  GLU  41           1HB      GLU  41   4.202 -13.384  -7.477
  344    HG2  GLU  41           2HG      GLU  41   6.640 -13.708  -6.838
  345    HG3  GLU  41           1HG      GLU  41   6.027 -14.432  -5.350
  346    H    LEU  42           HN       LEU  42   2.839 -11.509  -4.562
  347    HA   LEU  42           HA       LEU  42   0.967 -10.513  -6.410
  348    HB2  LEU  42           2HB      LEU  42   1.141 -10.179  -3.416
  349    HB3  LEU  42           1HB      LEU  42  -0.219  -9.625  -4.371
  350    HG   LEU  42           HG       LEU  42   0.673 -12.495  -4.090
  351   HD11  LEU  42          1HD1      LEU  42  -1.695 -11.034  -2.934
  352   HD12  LEU  42          2HD1      LEU  42  -0.296 -11.629  -2.041
  353   HD13  LEU  42          3HD1      LEU  42  -1.397 -12.767  -2.816
  354   HD21  LEU  42          3HD2      LEU  42  -1.447 -13.006  -5.239
  355   HD22  LEU  42          1HD2      LEU  42  -0.334 -12.099  -6.263
  356   HD23  LEU  42          2HD2      LEU  42  -1.701 -11.282  -5.506
  357    H    ILE  43           HN       ILE  43   3.239  -8.902  -4.245
  358    HA   ILE  43           HA       ILE  43   2.512  -6.250  -4.668
  359    HB   ILE  43           HB       ILE  43   5.317  -7.343  -4.312
  360   HG12  ILE  43          2HG1      ILE  43   3.826  -8.026  -2.491
  361   HG13  ILE  43          1HG1      ILE  43   5.000  -6.842  -1.926
  362   HG21  ILE  43          1HG2      ILE  43   4.266  -4.558  -3.826
  363   HG22  ILE  43          2HG2      ILE  43   5.318  -5.052  -5.153
  364   HG23  ILE  43          3HG2      ILE  43   5.903  -5.123  -3.492
  365   HD11  ILE  43          3HD1      ILE  43   2.803  -6.416  -1.001
  366   HD12  ILE  43          1HD1      ILE  43   2.126  -6.293  -2.623
  367   HD13  ILE  43          2HD1      ILE  43   3.297  -5.098  -2.064
  368    H    ASN  44           HN       ASN  44   4.907  -8.192  -6.424
  369    HA   ASN  44           HA       ASN  44   5.578  -6.254  -8.338
  370    HB2  ASN  44           2HB      ASN  44   5.697  -9.269  -8.484
  371    HB3  ASN  44           1HB      ASN  44   6.388  -8.200  -9.701
  372   HD21  ASN  44          1HD2      ASN  44   7.667 -10.142  -7.930
  373   HD22  ASN  44          2HD2      ASN  44   8.858  -9.256  -7.049
  374    H    GLY  45           HN       GLY  45   3.106  -8.784  -8.355
  375    HA2  GLY  45           2HA      GLY  45   2.192  -8.445 -10.980
  376    HA3  GLY  45           1HA      GLY  45   1.221  -9.042  -9.641
  377    H    TYR  46           HN       TYR  46   1.114  -6.878  -7.975
  378    HA   TYR  46           HA       TYR  46  -0.881  -5.281  -9.151
  379    HB2  TYR  46           2HB      TYR  46   0.769  -4.693  -6.682
  380    HB3  TYR  46           1HB      TYR  46  -0.728  -3.885  -7.126
  381    HD1  TYR  46           2HD      TYR  46  -2.191  -6.426  -8.068
  382    HD2  TYR  46           1HD      TYR  46   0.081  -5.542  -4.583
  383    HE1  TYR  46           2HE      TYR  46  -3.449  -8.123  -6.820
  384    HE2  TYR  46           1HE      TYR  46  -1.173  -7.240  -3.331
  385    HH   TYR  46           HH       TYR  46  -3.374  -8.356  -3.451
  386    H    ILE  47           HN       ILE  47   2.487  -4.536  -8.305
  387    HA   ILE  47           HA       ILE  47   2.648  -1.922  -9.154
  388    HB   ILE  47           HB       ILE  47   4.736  -4.106  -9.311
  389   HG12  ILE  47          2HG1      ILE  47   4.346  -1.830  -7.354
  390   HG13  ILE  47          1HG1      ILE  47   3.943  -3.516  -7.053
  391   HG21  ILE  47          1HG2      ILE  47   5.125  -1.139  -9.704
  392   HG22  ILE  47          2HG2      ILE  47   5.332  -2.396 -10.924
  393   HG23  ILE  47          3HG2      ILE  47   6.418  -2.327  -9.536
  394   HD11  ILE  47          3HD1      ILE  47   6.040  -2.899  -5.995
  395   HD12  ILE  47          1HD1      ILE  47   6.703  -2.424  -7.559
  396   HD13  ILE  47          2HD1      ILE  47   6.302  -4.112  -7.249
  397    H    GLN  48           HN       GLN  48   3.038  -4.852 -11.094
  398    HA   GLN  48           HA       GLN  48   3.667  -3.609 -13.520
  399    HB2  GLN  48           2HB      GLN  48   2.460  -6.266 -12.829
  400    HB3  GLN  48           1HB      GLN  48   2.656  -5.778 -14.503
  401    HG2  GLN  48           2HG      GLN  48   4.875  -5.960 -12.481
  402    HG3  GLN  48           1HG      GLN  48   4.493  -7.188 -13.683
  403   HE21  GLN  48          1HE2      GLN  48   3.859  -5.219 -15.775
  404   HE22  GLN  48          2HE2      GLN  48   5.374  -4.560 -16.275
  405    H    LYS  49           HN       LYS  49   0.503  -4.688 -12.285
  406    HA   LYS  49           HA       LYS  49  -0.923  -3.829 -14.574
  407    HB2  LYS  49           2HB      LYS  49  -1.837  -4.462 -11.777
  408    HB3  LYS  49           1HB      LYS  49  -2.940  -4.060 -13.085
  409    HG2  LYS  49           2HG      LYS  49  -2.084  -5.972 -14.364
  410    HG3  LYS  49           1HG      LYS  49  -1.037  -6.387 -13.007
  411    HD2  LYS  49           2HD      LYS  49  -2.946  -6.777 -11.592
  412    HD3  LYS  49           1HD      LYS  49  -4.043  -6.206 -12.854
  413    HE2  LYS  49           2HE      LYS  49  -2.232  -8.605 -13.084
  414    HE3  LYS  49           1HE      LYS  49  -3.950  -8.672 -12.699
  415    HZ1  LYS  49           3HZ      LYS  49  -3.402  -9.074 -15.068
  416    HZ2  LYS  49           1HZ      LYS  49  -2.871  -7.474 -15.202
  417    HZ3  LYS  49           2HZ      LYS  49  -4.489  -7.808 -14.833
  418    H    ILE  50           HN       ILE  50  -0.123  -2.240 -11.555
  419    HA   ILE  50           HA       ILE  50  -1.888  -0.057 -11.808
  420    HB   ILE  50           HB       ILE  50   0.734  -0.276 -10.316
  421   HG12  ILE  50          2HG1      ILE  50  -2.098  -0.363  -9.263
  422   HG13  ILE  50          1HG1      ILE  50  -1.171  -1.802  -9.670
  423   HG21  ILE  50          1HG2      ILE  50  -1.397   1.851 -10.099
  424   HG22  ILE  50          2HG2      ILE  50   0.225   2.069 -10.757
  425   HG23  ILE  50          3HG2      ILE  50   0.011   1.693  -9.048
  426   HD11  ILE  50          3HD1      ILE  50  -1.137  -1.335  -7.279
  427   HD12  ILE  50          1HD1      ILE  50  -0.414   0.239  -7.592
  428   HD13  ILE  50          2HD1      ILE  50   0.478  -1.230  -7.978
  429    H    LYS  51           HN       LYS  51   1.587  -0.310 -12.638
  430    HA   LYS  51           HA       LYS  51   1.596   2.361 -13.684
  431    HB2  LYS  51           2HB      LYS  51   3.696   0.202 -13.813
  432    HB3  LYS  51           1HB      LYS  51   3.929   1.847 -14.390
  433    HG2  LYS  51           2HG      LYS  51   3.394   2.634 -12.067
  434    HG3  LYS  51           1HG      LYS  51   3.439   0.947 -11.563
  435    HD2  LYS  51           2HD      LYS  51   5.712   2.484 -12.828
  436    HD3  LYS  51           1HD      LYS  51   5.570   2.063 -11.120
  437    HE2  LYS  51           2HE      LYS  51   5.575  -0.331 -11.760
  438    HE3  LYS  51           1HE      LYS  51   5.828   0.156 -13.436
  439    HZ1  LYS  51           3HZ      LYS  51   7.904  -0.448 -12.386
  440    HZ2  LYS  51           1HZ      LYS  51   7.672   0.712 -11.179
  441    HZ3  LYS  51           2HZ      LYS  51   7.907   1.193 -12.782
  442    H    SER  52           HN       SER  52   0.938  -0.735 -15.047
  443    HA   SER  52           HA       SER  52   1.433   0.143 -17.753
  444    HB2  SER  52           2HB      SER  52   0.056  -2.356 -16.750
  445    HB3  SER  52           1HB      SER  52   0.545  -2.046 -18.418
  446    HG   SER  52           HG       SER  52   2.006  -2.958 -16.337
  447    H    GLY  53           HN       GLY  53  -1.052   0.573 -15.538
  448    HA2  GLY  53           2HA      GLY  53  -3.010   1.773 -15.829
  449    HA3  GLY  53           1HA      GLY  53  -2.714   1.776 -17.560
  450    H    GLU  54           HN       GLU  54  -2.701  -1.197 -15.771
  451    HA   GLU  54           HA       GLU  54  -4.895  -2.205 -17.349
  452    HB2  GLU  54           2HB      GLU  54  -3.218  -3.448 -15.165
  453    HB3  GLU  54           1HB      GLU  54  -4.512  -4.300 -15.992
  454    HG2  GLU  54           2HG      GLU  54  -3.342  -4.108 -18.093
  455    HG3  GLU  54           1HG      GLU  54  -2.080  -3.142 -17.333
  456    H    GLU  55           HN       GLU  55  -4.247  -1.792 -13.895
  457    HA   GLU  55           HA       GLU  55  -7.151  -1.633 -13.441
  458    HB2  GLU  55           2HB      GLU  55  -5.049  -2.724 -11.557
  459    HB3  GLU  55           1HB      GLU  55  -6.767  -2.611 -11.225
  460    HG2  GLU  55           2HG      GLU  55  -5.536  -4.311 -13.383
  461    HG3  GLU  55           1HG      GLU  55  -6.022  -4.889 -11.791
  462    H    ASP  56           HN       ASP  56  -7.848   0.027 -12.126
  463    HA   ASP  56           HA       ASP  56  -6.044   2.204 -11.616
  464    HB2  ASP  56           2HB      ASP  56  -8.943   1.711 -10.902
  465    HB3  ASP  56           1HB      ASP  56  -8.075   3.127 -10.324
  466    H    PHE  57           HN       PHE  57  -5.035   2.719  -9.724
  467    HA   PHE  57           HA       PHE  57  -4.416   0.739  -7.892
  468    HB2  PHE  57           2HB      PHE  57  -3.223   2.966  -8.247
  469    HB3  PHE  57           1HB      PHE  57  -4.437   3.677  -7.190
  470    HD1  PHE  57           1HD      PHE  57  -4.677   2.601  -4.830
  471    HD2  PHE  57           2HD      PHE  57  -1.293   2.079  -7.349
  472    HE1  PHE  57           1HE      PHE  57  -3.323   1.972  -2.876
  473    HE2  PHE  57           2HE      PHE  57   0.067   1.447  -5.402
  474    HZ   PHE  57           HZ       PHE  57  -0.949   1.391  -3.161
  475    H    GLU  58           HN       GLU  58  -6.807   3.334  -7.585
  476    HA   GLU  58           HA       GLU  58  -7.753   2.767  -5.041
  477    HB2  GLU  58           2HB      GLU  58  -9.399   3.755  -7.378
  478    HB3  GLU  58           1HB      GLU  58  -9.809   3.923  -5.681
  479    HG2  GLU  58           2HG      GLU  58  -8.991   6.008  -6.144
  480    HG3  GLU  58           1HG      GLU  58  -7.533   5.206  -5.563
  481    H    SER  59           HN       SER  59  -9.116   1.647  -8.128
  482    HA   SER  59           HA       SER  59 -11.076  -0.022  -7.004
  483    HB2  SER  59           2HB      SER  59 -11.192   0.801  -9.310
  484    HB3  SER  59           1HB      SER  59  -9.769  -0.147  -9.732
  485    HG   SER  59           HG       SER  59 -11.119  -1.667 -10.172
  486    H    LEU  60           HN       LEU  60  -7.738  -0.605  -7.932
  487    HA   LEU  60           HA       LEU  60  -7.768  -3.422  -7.739
  488    HB2  LEU  60           2HB      LEU  60  -6.019  -2.057  -8.875
  489    HB3  LEU  60           1HB      LEU  60  -5.457  -1.531  -7.303
  490    HG   LEU  60           HG       LEU  60  -4.981  -3.954  -6.775
  491   HD11  LEU  60          1HD1      LEU  60  -6.406  -4.973  -8.457
  492   HD12  LEU  60          2HD1      LEU  60  -4.730  -5.472  -8.674
  493   HD13  LEU  60          3HD1      LEU  60  -5.431  -4.253  -9.738
  494   HD21  LEU  60          3HD2      LEU  60  -2.893  -3.977  -8.048
  495   HD22  LEU  60          1HD2      LEU  60  -3.224  -2.384  -7.369
  496   HD23  LEU  60          2HD2      LEU  60  -3.512  -2.689  -9.083
  497    H    ALA  61           HN       ALA  61  -6.682  -0.919  -5.452
  498    HA   ALA  61           HA       ALA  61  -6.009  -2.677  -3.368
  499    HB1  ALA  61           1HB      ALA  61  -6.020  -0.712  -1.932
  500    HB2  ALA  61           2HB      ALA  61  -6.887   0.200  -3.167
  501    HB3  ALA  61           3HB      ALA  61  -5.241  -0.353  -3.474
  502    H    SER  62           HN       SER  62  -9.034  -1.137  -4.231
  503    HA   SER  62           HA       SER  62 -10.480  -1.622  -1.890
  504    HB2  SER  62           2HB      SER  62 -11.489  -1.397  -4.721
  505    HB3  SER  62           1HB      SER  62 -12.484  -1.280  -3.268
  506    HG   SER  62           HG       SER  62 -10.406   0.455  -4.116
  507    H    GLN  63           HN       GLN  63  -9.297  -3.923  -4.039
  508    HA   GLN  63           HA       GLN  63 -11.189  -5.899  -2.953
  509    HB2  GLN  63           2HB      GLN  63 -10.145  -5.782  -5.784
  510    HB3  GLN  63           1HB      GLN  63 -11.015  -7.149  -5.110
  511    HG2  GLN  63           2HG      GLN  63 -12.975  -5.730  -4.767
  512    HG3  GLN  63           1HG      GLN  63 -12.093  -4.359  -5.435
  513   HE21  GLN  63          1HE2      GLN  63 -10.771  -6.003  -7.460
  514   HE22  GLN  63          2HE2      GLN  63 -11.966  -6.346  -8.657
  515    H    PHE  64           HN       PHE  64  -7.964  -5.268  -4.229
  516    HA   PHE  64           HA       PHE  64  -7.100  -7.940  -3.523
  517    HB2  PHE  64           2HB      PHE  64  -5.718  -5.670  -4.926
  518    HB3  PHE  64           1HB      PHE  64  -4.905  -7.173  -4.508
  519    HD1  PHE  64           1HD      PHE  64  -7.688  -5.743  -6.487
  520    HD2  PHE  64           2HD      PHE  64  -5.160  -9.102  -5.830
  521    HE1  PHE  64           1HE      PHE  64  -8.512  -6.764  -8.566
  522    HE2  PHE  64           2HE      PHE  64  -5.977 -10.128  -7.911
  523    HZ   PHE  64           HZ       PHE  64  -7.655  -8.959  -9.283
  524    H    SER  65           HN       SER  65  -7.304  -5.047  -1.843
  525    HA   SER  65           HA       SER  65  -4.947  -5.595  -0.236
  526    HB2  SER  65           2HB      SER  65  -7.066  -3.451  -0.078
  527    HB3  SER  65           1HB      SER  65  -5.849  -3.671   1.182
  528    HG   SER  65           HG       SER  65  -4.590  -3.706  -1.098
  529    H    ASP  66           HN       ASP  66  -4.938  -6.862   1.446
  530    HA   ASP  66           HA       ASP  66  -7.312  -8.251   2.218
  531    HB2  ASP  66           2HB      ASP  66  -4.653  -8.269   3.659
  532    HB3  ASP  66           1HB      ASP  66  -5.908  -9.498   3.723
  533    H    ALA  67           HN       ALA  67  -5.811  -5.366   3.196
  534    HA   ALA  67           HA       ALA  67  -7.034  -5.432   5.857
  535    HB1  ALA  67           1HB      ALA  67  -5.627  -3.535   6.385
  536    HB2  ALA  67           2HB      ALA  67  -5.046  -3.483   4.723
  537    HB3  ALA  67           3HB      ALA  67  -4.668  -4.869   5.749
  538    H    SER  68           HN       SER  68  -7.471  -2.930   6.515
  539    HA   SER  68           HA       SER  68  -9.947  -2.326   5.317
  540    HB2  SER  68           2HB      SER  68  -8.291  -0.605   7.166
  541    HB3  SER  68           1HB      SER  68 -10.026  -0.467   6.870
  542    HG   SER  68           HG       SER  68 -10.305  -2.504   7.788
  543    H    SER  69           HN       SER  69  -6.870  -1.622   4.219
  544    HA   SER  69           HA       SER  69  -7.013   0.970   3.236
  545    HB2  SER  69           2HB      SER  69  -5.764  -1.353   1.769
  546    HB3  SER  69           1HB      SER  69  -5.240   0.335   1.780
  547    HG   SER  69           HG       SER  69  -3.967  -0.349   3.329
  548    H    ALA  70           HN       ALA  70  -8.436  -2.002   2.074
  549    HA   ALA  70           HA       ALA  70  -9.275  -1.129  -0.465
  550    HB1  ALA  70           1HB      ALA  70 -10.764  -3.074  -0.380
  551    HB2  ALA  70           2HB      ALA  70 -10.408  -3.262   1.338
  552    HB3  ALA  70           3HB      ALA  70  -9.129  -3.481   0.143
  553    H    LYS  71           HN       LYS  71 -10.651  -0.944   2.746
  554    HA   LYS  71           HA       LYS  71 -13.270  -0.158   1.935
  555    HB2  LYS  71           2HB      LYS  71 -11.927   0.229   4.615
  556    HB3  LYS  71           1HB      LYS  71 -13.651   0.294   4.297
  557    HG2  LYS  71           2HG      LYS  71 -11.877  -2.136   4.078
  558    HG3  LYS  71           1HG      LYS  71 -13.069  -1.811   5.337
  559    HD2  LYS  71           2HD      LYS  71 -13.670  -2.186   2.399
  560    HD3  LYS  71           1HD      LYS  71 -13.904  -3.401   3.654
  561    HE2  LYS  71           2HE      LYS  71 -15.542  -1.995   4.755
  562    HE3  LYS  71           1HE      LYS  71 -15.258  -0.705   3.587
  563    HZ1  LYS  71           3HZ      LYS  71 -17.239  -1.930   3.040
  564    HZ2  LYS  71           1HZ      LYS  71 -16.380  -3.385   2.973
  565    HZ3  LYS  71           2HZ      LYS  71 -16.075  -2.164   1.844
  566    H    ALA  72           HN       ALA  72 -10.288   1.430   2.242
  567    HA   ALA  72           HA       ALA  72 -11.474   4.080   2.461
  568    HB1  ALA  72           1HB      ALA  72  -9.157   4.868   2.552
  569    HB2  ALA  72           2HB      ALA  72  -8.585   3.228   2.250
  570    HB3  ALA  72           3HB      ALA  72  -9.444   3.600   3.744
  571    H    ARG  73           HN       ARG  73 -11.232   1.915   0.127
  572    HA   ARG  73           HA       ARG  73 -11.321   1.925  -2.122
  573    HB2  ARG  73           2HB      ARG  73 -12.819   3.936  -1.656
  574    HB3  ARG  73           1HB      ARG  73 -11.423   4.950  -1.985
  575    HG2  ARG  73           2HG      ARG  73 -12.830   4.834  -3.938
  576    HG3  ARG  73           1HG      ARG  73 -11.306   4.003  -4.260
  577    HD2  ARG  73           2HD      ARG  73 -12.412   1.853  -3.787
  578    HD3  ARG  73           1HD      ARG  73 -13.931   2.709  -3.532
  579    HE   ARG  73           HE       ARG  73 -12.911   3.366  -6.069
  580   HH11  ARG  73          1HH1      ARG  73 -14.294   0.643  -4.361
  581   HH12  ARG  73          2HH1      ARG  73 -15.001  -0.058  -5.771
  582   HH21  ARG  73          1HH2      ARG  73 -13.826   2.450  -7.947
  583   HH22  ARG  73          2HH2      ARG  73 -14.735   0.984  -7.836
  584    H    GLY  74           HN       GLY  74  -8.792   2.078  -0.675
  585    HA2  GLY  74           2HA      GLY  74  -6.605   1.865  -1.429
  586    HA3  GLY  74           1HA      GLY  74  -7.095   2.550  -2.970
  587    H    ASP  75           HN       ASP  75  -8.064   4.958  -2.343
  588    HA   ASP  75           HA       ASP  75  -5.699   6.470  -1.887
  589    HB2  ASP  75           2HB      ASP  75  -7.316   7.380  -3.391
  590    HB3  ASP  75           1HB      ASP  75  -8.593   7.274  -2.187
  591    H    LEU  76           HN       LEU  76  -4.918   7.377  -0.099
  592    HA   LEU  76           HA       LEU  76  -6.313   6.845   2.402
  593    HB2  LEU  76           2HB      LEU  76  -3.728   6.546   1.756
  594    HB3  LEU  76           1HB      LEU  76  -3.661   8.204   2.305
  595    HG   LEU  76           HG       LEU  76  -4.689   5.920   3.996
  596   HD11  LEU  76          1HD1      LEU  76  -1.961   7.195   3.960
  597   HD12  LEU  76          2HD1      LEU  76  -2.355   5.555   3.445
  598   HD13  LEU  76          3HD1      LEU  76  -2.531   6.015   5.140
  599   HD21  LEU  76          3HD2      LEU  76  -4.369   7.475   5.852
  600   HD22  LEU  76          1HD2      LEU  76  -5.495   8.137   4.668
  601   HD23  LEU  76          2HD2      LEU  76  -3.834   8.721   4.726
  602    H    GLY  77           HN       GLY  77  -5.573   9.410   0.222
  603    HA2  GLY  77           2HA      GLY  77  -6.494  11.545   0.223
  604    HA3  GLY  77           1HA      GLY  77  -7.066  11.270   1.864
  605    H    ALA  78           HN       ALA  78  -6.201  13.544   2.017
  606    HA   ALA  78           HA       ALA  78  -3.346  13.816   2.113
  607    HB1  ALA  78           1HB      ALA  78  -3.805  16.065   2.974
  608    HB2  ALA  78           2HB      ALA  78  -5.518  15.664   3.102
  609    HB3  ALA  78           3HB      ALA  78  -4.743  15.723   1.520
  610    H    PHE  79           HN       PHE  79  -2.284  12.753   3.643
  611    HA   PHE  79           HA       PHE  79  -3.370  12.871   6.368
  612    HB2  PHE  79           2HB      PHE  79  -2.140  10.777   6.839
  613    HB3  PHE  79           1HB      PHE  79  -3.341  10.572   5.573
  614    HD1  PHE  79           2HD      PHE  79   0.233  10.641   6.355
  615    HD2  PHE  79           1HD      PHE  79  -2.669  10.141   3.283
  616    HE1  PHE  79           2HE      PHE  79   1.958   9.693   4.883
  617    HE2  PHE  79           1HE      PHE  79  -0.951   9.191   1.809
  618    HZ   PHE  79           HZ       PHE  79   1.368   8.968   2.606
  619    H    SER  80           HN       SER  80  -1.950  13.234   8.059
  620    HA   SER  80           HA       SER  80   0.330  14.844   7.312
  621    HB2  SER  80           2HB      SER  80  -1.218  15.649   9.052
  622    HB3  SER  80           1HB      SER  80  -0.852  14.231  10.033
  623    HG   SER  80           HG       SER  80   0.667  16.511   9.531
  624    H    ARG  81           HN       ARG  81   2.421  14.370   7.771
  625    HA   ARG  81           HA       ARG  81   3.200  11.679   7.830
  626    HB2  ARG  81           2HB      ARG  81   5.505  12.618   8.299
  627    HB3  ARG  81           1HB      ARG  81   4.705  13.209   6.853
  628    HG2  ARG  81           2HG      ARG  81   4.083  15.258   8.039
  629    HG3  ARG  81           1HG      ARG  81   4.904  14.661   9.482
  630    HD2  ARG  81           2HD      ARG  81   7.023  14.686   8.368
  631    HD3  ARG  81           1HD      ARG  81   6.260  15.038   6.818
  632    HE   ARG  81           HE       ARG  81   5.580  17.073   8.602
  633   HH11  ARG  81          1HH1      ARG  81   8.439  15.832   6.983
  634   HH12  ARG  81          2HH1      ARG  81   9.240  17.359   6.939
  635   HH21  ARG  81          1HH2      ARG  81   6.638  19.117   8.530
  636   HH22  ARG  81          2HH2      ARG  81   8.214  19.232   7.825
  637    H    GLY  82           HN       GLY  82   2.555  13.919  10.405
  638    HA2  GLY  82           2HA      GLY  82   3.932  12.447  12.441
  639    HA3  GLY  82           1HA      GLY  82   2.765  13.732  12.699
  640    H    GLN  83           HN       GLN  83   1.078  11.882  10.757
  641    HA   GLN  83           HA       GLN  83  -0.050  10.267  12.948
  642    HB2  GLN  83           2HB      GLN  83  -1.403  11.303  10.449
  643    HB3  GLN  83           1HB      GLN  83  -2.177  10.390  11.733
  644    HG2  GLN  83           2HG      GLN  83  -0.953  13.124  12.021
  645    HG3  GLN  83           1HG      GLN  83  -2.672  12.781  11.855
  646   HE21  GLN  83          1HE2      GLN  83  -2.537  10.396  13.535
  647   HE22  GLN  83          2HE2      GLN  83  -2.357  10.967  15.157
  648    H    MET  84           HN       MET  84   2.089   9.753  10.771
  649    HA   MET  84           HA       MET  84   0.919   7.236   9.828
  650    HB2  MET  84           2HB      MET  84   0.885   8.865   7.994
  651    HB3  MET  84           1HB      MET  84   2.609   9.132   8.194
  652    HG2  MET  84           2HG      MET  84   2.031   7.670   6.293
  653    HG3  MET  84           1HG      MET  84   3.107   6.918   7.469
  654    HE1  MET  84           3HE      MET  84  -1.410   5.979   7.192
  655    HE2  MET  84           1HE      MET  84  -0.593   7.156   6.165
  656    HE3  MET  84           2HE      MET  84  -0.778   7.469   7.890
  657    H    GLN  85           HN       GLN  85   2.411   5.551   9.424
  658    HA   GLN  85           HA       GLN  85   4.499   5.315  11.298
  659    HB2  GLN  85           2HB      GLN  85   4.007   3.682   8.804
  660    HB3  GLN  85           1HB      GLN  85   5.037   3.218  10.147
  661    HG2  GLN  85           2HG      GLN  85   3.042   3.253  11.616
  662    HG3  GLN  85           1HG      GLN  85   2.053   3.559  10.189
  663   HE21  GLN  85          1HE2      GLN  85   4.023   1.265  11.865
  664   HE22  GLN  85          2HE2      GLN  85   3.526  -0.128  10.976
  665    H    LYS  86           HN       LYS  86   6.727   5.339  11.045
  666    HA   LYS  86           HA       LYS  86   7.737   7.314   9.363
  667    HB2  LYS  86           2HB      LYS  86   8.807   6.724  11.474
  668    HB3  LYS  86           1HB      LYS  86   9.289   5.170  10.816
  669    HG2  LYS  86           2HG      LYS  86  11.142   6.738  10.821
  670    HG3  LYS  86           1HG      LYS  86  10.697   6.292   9.171
  671    HD2  LYS  86           2HD      LYS  86   9.424   8.384   8.965
  672    HD3  LYS  86           1HD      LYS  86   9.895   8.823  10.606
  673    HE2  LYS  86           2HE      LYS  86  11.756   8.392   8.273
  674    HE3  LYS  86           1HE      LYS  86  11.283   9.950   8.947
  675    HZ1  LYS  86           3HZ      LYS  86  13.436   9.290   9.759
  676    HZ2  LYS  86           1HZ      LYS  86  12.816   7.835  10.359
  677    HZ3  LYS  86           2HZ      LYS  86  12.334   9.309  11.038
  678    HA   PRO  87           HA       PRO  87   9.683   3.709   6.587
  679    HB2  PRO  87           2HB      PRO  87   7.441   1.766   6.886
  680    HB3  PRO  87           1HB      PRO  87   9.171   1.463   6.688
  681    HG2  PRO  87           2HG      PRO  87   8.020   1.139   9.057
  682    HG3  PRO  87           1HG      PRO  87   9.633   1.866   8.929
  683    HD2  PRO  87           2HD      PRO  87   6.993   3.183   9.411
  684    HD3  PRO  87           1HD      PRO  87   8.579   3.537  10.122
  685    H    PHE  88           HN       PHE  88   6.236   4.211   7.018
  686    HA   PHE  88           HA       PHE  88   5.603   4.104   4.218
  687    HB2  PHE  88           2HB      PHE  88   4.026   3.544   6.138
  688    HB3  PHE  88           1HB      PHE  88   3.931   5.268   6.456
  689    HD1  PHE  88           2HD      PHE  88   3.034   6.770   4.602
  690    HD2  PHE  88           1HD      PHE  88   2.657   2.535   4.556
  691    HE1  PHE  88           2HE      PHE  88   1.200   6.955   2.980
  692    HE2  PHE  88           1HE      PHE  88   0.820   2.716   2.928
  693    HZ   PHE  88           HZ       PHE  88   0.094   4.935   2.142
  694    H    GLU  89           HN       GLU  89   5.948   6.617   6.685
  695    HA   GLU  89           HA       GLU  89   5.405   8.899   5.179
  696    HB2  GLU  89           2HB      GLU  89   5.638   8.985   7.583
  697    HB3  GLU  89           1HB      GLU  89   7.308   8.453   7.481
  698    HG2  GLU  89           2HG      GLU  89   7.769  10.581   6.201
  699    HG3  GLU  89           1HG      GLU  89   6.156  11.106   6.684
  700    H    ASP  90           HN       ASP  90   8.500   7.350   5.862
  701    HA   ASP  90           HA       ASP  90  10.237   8.988   4.498
  702    HB2  ASP  90           2HB      ASP  90  11.059   7.254   5.928
  703    HB3  ASP  90           1HB      ASP  90  10.302   6.006   4.948
  704    H    ALA  91           HN       ALA  91   8.449   6.207   3.226
  705    HA   ALA  91           HA       ALA  91   9.525   6.419   0.602
  706    HB1  ALA  91           1HB      ALA  91   7.788   4.802  -0.018
  707    HB2  ALA  91           2HB      ALA  91   7.039   5.015   1.566
  708    HB3  ALA  91           3HB      ALA  91   8.649   4.312   1.439
  709    H    SER  92           HN       SER  92   6.509   7.516   2.110
  710    HA   SER  92           HA       SER  92   5.220   8.431  -0.199
  711    HB2  SER  92           2HB      SER  92   5.000   9.472   2.631
  712    HB3  SER  92           1HB      SER  92   3.855   9.805   1.334
  713    HG   SER  92           HG       SER  92   4.462   7.302   2.523
  714    H    PHE  93           HN       PHE  93   7.503  10.060   1.945
  715    HA   PHE  93           HA       PHE  93   7.269  12.552   0.512
  716    HB2  PHE  93           2HB      PHE  93   8.947  11.637   2.828
  717    HB3  PHE  93           1HB      PHE  93   9.252  13.178   2.035
  718    HD1  PHE  93           2HD      PHE  93   6.360  11.258   3.416
  719    HD2  PHE  93           1HD      PHE  93   8.260  15.032   2.936
  720    HE1  PHE  93           2HE      PHE  93   4.598  12.310   4.766
  721    HE2  PHE  93           1HE      PHE  93   6.499  16.091   4.288
  722    HZ   PHE  93           HZ       PHE  93   4.666  14.731   5.202
  723    H    ALA  94           HN       ALA  94   8.791   9.729  -0.174
  724    HA   ALA  94           HA       ALA  94  11.073  11.002  -1.493
  725    HB1  ALA  94           1HB      ALA  94  11.871   8.727  -1.902
  726    HB2  ALA  94           2HB      ALA  94  10.392   8.075  -1.199
  727    HB3  ALA  94           3HB      ALA  94  11.526   8.971  -0.189
  728    H    LEU  95           HN       LEU  95   7.948   9.823  -2.073
  729    HA   LEU  95           HA       LEU  95   8.360   9.269  -4.879
  730    HB2  LEU  95           2HB      LEU  95   5.824   9.383  -3.258
  731    HB3  LEU  95           1HB      LEU  95   5.956   8.807  -4.907
  732    HG   LEU  95           HG       LEU  95   7.203   7.533  -2.477
  733   HD11  LEU  95          1HD1      LEU  95   4.917   6.671  -4.236
  734   HD12  LEU  95          2HD1      LEU  95   4.798   7.248  -2.574
  735   HD13  LEU  95          3HD1      LEU  95   5.619   5.728  -2.923
  736   HD21  LEU  95          3HD2      LEU  95   7.835   5.725  -4.005
  737   HD22  LEU  95          1HD2      LEU  95   8.609   7.244  -4.451
  738   HD23  LEU  95          2HD2      LEU  95   7.220   6.661  -5.366
  739    H    ARG  96           HN       ARG  96   7.335  10.374  -6.551
  740    HA   ARG  96           HA       ARG  96   6.774  13.192  -5.965
  741    HB2  ARG  96           2HB      ARG  96   7.691  11.887  -8.537
  742    HB3  ARG  96           1HB      ARG  96   7.394  13.606  -8.317
  743    HG2  ARG  96           2HG      ARG  96   9.188  13.734  -6.688
  744    HG3  ARG  96           1HG      ARG  96   9.462  11.998  -6.836
  745    HD2  ARG  96           2HD      ARG  96  10.064  12.290  -9.182
  746    HD3  ARG  96           1HD      ARG  96   9.764  14.021  -9.049
  747    HE   ARG  96           HE       ARG  96  11.707  12.930  -7.195
  748   HH11  ARG  96          1HH1      ARG  96  11.154  14.550 -10.253
  749   HH12  ARG  96          2HH1      ARG  96  12.768  15.158 -10.381
  750   HH21  ARG  96          1HH2      ARG  96  13.855  13.733  -7.344
  751   HH22  ARG  96          2HH2      ARG  96  14.315  14.689  -8.714
  752    H    THR  97           HN       THR  97   5.407  14.000  -8.124
  753    HA   THR  97           HA       THR  97   2.805  13.066  -7.665
  754    HB   THR  97           HB       THR  97   3.755  14.541 -10.129
  755    HG1  THR  97           1HG      THR  97   3.175  15.452  -7.488
  756   HG21  THR  97          3HG2      THR  97   1.490  15.488 -10.093
  757   HG22  THR  97          1HG2      THR  97   1.105  14.531  -8.664
  758   HG23  THR  97          2HG2      THR  97   1.431  13.731 -10.200
  759    H    GLY  98           HN       GLY  98   2.044  11.111  -8.197
  760    HA2  GLY  98           2HA      GLY  98   1.329   9.422  -9.602
  761    HA3  GLY  98           1HA      GLY  98   2.183  10.201 -10.927
  762    H    GLU  99           HN       GLU  99   3.848   9.496  -7.965
  763    HA   GLU  99           HA       GLU  99   5.318   7.390  -9.388
  764    HB2  GLU  99           2HB      GLU  99   6.570   9.474  -8.693
  765    HB3  GLU  99           1HB      GLU  99   6.297   8.988  -7.027
  766    HG2  GLU  99           2HG      GLU  99   8.519   8.361  -7.829
  767    HG3  GLU  99           1HG      GLU  99   7.553   6.957  -7.372
  768    H    MET 100           HN       MET 100   5.864   5.487  -8.303
  769    HA   MET 100           HA       MET 100   4.290   4.971  -5.868
  770    HB2  MET 100           2HB      MET 100   3.235   3.980  -7.873
  771    HB3  MET 100           1HB      MET 100   4.709   3.080  -8.186
  772    HG2  MET 100           2HG      MET 100   4.418   1.767  -6.224
  773    HG3  MET 100           1HG      MET 100   3.097   2.791  -5.667
  774    HE1  MET 100           3HE      MET 100   2.782   0.120  -9.414
  775    HE2  MET 100           1HE      MET 100   4.240   0.230  -8.429
  776    HE3  MET 100           2HE      MET 100   3.696   1.626  -9.359
  777    H    SER 101           HN       SER 101   5.221   3.729  -4.301
  778    HA   SER 101           HA       SER 101   8.099   3.394  -4.490
  779    HB2  SER 101           2HB      SER 101   7.918   2.883  -2.058
  780    HB3  SER 101           1HB      SER 101   7.218   4.445  -2.482
  781    HG   SER 101           HG       SER 101   5.962   2.069  -1.695
  782    H    GLY 102           HN       GLY 102   8.852   1.347  -3.141
  783    HA2  GLY 102           2HA      GLY 102   7.744  -0.956  -4.536
  784    HA3  GLY 102           1HA      GLY 102   9.241  -0.910  -3.611
  785    HA   PRO 103           HA       PRO 103   6.044  -3.014  -1.008
  786    HB2  PRO 103           2HB      PRO 103   7.664  -5.029  -0.166
  787    HB3  PRO 103           1HB      PRO 103   6.722  -5.110  -1.656
  788    HG2  PRO 103           2HG      PRO 103   9.617  -4.476  -1.275
  789    HG3  PRO 103           1HG      PRO 103   8.839  -5.456  -2.531
  790    HD2  PRO 103           2HD      PRO 103   9.650  -2.892  -2.934
  791    HD3  PRO 103           1HD      PRO 103   8.277  -3.620  -3.789
  792    H    VAL 104           HN       VAL 104   5.897  -1.610   0.675
  793    HA   VAL 104           HA       VAL 104   8.170  -1.185   2.438
  794    HB   VAL 104           HB       VAL 104   5.332  -0.155   2.695
  795   HG11  VAL 104          1HG1      VAL 104   7.876   0.722   4.059
  796   HG12  VAL 104          2HG1      VAL 104   6.536  -0.145   4.810
  797   HG13  VAL 104          3HG1      VAL 104   6.303   1.502   4.222
  798   HG21  VAL 104          3HG2      VAL 104   6.201   1.963   1.802
  799   HG22  VAL 104          1HG2      VAL 104   6.353   0.650   0.635
  800   HG23  VAL 104          2HG2      VAL 104   7.767   1.198   1.535
  801    H    PHE 105           HN       PHE 105   8.594  -2.842   3.750
  802    HA   PHE 105           HA       PHE 105   6.502  -4.609   4.669
  803    HB2  PHE 105           2HB      PHE 105   9.480  -4.624   5.165
  804    HB3  PHE 105           1HB      PHE 105   8.370  -5.862   5.735
  805    HD1  PHE 105           1HD      PHE 105   7.297  -7.383   4.146
  806    HD2  PHE 105           2HD      PHE 105  10.177  -4.519   2.883
  807    HE1  PHE 105           1HE      PHE 105   7.574  -8.603   2.027
  808    HE2  PHE 105           2HE      PHE 105  10.457  -5.731   0.761
  809    HZ   PHE 105           HZ       PHE 105   9.157  -7.776   0.331
  810    H    THR 106           HN       THR 106   5.439  -4.414   6.483
  811    HA   THR 106           HA       THR 106   6.734  -3.285   8.849
  812    HB   THR 106           HB       THR 106   4.619  -2.065   9.429
  813    HG1  THR 106           1HG      THR 106   3.897  -3.130   6.960
  814   HG21  THR 106          3HG2      THR 106   4.984  -0.138   7.942
  815   HG22  THR 106          1HG2      THR 106   5.947  -1.153   6.868
  816   HG23  THR 106          2HG2      THR 106   6.511  -0.816   8.504
  817    H    ASP 107           HN       ASP 107   5.133  -3.676  10.794
  818    HA   ASP 107           HA       ASP 107   4.588  -6.471  10.863
  819    HB2  ASP 107           2HB      ASP 107   3.956  -4.245  12.806
  820    HB3  ASP 107           1HB      ASP 107   3.556  -5.930  13.115
  821    H    SER 108           HN       SER 108   2.771  -3.713   9.999
  822    HA   SER 108           HA       SER 108   0.183  -4.927  10.342
  823    HB2  SER 108           2HB      SER 108   0.957  -2.429   8.818
  824    HB3  SER 108           1HB      SER 108  -0.673  -2.887   9.309
  825    HG   SER 108           HG       SER 108  -0.291  -2.139  11.231
  826    H    GLY 109           HN       GLY 109   2.640  -5.256   8.104
  827    HA2  GLY 109           2HA      GLY 109   2.121  -7.037   6.421
  828    HA3  GLY 109           1HA      GLY 109   0.753  -6.026   5.968
  829    H    ILE 110           HN       ILE 110   1.775  -6.173   3.818
  830    HA   ILE 110           HA       ILE 110   4.128  -4.444   3.521
  831    HB   ILE 110           HB       ILE 110   2.768  -6.099   1.384
  832   HG12  ILE 110          2HG1      ILE 110   5.201  -6.833   3.030
  833   HG13  ILE 110          1HG1      ILE 110   3.597  -7.515   3.264
  834   HG21  ILE 110          1HG2      ILE 110   5.508  -4.845   1.538
  835   HG22  ILE 110          2HG2      ILE 110   4.160  -4.282   0.552
  836   HG23  ILE 110          3HG2      ILE 110   4.911  -5.841   0.213
  837   HD11  ILE 110          3HD1      ILE 110   5.020  -9.022   2.004
  838   HD12  ILE 110          1HD1      ILE 110   5.288  -7.775   0.787
  839   HD13  ILE 110          2HD1      ILE 110   3.677  -8.458   1.010
  840    H    HIS 111           HN       HIS 111   3.903  -2.415   2.777
  841    HA   HIS 111           HA       HIS 111   1.231  -1.626   1.806
  842    HB2  HIS 111           2HB      HIS 111   3.397   0.175   2.922
  843    HB3  HIS 111           1HB      HIS 111   1.771   0.655   2.474
  844    HD1  HIS 111           1HD      HIS 111   0.070   0.629   4.321
  845    HD2  HIS 111           2HD      HIS 111   3.464  -1.581   5.238
  846    HE1  HIS 111           1HE      HIS 111  -0.168  -0.000   6.737
  847    HE2  HIS 111           2HE      HIS 111   2.012  -1.121   7.313
  848    H    ILE 112           HN       ILE 112   0.991  -0.854  -0.179
  849    HA   ILE 112           HA       ILE 112   3.391  -0.102  -1.717
  850    HB   ILE 112           HB       ILE 112   0.636  -0.691  -2.810
  851   HG12  ILE 112          2HG1      ILE 112   3.032  -2.543  -2.693
  852   HG13  ILE 112          1HG1      ILE 112   1.561  -2.720  -1.744
  853   HG21  ILE 112          1HG2      ILE 112   3.325  -0.481  -4.160
  854   HG22  ILE 112          2HG2      ILE 112   2.028   0.708  -4.233
  855   HG23  ILE 112          3HG2      ILE 112   1.806  -0.881  -4.961
  856   HD11  ILE 112          3HD1      ILE 112   1.597  -4.249  -3.627
  857   HD12  ILE 112          1HD1      ILE 112   1.758  -2.893  -4.742
  858   HD13  ILE 112          2HD1      ILE 112   0.286  -3.081  -3.791
  859    H    ILE 113           HN       ILE 113   3.576   2.013  -2.275
  860    HA   ILE 113           HA       ILE 113   1.312   3.744  -1.533
  861    HB   ILE 113           HB       ILE 113   4.243   4.418  -1.431
  862   HG12  ILE 113          2HG1      ILE 113   2.398   3.813   0.883
  863   HG13  ILE 113          1HG1      ILE 113   3.549   2.664   0.212
  864   HG21  ILE 113          1HG2      ILE 113   1.822   5.882  -0.370
  865   HG22  ILE 113          2HG2      ILE 113   2.795   6.361  -1.760
  866   HG23  ILE 113          3HG2      ILE 113   3.498   6.380  -0.142
  867   HD11  ILE 113          3HD1      ILE 113   4.228   5.309   1.468
  868   HD12  ILE 113          1HD1      ILE 113   5.380   4.147   0.812
  869   HD13  ILE 113          2HD1      ILE 113   4.405   3.723   2.221
  870    H    LEU 114           HN       LEU 114   0.501   4.953  -3.082
  871    HA   LEU 114           HA       LEU 114   2.209   5.735  -5.352
  872    HB2  LEU 114           2HB      LEU 114   0.569   4.092  -6.108
  873    HB3  LEU 114           1HB      LEU 114  -0.728   5.017  -5.385
  874    HG   LEU 114           HG       LEU 114  -0.263   6.855  -7.002
  875   HD11  LEU 114          1HD1      LEU 114   1.546   4.846  -8.318
  876   HD12  LEU 114          2HD1      LEU 114   2.084   6.289  -7.456
  877   HD13  LEU 114          3HD1      LEU 114   1.126   6.446  -8.929
  878   HD21  LEU 114          3HD2      LEU 114  -1.272   5.743  -8.922
  879   HD22  LEU 114          1HD2      LEU 114  -2.027   5.216  -7.417
  880   HD23  LEU 114          2HD2      LEU 114  -0.865   4.171  -8.233
  881    H    ARG 115           HN       ARG 115   2.643   7.828  -5.042
  882    HA   ARG 115           HA       ARG 115   1.025   9.485  -3.392
  883    HB2  ARG 115           2HB      ARG 115   3.430   9.839  -3.523
  884    HB3  ARG 115           1HB      ARG 115   3.300  10.243  -5.230
  885    HG2  ARG 115           2HG      ARG 115   1.978  12.213  -4.684
  886    HG3  ARG 115           1HG      ARG 115   2.050  11.799  -2.973
  887    HD2  ARG 115           2HD      ARG 115   4.448  12.095  -2.964
  888    HD3  ARG 115           1HD      ARG 115   4.447  12.378  -4.705
  889    HE   ARG 115           HE       ARG 115   2.723  14.236  -3.489
  890   HH11  ARG 115          1HH1      ARG 115   6.164  13.507  -3.657
  891   HH12  ARG 115          2HH1      ARG 115   6.645  15.156  -3.460
  892   HH21  ARG 115          1HH2      ARG 115   3.366  16.399  -3.192
  893   HH22  ARG 115          2HH2      ARG 115   5.048  16.813  -3.184
  894    H    THR 116           HN       THR 116  -0.636  10.696  -3.844
  895    HA   THR 116           HA       THR 116  -1.461  11.015  -6.630
  896    HB   THR 116           HB       THR 116  -3.060  11.672  -4.148
  897    HG1  THR 116           1HG      THR 116  -2.870   9.219  -5.587
  898   HG21  THR 116          3HG2      THR 116  -4.977  11.365  -5.637
  899   HG22  THR 116          1HG2      THR 116  -3.891  10.972  -6.971
  900   HG23  THR 116          2HG2      THR 116  -3.887  12.594  -6.277
  901    H    GLU 117           HN       GLU 117  -1.221  12.908  -3.607
  902    HA   GLU 117           HA       GLU 117  -0.563  15.270  -5.195
  903    HB2  GLU 117           2HB      GLU 117  -2.632  15.275  -2.975
  904    HB3  GLU 117           1HB      GLU 117  -2.073  16.680  -3.866
  905    HG2  GLU 117           2HG      GLU 117  -2.996  15.729  -5.930
  906    HG3  GLU 117           1HG      GLU 117  -3.586  14.345  -5.016
  Start of MODEL    9
    1    H1   GLY   1           1HT      GLY   1  10.304  16.388  -3.144
    2    H2   GLY   1           2HT      GLY   1  11.569  15.949  -4.185
    3    H3   GLY   1           3HT      GLY   1  10.367  14.831  -3.805
    4    HA2  GLY   1           1HA      GLY   1  10.081  15.739  -6.034
    5    HA3  GLY   1           2HA      GLY   1   8.721  16.080  -4.974
    6    H    SER   2           HN       SER   2  10.642  18.051  -3.576
    7    HA   SER   2           HA       SER   2  10.760  20.166  -5.560
    8    HB2  SER   2           2HB      SER   2   9.568  21.671  -3.883
    9    HB3  SER   2           1HB      SER   2   8.557  20.498  -4.723
   10    HG   SER   2           HG       SER   2   9.374  19.218  -2.638
   11    H    HIS   3           HN       HIS   3  11.326  22.245  -3.803
   12    HA   HIS   3           HA       HIS   3  13.954  21.407  -2.867
   13    HB2  HIS   3           2HB      HIS   3  12.721  24.160  -3.107
   14    HB3  HIS   3           1HB      HIS   3  14.355  23.848  -2.540
   15    HD1  HIS   3           1HD      HIS   3  16.139  23.714  -4.292
   16    HD2  HIS   3           2HD      HIS   3  12.318  23.402  -5.891
   17    HE1  HIS   3           1HE      HIS   3  16.442  23.773  -6.781
   18    HE2  HIS   3           2HE      HIS   3  14.139  23.397  -7.719
   19    H    MET   4           HN       MET   4  11.084  23.045  -1.601
   20    HA   MET   4           HA       MET   4  12.121  22.932   1.105
   21    HB2  MET   4           2HB      MET   4  10.875  24.920   0.315
   22    HB3  MET   4           1HB      MET   4   9.450  23.919   0.081
   23    HG2  MET   4           2HG      MET   4   9.404  23.442   2.488
   24    HG3  MET   4           1HG      MET   4  10.811  24.481   2.710
   25    HE1  MET   4           3HE      MET   4   7.936  26.600   4.312
   26    HE2  MET   4           1HE      MET   4   9.546  25.919   4.546
   27    HE3  MET   4           2HE      MET   4   8.152  24.851   4.377
   28    H    GLU   5           HN       GLU   5  10.013  21.160  -0.955
   29    HA   GLU   5           HA       GLU   5   8.977  19.188  -0.765
   30    HB2  GLU   5           2HB      GLU   5  10.347  19.103   1.913
   31    HB3  GLU   5           1HB      GLU   5   9.273  17.820   1.374
   32    HG2  GLU   5           2HG      GLU   5  11.753  18.730  -0.067
   33    HG3  GLU   5           1HG      GLU   5  11.632  17.306   0.968
   34    HA   PRO   6           HA       PRO   6   5.106  20.310   1.006
   35    HB2  PRO   6           2HB      PRO   6   4.165  17.574   0.707
   36    HB3  PRO   6           1HB      PRO   6   3.717  19.005  -0.223
   37    HG2  PRO   6           2HG      PRO   6   5.167  16.959  -1.270
   38    HG3  PRO   6           1HG      PRO   6   5.328  18.638  -1.815
   39    HD2  PRO   6           2HD      PRO   6   7.062  17.072   0.053
   40    HD3  PRO   6           1HD      PRO   6   7.519  18.197  -1.244
   41    H    ALA   7           HN       ALA   7   4.145  20.306   2.973
   42    HA   ALA   7           HA       ALA   7   5.313  18.633   5.041
   43    HB1  ALA   7           1HB      ALA   7   4.063  20.053   6.597
   44    HB2  ALA   7           2HB      ALA   7   3.268  20.848   5.238
   45    HB3  ALA   7           3HB      ALA   7   5.007  21.027   5.470
   46    H    ARG   8           HN       ARG   8   2.520  18.840   3.100
   47    HA   ARG   8           HA       ARG   8   1.366  16.505   4.448
   48    HB2  ARG   8           2HB      ARG   8  -0.162  18.916   3.438
   49    HB3  ARG   8           1HB      ARG   8  -0.902  17.414   3.965
   50    HG2  ARG   8           2HG      ARG   8  -0.079  17.768   6.216
   51    HG3  ARG   8           1HG      ARG   8   0.750  19.239   5.701
   52    HD2  ARG   8           2HD      ARG   8  -1.387  20.246   5.109
   53    HD3  ARG   8           1HD      ARG   8  -2.226  18.770   5.574
   54    HE   ARG   8           HE       ARG   8  -0.706  19.672   7.751
   55   HH11  ARG   8          1HH1      ARG   8  -3.521  20.652   5.899
   56   HH12  ARG   8          2HH1      ARG   8  -4.283  21.446   7.233
   57   HH21  ARG   8          1HH2      ARG   8  -1.714  20.734   9.522
   58   HH22  ARG   8          2HH2      ARG   8  -3.251  21.498   9.294
   59    H    VAL   9           HN       VAL   9   0.861  14.909   3.060
   60    HA   VAL   9           HA       VAL   9   0.575  15.573   0.210
   61    HB   VAL   9           HB       VAL   9   1.816  13.528  -0.418
   62   HG11  VAL   9          1HG1      VAL   9   3.412  15.443   1.275
   63   HG12  VAL   9          2HG1      VAL   9   2.994  15.645  -0.428
   64   HG13  VAL   9          3HG1      VAL   9   4.077  14.343   0.068
   65   HG21  VAL   9          3HG2      VAL   9   3.202  12.356   1.222
   66   HG22  VAL   9          1HG2      VAL   9   1.492  12.248   1.639
   67   HG23  VAL   9          2HG2      VAL   9   2.542  13.367   2.508
   68    H    ARG  10           HN       ARG  10  -0.825  14.264  -0.953
   69    HA   ARG  10           HA       ARG  10  -2.529  12.540   0.716
   70    HB2  ARG  10           2HB      ARG  10  -3.778  14.326  -0.354
   71    HB3  ARG  10           1HB      ARG  10  -3.106  13.898  -1.921
   72    HG2  ARG  10           2HG      ARG  10  -4.248  11.712  -1.781
   73    HG3  ARG  10           1HG      ARG  10  -4.981  12.225  -0.261
   74    HD2  ARG  10           2HD      ARG  10  -6.197  13.956  -1.343
   75    HD3  ARG  10           1HD      ARG  10  -5.298  13.736  -2.845
   76    HE   ARG  10           HE       ARG  10  -6.922  11.513  -1.838
   77   HH11  ARG  10          1HH1      ARG  10  -6.513  14.104  -4.195
   78   HH12  ARG  10          2HH1      ARG  10  -7.613  13.390  -5.327
   79   HH21  ARG  10          1HH2      ARG  10  -8.350  10.597  -3.323
   80   HH22  ARG  10          2HH2      ARG  10  -8.668  11.388  -4.837
   81    H    CYS  11           HN       CYS  11  -2.011  10.493   0.577
   82    HA   CYS  11           HA       CYS  11  -1.200   9.466  -2.049
   83    HB2  CYS  11           2HB      CYS  11  -0.127   8.585   0.633
   84    HB3  CYS  11           1HB      CYS  11   0.337   7.937  -0.935
   85    HG   CYS  11           HG       CYS  11   1.383  10.696   0.632
   86    H    SER  12           HN       SER  12  -1.808   7.391  -2.559
   87    HA   SER  12           HA       SER  12  -4.051   6.327  -1.029
   88    HB2  SER  12           2HB      SER  12  -2.981   5.507  -3.747
   89    HB3  SER  12           1HB      SER  12  -4.508   5.001  -3.023
   90    HG   SER  12           HG       SER  12  -3.931   7.736  -3.439
   91    H    HIS  13           HN       HIS  13  -4.016   4.090  -0.380
   92    HA   HIS  13           HA       HIS  13  -1.335   2.909  -0.336
   93    HB2  HIS  13           2HB      HIS  13  -1.457   2.416   2.046
   94    HB3  HIS  13           1HB      HIS  13  -1.581   4.145   1.772
   95    HD1  HIS  13           1HD      HIS  13  -2.685   2.248   4.232
   96    HD2  HIS  13           2HD      HIS  13  -4.882   4.268   1.342
   97    HE1  HIS  13           1HE      HIS  13  -4.960   2.611   5.236
   98    HE2  HIS  13           2HE      HIS  13  -6.306   3.702   3.425
   99    H    LEU  14           HN       LEU  14  -1.217   0.785  -0.441
  100    HA   LEU  14           HA       LEU  14  -3.716  -0.770  -0.346
  101    HB2  LEU  14           2HB      LEU  14  -2.703  -0.400  -2.659
  102    HB3  LEU  14           1HB      LEU  14  -1.322  -1.322  -2.116
  103    HG   LEU  14           HG       LEU  14  -4.097  -2.494  -2.141
  104   HD11  LEU  14          1HD1      LEU  14  -2.054  -2.527  -4.355
  105   HD12  LEU  14          2HD1      LEU  14  -3.627  -1.732  -4.393
  106   HD13  LEU  14          3HD1      LEU  14  -3.529  -3.489  -4.309
  107   HD21  LEU  14          3HD2      LEU  14  -2.882  -4.619  -2.251
  108   HD22  LEU  14          1HD2      LEU  14  -2.417  -3.694  -0.822
  109   HD23  LEU  14          2HD2      LEU  14  -1.349  -3.747  -2.225
  110    H    LEU  15           HN       LEU  15  -3.656  -2.256   1.236
  111    HA   LEU  15           HA       LEU  15  -1.005  -3.166   2.114
  112    HB2  LEU  15           2HB      LEU  15  -1.918  -1.778   3.835
  113    HB3  LEU  15           1HB      LEU  15  -3.453  -2.620   3.777
  114    HG   LEU  15           HG       LEU  15  -2.397  -4.637   4.697
  115   HD11  LEU  15          1HD1      LEU  15  -0.109  -4.556   5.555
  116   HD12  LEU  15          2HD1      LEU  15   0.100  -2.957   4.839
  117   HD13  LEU  15          3HD1      LEU  15  -0.158  -4.360   3.802
  118   HD21  LEU  15          3HD2      LEU  15  -2.008  -3.810   6.945
  119   HD22  LEU  15          1HD2      LEU  15  -3.376  -2.977   6.209
  120   HD23  LEU  15          2HD2      LEU  15  -1.810  -2.172   6.327
  121    H    VAL  16           HN       VAL  16  -0.637  -5.177   1.767
  122    HA   VAL  16           HA       VAL  16  -2.820  -7.110   2.010
  123    HB   VAL  16           HB       VAL  16  -2.398  -6.829  -0.382
  124   HG11  VAL  16          1HG1      VAL  16  -0.158  -5.928  -0.307
  125   HG12  VAL  16          2HG1      VAL  16  -0.221  -7.328  -1.379
  126   HG13  VAL  16          3HG1      VAL  16   0.474  -7.482   0.235
  127   HG21  VAL  16          3HG2      VAL  16  -1.214  -9.404   0.647
  128   HG22  VAL  16          1HG2      VAL  16  -1.807  -9.130  -0.992
  129   HG23  VAL  16          2HG2      VAL  16  -2.924  -9.074   0.372
  130    H    LYS  17           HN       LYS  17  -2.346  -8.708   3.400
  131    HA   LYS  17           HA       LYS  17   0.420  -8.757   4.374
  132    HB2  LYS  17           2HB      LYS  17  -0.416  -9.628   6.467
  133    HB3  LYS  17           1HB      LYS  17  -1.303  -8.175   6.038
  134    HG2  LYS  17           2HG      LYS  17  -3.166  -9.543   5.256
  135    HG3  LYS  17           1HG      LYS  17  -2.268 -11.001   5.681
  136    HD2  LYS  17           2HD      LYS  17  -3.746 -10.611   7.478
  137    HD3  LYS  17           1HD      LYS  17  -2.162 -10.079   8.039
  138    HE2  LYS  17           2HE      LYS  17  -3.793  -8.455   8.710
  139    HE3  LYS  17           1HE      LYS  17  -2.801  -7.748   7.436
  140    HZ1  LYS  17           3HZ      LYS  17  -5.203  -7.331   7.164
  141    HZ2  LYS  17           1HZ      LYS  17  -5.461  -8.992   6.999
  142    HZ3  LYS  17           2HZ      LYS  17  -4.541  -8.160   5.844
  143    H    HIS  18           HN       HIS  18   0.444 -11.154   5.698
  144    HA   HIS  18           HA       HIS  18  -0.200 -13.216   3.792
  145    HB2  HIS  18           2HB      HIS  18   2.164 -14.095   3.765
  146    HB3  HIS  18           1HB      HIS  18   1.930 -12.599   2.882
  147    HD1  HIS  18           1HD      HIS  18   4.385 -14.082   4.831
  148    HD2  HIS  18           2HD      HIS  18   2.602 -10.330   4.958
  149    HE1  HIS  18           1HE      HIS  18   6.042 -12.576   5.978
  150    HE2  HIS  18           2HE      HIS  18   4.878 -10.367   6.192
  151    H    SER  19           HN       SER  19   0.826 -15.398   4.742
  152    HA   SER  19           HA       SER  19  -0.579 -15.850   7.116
  153    HB2  SER  19           2HB      SER  19   0.059 -17.586   5.410
  154    HB3  SER  19           1HB      SER  19   1.699 -17.533   6.051
  155    HG   SER  19           HG       SER  19   0.845 -19.100   7.231
  156    H    GLN  20           HN       GLN  20   2.810 -15.124   6.548
  157    HA   GLN  20           HA       GLN  20   3.533 -15.441   9.307
  158    HB2  GLN  20           2HB      GLN  20   5.077 -14.138   7.050
  159    HB3  GLN  20           1HB      GLN  20   5.723 -14.528   8.633
  160    HG2  GLN  20           2HG      GLN  20   6.489 -16.187   7.122
  161    HG3  GLN  20           1HG      GLN  20   5.259 -16.940   8.134
  162   HE21  GLN  20          1HE2      GLN  20   4.862 -18.535   6.628
  163   HE22  GLN  20          2HE2      GLN  20   4.011 -18.242   5.155
  164    H    SER  21           HN       SER  21   1.814 -14.047  10.066
  165    HA   SER  21           HA       SER  21   2.801 -11.386  10.555
  166    HB2  SER  21           2HB      SER  21   0.127 -11.845   9.196
  167    HB3  SER  21           1HB      SER  21   0.626 -10.315   9.917
  168    HG   SER  21           HG       SER  21   2.559 -11.194   8.299
  169    H    ARG  22           HN       ARG  22   1.486 -10.317  12.257
  170    HA   ARG  22           HA       ARG  22   1.018 -12.170  14.354
  171    HB2  ARG  22           2HB      ARG  22   0.451  -9.207  14.209
  172    HB3  ARG  22           1HB      ARG  22   0.373 -10.174  15.673
  173    HG2  ARG  22           2HG      ARG  22   2.746 -10.673  15.495
  174    HG3  ARG  22           1HG      ARG  22   2.835  -9.754  13.991
  175    HD2  ARG  22           2HD      ARG  22   3.654  -8.431  15.858
  176    HD3  ARG  22           1HD      ARG  22   2.181  -7.728  15.198
  177    HE   ARG  22           HE       ARG  22   1.258  -9.274  17.204
  178   HH11  ARG  22          1HH1      ARG  22   3.752  -6.812  17.050
  179   HH12  ARG  22          2HH1      ARG  22   3.559  -6.323  18.695
  180   HH21  ARG  22          1HH2      ARG  22   0.976  -8.610  19.386
  181   HH22  ARG  22          2HH2      ARG  22   1.967  -7.348  20.032
  182    H    ARG  23           HN       ARG  23  -1.067 -10.396  12.185
  183    HA   ARG  23           HA       ARG  23  -3.306 -12.041  13.109
  184    HB2  ARG  23           2HB      ARG  23  -3.383  -9.055  12.643
  185    HB3  ARG  23           1HB      ARG  23  -4.821 -10.056  12.774
  186    HG2  ARG  23           2HG      ARG  23  -4.247 -10.639  15.050
  187    HG3  ARG  23           1HG      ARG  23  -2.734  -9.741  14.923
  188    HD2  ARG  23           2HD      ARG  23  -5.483  -8.532  14.626
  189    HD3  ARG  23           1HD      ARG  23  -4.527  -8.498  16.107
  190    HE   ARG  23           HE       ARG  23  -2.862  -7.428  14.259
  191   HH11  ARG  23          1HH1      ARG  23  -6.147  -6.685  15.227
  192   HH12  ARG  23          2HH1      ARG  23  -6.003  -5.001  14.873
  193   HH21  ARG  23          1HH2      ARG  23  -2.666  -5.188  13.797
  194   HH22  ARG  23          2HH2      ARG  23  -4.018  -4.145  14.058
  195    HA   PRO  24           HA       PRO  24  -2.974 -12.335   8.544
  196    HB2  PRO  24           2HB      PRO  24  -3.600 -14.945   8.366
  197    HB3  PRO  24           1HB      PRO  24  -1.984 -14.410   8.844
  198    HG2  PRO  24           2HG      PRO  24  -4.244 -15.369  10.555
  199    HG3  PRO  24           1HG      PRO  24  -2.517 -15.758  10.663
  200    HD2  PRO  24           2HD      PRO  24  -3.761 -13.907  12.250
  201    HD3  PRO  24           1HD      PRO  24  -2.038 -13.844  11.832
  202    H    SER  25           HN       SER  25  -5.168 -11.124   9.741
  203    HA   SER  25           HA       SER  25  -7.584 -12.560   9.115
  204    HB2  SER  25           2HB      SER  25  -8.643 -10.381   9.819
  205    HB3  SER  25           1HB      SER  25  -7.623 -11.145  11.040
  206    HG   SER  25           HG       SER  25  -7.187  -8.834   9.525
  207    H    SER  26           HN       SER  26  -9.182 -11.776   7.626
  208    HA   SER  26           HA       SER  26  -8.353  -9.874   5.594
  209    HB2  SER  26           2HB      SER  26  -7.476 -11.931   4.663
  210    HB3  SER  26           1HB      SER  26  -8.982 -12.778   5.000
  211    H    TRP  27           HN       TRP  27 -10.106  -9.068   4.382
  212    HA   TRP  27           HA       TRP  27 -12.731  -9.593   5.564
  213    HB2  TRP  27           2HB      TRP  27 -13.467  -7.535   4.531
  214    HB3  TRP  27           1HB      TRP  27 -11.924  -7.213   5.310
  215    HD1  TRP  27           1HD      TRP  27  -9.767  -6.915   3.617
  216    HE1  TRP  27           1HE      TRP  27  -9.657  -6.060   1.205
  217    HE3  TRP  27           3HE      TRP  27 -14.690  -7.442   2.353
  218    HZ2  TRP  27           2HZ      TRP  27 -11.421  -5.657  -0.956
  219    HZ3  TRP  27           3HZ      TRP  27 -15.396  -6.791   0.087
  220    HH2  TRP  27           2HH      TRP  27 -13.793  -5.918  -1.532
  221    H    ARG  28           HN       ARG  28 -10.818 -10.674   3.157
  222    HA   ARG  28           HA       ARG  28 -12.913 -11.031   1.147
  223    HB2  ARG  28           2HB      ARG  28 -10.023 -11.864   0.982
  224    HB3  ARG  28           1HB      ARG  28 -11.163 -11.669  -0.340
  225    HG2  ARG  28           2HG      ARG  28 -11.165  -9.278  -0.037
  226    HG3  ARG  28           1HG      ARG  28 -10.128  -9.431   1.385
  227    HD2  ARG  28           2HD      ARG  28  -8.789  -8.801  -0.516
  228    HD3  ARG  28           1HD      ARG  28  -8.388 -10.450  -0.034
  229    HE   ARG  28           HE       ARG  28 -10.386 -10.232  -2.112
  230   HH11  ARG  28          1HH1      ARG  28  -6.963 -10.514  -1.404
  231   HH12  ARG  28          2HH1      ARG  28  -6.567 -11.195  -2.945
  232   HH21  ARG  28          1HH2      ARG  28  -9.854 -11.085  -4.180
  233   HH22  ARG  28          2HH2      ARG  28  -8.214 -11.509  -4.529
  234    H    GLN  29           HN       GLN  29 -10.393 -12.966   2.757
  235    HA   GLN  29           HA       GLN  29 -12.211 -15.282   2.595
  236    HB2  GLN  29           2HB      GLN  29 -10.326 -16.725   2.076
  237    HB3  GLN  29           1HB      GLN  29 -10.467 -15.457   0.869
  238    HG2  GLN  29           2HG      GLN  29  -8.634 -14.245   1.875
  239    HG3  GLN  29           1HG      GLN  29  -8.538 -15.421   3.183
  240   HE21  GLN  29          1HE2      GLN  29  -9.114 -16.260  -0.157
  241   HE22  GLN  29          2HE2      GLN  29  -7.605 -17.057  -0.420
  242    H    GLU  30           HN       GLU  30 -11.118 -17.137   3.956
  243    HA   GLU  30           HA       GLU  30 -10.509 -16.023   6.599
  244    HB2  GLU  30           2HB      GLU  30 -11.420 -18.795   5.805
  245    HB3  GLU  30           1HB      GLU  30 -11.164 -18.235   7.448
  246    HG2  GLU  30           2HG      GLU  30 -12.985 -16.680   7.256
  247    HG3  GLU  30           1HG      GLU  30 -13.191 -17.083   5.552
  248    H    LYS  31           HN       LYS  31  -8.753 -16.847   7.769
  249    HA   LYS  31           HA       LYS  31  -6.510 -17.162   7.901
  250    HB2  LYS  31           2HB      LYS  31  -5.813 -19.520   7.661
  251    HB3  LYS  31           1HB      LYS  31  -7.308 -19.338   8.558
  252    HG2  LYS  31           2HG      LYS  31  -8.593 -20.148   6.711
  253    HG3  LYS  31           1HG      LYS  31  -7.187 -20.101   5.645
  254    HD2  LYS  31           2HD      LYS  31  -6.100 -21.828   6.978
  255    HD3  LYS  31           1HD      LYS  31  -7.471 -21.853   8.086
  256    HE2  LYS  31           2HE      LYS  31  -7.585 -22.537   5.151
  257    HE3  LYS  31           1HE      LYS  31  -7.534 -23.707   6.466
  258    HZ1  LYS  31           3HZ      LYS  31  -9.784 -23.417   5.767
  259    HZ2  LYS  31           1HZ      LYS  31  -9.683 -21.738   5.929
  260    HZ3  LYS  31           2HZ      LYS  31  -9.620 -22.727   7.297
  261    H    ILE  32           HN       ILE  32  -5.709 -15.669   6.483
  262    HA   ILE  32           HA       ILE  32  -5.367 -15.949   3.751
  263    HB   ILE  32           HB       ILE  32  -3.712 -14.458   5.783
  264   HG12  ILE  32          2HG1      ILE  32  -5.763 -13.596   3.736
  265   HG13  ILE  32          1HG1      ILE  32  -5.988 -13.656   5.481
  266   HG21  ILE  32          1HG2      ILE  32  -2.264 -14.972   3.903
  267   HG22  ILE  32          2HG2      ILE  32  -2.671 -13.256   3.918
  268   HG23  ILE  32          3HG2      ILE  32  -3.469 -14.341   2.780
  269   HD11  ILE  32          3HD1      ILE  32  -4.056 -11.873   4.026
  270   HD12  ILE  32          1HD1      ILE  32  -4.331 -11.911   5.765
  271   HD13  ILE  32          2HD1      ILE  32  -5.617 -11.384   4.681
  272    H    THR  33           HN       THR  33  -4.429 -17.526   2.701
  273    HA   THR  33           HA       THR  33  -2.145 -18.870   3.928
  274    HB   THR  33           HB       THR  33  -3.824 -19.908   1.644
  275    HG1  THR  33           1HG      THR  33  -4.715 -19.483   4.031
  276   HG21  THR  33          3HG2      THR  33  -1.621 -20.951   1.928
  277   HG22  THR  33          1HG2      THR  33  -2.910 -22.073   2.360
  278   HG23  THR  33          2HG2      THR  33  -1.984 -21.264   3.625
  279    H    ARG  34           HN       ARG  34  -0.653 -17.313   3.266
  280    HA   ARG  34           HA       ARG  34   0.497 -17.850   0.709
  281    HB2  ARG  34           2HB      ARG  34   0.455 -15.621  -0.211
  282    HB3  ARG  34           1HB      ARG  34  -1.203 -16.059   0.164
  283    HG2  ARG  34           2HG      ARG  34  -1.064 -14.736   2.231
  284    HG3  ARG  34           1HG      ARG  34   0.582 -14.272   1.805
  285    HD2  ARG  34           2HD      ARG  34  -0.758 -12.465   1.125
  286    HD3  ARG  34           1HD      ARG  34  -0.406 -13.352  -0.354
  287    HE   ARG  34           HE       ARG  34  -2.660 -14.309  -0.183
  288   HH11  ARG  34          1HH1      ARG  34  -1.983 -11.404   1.691
  289   HH12  ARG  34          2HH1      ARG  34  -3.623 -10.859   1.724
  290   HH21  ARG  34          1HH2      ARG  34  -4.862 -13.603  -0.130
  291   HH22  ARG  34          2HH2      ARG  34  -5.265 -12.137   0.683
  292    H    THR  35           HN       THR  35   2.670 -17.671   0.876
  293    HA   THR  35           HA       THR  35   3.702 -16.847   3.435
  294    HB   THR  35           HB       THR  35   4.560 -18.904   2.301
  295    HG1  THR  35           1HG      THR  35   6.714 -18.492   2.839
  296   HG21  THR  35          3HG2      THR  35   6.163 -18.662   0.453
  297   HG22  THR  35          1HG2      THR  35   5.819 -16.934   0.387
  298   HG23  THR  35          2HG2      THR  35   4.557 -18.100  -0.005
  299    H    LYS  36           HN       LYS  36   6.066 -15.748   3.065
  300    HA   LYS  36           HA       LYS  36   5.498 -13.040   2.519
  301    HB2  LYS  36           2HB      LYS  36   7.207 -13.718   4.110
  302    HB3  LYS  36           1HB      LYS  36   8.131 -14.486   2.830
  303    HG2  LYS  36           2HG      LYS  36   8.674 -12.381   1.858
  304    HG3  LYS  36           1HG      LYS  36   7.561 -11.536   2.940
  305    HD2  LYS  36           2HD      LYS  36   8.910 -12.046   4.844
  306    HD3  LYS  36           1HD      LYS  36   9.922 -13.139   3.905
  307    HE2  LYS  36           2HE      LYS  36   9.688 -10.183   3.375
  308    HE3  LYS  36           1HE      LYS  36  10.944 -10.905   4.379
  309    HZ1  LYS  36           3HZ      LYS  36  11.727 -10.543   2.139
  310    HZ2  LYS  36           1HZ      LYS  36  10.472 -11.480   1.505
  311    HZ3  LYS  36           2HZ      LYS  36  11.667 -12.197   2.465
  312    H    GLU  37           HN       GLU  37   7.194 -15.530   0.690
  313    HA   GLU  37           HA       GLU  37   8.009 -13.933  -1.470
  314    HB2  GLU  37           2HB      GLU  37   7.475 -16.890  -1.219
  315    HB3  GLU  37           1HB      GLU  37   8.039 -16.169  -2.717
  316    HG2  GLU  37           2HG      GLU  37   9.846 -17.174  -1.368
  317    HG3  GLU  37           1HG      GLU  37  10.081 -15.456  -1.680
  318    H    GLU  38           HN       GLU  38   5.076 -15.853  -0.968
  319    HA   GLU  38           HA       GLU  38   3.916 -15.462  -3.483
  320    HB2  GLU  38           2HB      GLU  38   2.712 -15.994  -0.781
  321    HB3  GLU  38           1HB      GLU  38   1.720 -15.822  -2.222
  322    HG2  GLU  38           2HG      GLU  38   3.896 -17.855  -1.821
  323    HG3  GLU  38           1HG      GLU  38   2.162 -18.156  -1.701
  324    H    ALA  39           HN       ALA  39   3.753 -13.515  -0.549
  325    HA   ALA  39           HA       ALA  39   1.858 -11.649  -1.483
  326    HB1  ALA  39           1HB      ALA  39   2.651 -10.212   0.331
  327    HB2  ALA  39           2HB      ALA  39   4.059 -11.253   0.548
  328    HB3  ALA  39           3HB      ALA  39   2.443 -11.873   0.887
  329    H    LEU  40           HN       LEU  40   5.398 -11.675  -1.535
  330    HA   LEU  40           HA       LEU  40   5.799  -9.170  -2.726
  331    HB2  LEU  40           2HB      LEU  40   7.580 -10.475  -1.670
  332    HB3  LEU  40           1HB      LEU  40   7.461 -11.682  -2.934
  333    HG   LEU  40           HG       LEU  40   8.187  -9.958  -4.579
  334   HD11  LEU  40          1HD1      LEU  40   9.232  -7.909  -3.734
  335   HD12  LEU  40          2HD1      LEU  40   8.671  -8.301  -2.108
  336   HD13  LEU  40          3HD1      LEU  40   7.504  -7.961  -3.386
  337   HD21  LEU  40          3HD2      LEU  40   9.779 -11.540  -3.669
  338   HD22  LEU  40          1HD2      LEU  40  10.046 -10.501  -2.271
  339   HD23  LEU  40          2HD2      LEU  40  10.542  -9.963  -3.874
  340    H    GLU  41           HN       GLU  41   5.386 -12.381  -4.150
  341    HA   GLU  41           HA       GLU  41   5.757 -11.722  -6.833
  342    HB2  GLU  41           2HB      GLU  41   4.054 -13.836  -5.531
  343    HB3  GLU  41           1HB      GLU  41   4.274 -13.725  -7.272
  344    HG2  GLU  41           2HG      GLU  41   6.502 -14.057  -5.280
  345    HG3  GLU  41           1HG      GLU  41   5.753 -15.371  -6.190
  346    H    LEU  42           HN       LEU  42   2.884 -11.531  -4.814
  347    HA   LEU  42           HA       LEU  42   1.099 -10.797  -6.888
  348    HB2  LEU  42           2HB      LEU  42   0.961 -10.282  -3.918
  349    HB3  LEU  42           1HB      LEU  42  -0.356  -9.997  -5.037
  350    HG   LEU  42           HG       LEU  42   0.868 -12.691  -4.428
  351   HD11  LEU  42          1HD1      LEU  42  -1.768 -11.488  -3.596
  352   HD12  LEU  42          2HD1      LEU  42  -0.388 -11.807  -2.544
  353   HD13  LEU  42          3HD1      LEU  42  -1.251 -13.148  -3.299
  354   HD21  LEU  42          3HD2      LEU  42  -1.045 -13.574  -5.700
  355   HD22  LEU  42          1HD2      LEU  42   0.016 -12.585  -6.704
  356   HD23  LEU  42          2HD2      LEU  42  -1.512 -11.927  -6.121
  357    H    ILE  43           HN       ILE  43   2.959  -8.934  -4.516
  358    HA   ILE  43           HA       ILE  43   2.090  -6.368  -5.119
  359    HB   ILE  43           HB       ILE  43   4.884  -7.226  -4.330
  360   HG12  ILE  43          2HG1      ILE  43   3.149  -7.930  -2.738
  361   HG13  ILE  43          1HG1      ILE  43   4.193  -6.693  -2.049
  362   HG21  ILE  43          1HG2      ILE  43   3.589  -4.504  -4.184
  363   HG22  ILE  43          2HG2      ILE  43   4.913  -4.978  -5.248
  364   HG23  ILE  43          3HG2      ILE  43   5.160  -4.924  -3.502
  365   HD11  ILE  43          3HD1      ILE  43   1.884  -6.309  -1.456
  366   HD12  ILE  43          1HD1      ILE  43   1.428  -6.271  -3.158
  367   HD13  ILE  43          2HD1      ILE  43   2.474  -5.015  -2.498
  368    H    ASN  44           HN       ASN  44   4.902  -8.066  -6.480
  369    HA   ASN  44           HA       ASN  44   5.640  -6.083  -8.306
  370    HB2  ASN  44           2HB      ASN  44   6.045  -9.071  -8.368
  371    HB3  ASN  44           1HB      ASN  44   6.747  -7.985  -9.563
  372   HD21  ASN  44          1HD2      ASN  44   8.041  -9.737  -7.619
  373   HD22  ASN  44          2HD2      ASN  44   9.052  -8.711  -6.665
  374    H    GLY  45           HN       GLY  45   3.402  -8.793  -8.632
  375    HA2  GLY  45           2HA      GLY  45   2.845  -8.507 -11.372
  376    HA3  GLY  45           1HA      GLY  45   1.769  -9.233 -10.184
  377    H    TYR  46           HN       TYR  46   1.242  -7.122  -8.522
  378    HA   TYR  46           HA       TYR  46  -0.787  -5.728  -9.865
  379    HB2  TYR  46           2HB      TYR  46   0.623  -4.946  -7.299
  380    HB3  TYR  46           1HB      TYR  46  -0.912  -4.300  -7.853
  381    HD1  TYR  46           1HD      TYR  46  -1.965  -7.079  -8.837
  382    HD2  TYR  46           2HD      TYR  46  -0.204  -5.733  -5.203
  383    HE1  TYR  46           1HE      TYR  46  -3.134  -8.862  -7.614
  384    HE2  TYR  46           2HE      TYR  46  -1.364  -7.515  -3.975
  385    HH   TYR  46           HH       TYR  46  -2.882 -10.120  -5.514
  386    H    ILE  47           HN       ILE  47   2.417  -4.655  -8.803
  387    HA   ILE  47           HA       ILE  47   2.331  -2.029  -9.684
  388    HB   ILE  47           HB       ILE  47   4.693  -3.913  -9.535
  389   HG12  ILE  47          2HG1      ILE  47   3.746  -1.743  -7.648
  390   HG13  ILE  47          1HG1      ILE  47   3.508  -3.471  -7.408
  391   HG21  ILE  47          1HG2      ILE  47   4.695  -0.912  -9.869
  392   HG22  ILE  47          2HG2      ILE  47   5.237  -2.099 -11.056
  393   HG23  ILE  47          3HG2      ILE  47   6.115  -1.904  -9.539
  394   HD11  ILE  47          3HD1      ILE  47   5.344  -2.647  -6.064
  395   HD12  ILE  47          1HD1      ILE  47   6.155  -2.044  -7.509
  396   HD13  ILE  47          2HD1      ILE  47   5.928  -3.778  -7.284
  397    H    GLN  48           HN       GLN  48   3.359  -4.924 -11.470
  398    HA   GLN  48           HA       GLN  48   4.164  -3.613 -13.813
  399    HB2  GLN  48           2HB      GLN  48   3.022  -6.392 -13.500
  400    HB3  GLN  48           1HB      GLN  48   3.823  -5.797 -14.944
  401    HG2  GLN  48           2HG      GLN  48   5.054  -6.196 -12.225
  402    HG3  GLN  48           1HG      GLN  48   5.341  -7.157 -13.674
  403   HE21  GLN  48          1HE2      GLN  48   6.063  -4.230 -11.985
  404   HE22  GLN  48          2HE2      GLN  48   7.321  -3.687 -13.037
  405    H    LYS  49           HN       LYS  49   0.987  -4.876 -12.868
  406    HA   LYS  49           HA       LYS  49  -0.258  -4.311 -15.363
  407    HB2  LYS  49           2HB      LYS  49  -1.438  -4.797 -12.630
  408    HB3  LYS  49           1HB      LYS  49  -2.387  -4.644 -14.101
  409    HG2  LYS  49           2HG      LYS  49  -1.224  -6.602 -15.029
  410    HG3  LYS  49           1HG      LYS  49  -0.336  -6.768 -13.513
  411    HD2  LYS  49           2HD      LYS  49  -2.397  -7.131 -12.300
  412    HD3  LYS  49           1HD      LYS  49  -3.342  -6.834 -13.759
  413    HE2  LYS  49           2HE      LYS  49  -2.255  -8.798 -14.808
  414    HE3  LYS  49           1HE      LYS  49  -1.428  -9.113 -13.282
  415    HZ1  LYS  49           3HZ      LYS  49  -3.427 -10.457 -13.544
  416    HZ2  LYS  49           1HZ      LYS  49  -4.373  -9.064 -13.649
  417    HZ3  LYS  49           2HZ      LYS  49  -3.555  -9.433 -12.213
  418    H    ILE  50           HN       ILE  50   0.001  -2.523 -12.332
  419    HA   ILE  50           HA       ILE  50  -1.825  -0.475 -13.078
  420    HB   ILE  50           HB       ILE  50   0.393  -0.401 -11.015
  421   HG12  ILE  50          2HG1      ILE  50  -2.574  -0.921 -10.693
  422   HG13  ILE  50          1HG1      ILE  50  -1.323  -2.157 -10.649
  423   HG21  ILE  50          1HG2      ILE  50  -1.981   1.435 -11.378
  424   HG22  ILE  50          2HG2      ILE  50  -0.291   1.852 -11.666
  425   HG23  ILE  50          3HG2      ILE  50  -0.841   1.482 -10.033
  426   HD11  ILE  50          3HD1      ILE  50  -0.360  -1.099  -8.667
  427   HD12  ILE  50          1HD1      ILE  50  -2.044  -1.558  -8.414
  428   HD13  ILE  50          2HD1      ILE  50  -1.627   0.127  -8.717
  429    H    LYS  51           HN       LYS  51   1.688  -0.793 -13.325
  430    HA   LYS  51           HA       LYS  51   2.180   1.853 -14.193
  431    HB2  LYS  51           2HB      LYS  51   3.784  -0.679 -14.526
  432    HB3  LYS  51           1HB      LYS  51   4.361   0.910 -15.009
  433    HG2  LYS  51           2HG      LYS  51   3.507   0.240 -12.203
  434    HG3  LYS  51           1HG      LYS  51   5.168   0.099 -12.777
  435    HD2  LYS  51           2HD      LYS  51   3.696   2.680 -13.140
  436    HD3  LYS  51           1HD      LYS  51   4.360   2.274 -11.559
  437    HE2  LYS  51           2HE      LYS  51   5.932   3.626 -12.821
  438    HE3  LYS  51           1HE      LYS  51   6.580   2.014 -12.557
  439    HZ1  LYS  51           3HZ      LYS  51   6.958   2.846 -14.812
  440    HZ2  LYS  51           1HZ      LYS  51   5.293   2.929 -15.076
  441    HZ3  LYS  51           2HZ      LYS  51   6.044   1.433 -14.818
  442    H    SER  52           HN       SER  52   1.318  -1.076 -15.916
  443    HA   SER  52           HA       SER  52   1.847   0.078 -18.490
  444    HB2  SER  52           2HB      SER  52   0.616  -2.051 -19.255
  445    HB3  SER  52           1HB      SER  52   2.159  -2.244 -18.425
  446    HG   SER  52           HG       SER  52   1.183  -3.123 -16.769
  447    H    GLY  53           HN       GLY  53  -0.604   0.467 -16.272
  448    HA2  GLY  53           2HA      GLY  53  -2.506   1.785 -16.483
  449    HA3  GLY  53           1HA      GLY  53  -2.251   1.825 -18.221
  450    H    GLU  54           HN       GLU  54  -2.232  -1.234 -16.691
  451    HA   GLU  54           HA       GLU  54  -4.613  -1.999 -18.135
  452    HB2  GLU  54           2HB      GLU  54  -2.770  -3.570 -16.328
  453    HB3  GLU  54           1HB      GLU  54  -4.097  -4.252 -17.255
  454    HG2  GLU  54           2HG      GLU  54  -1.747  -2.824 -18.467
  455    HG3  GLU  54           1HG      GLU  54  -1.856  -4.572 -18.267
  456    H    GLU  55           HN       GLU  55  -3.596  -2.688 -14.828
  457    HA   GLU  55           HA       GLU  55  -6.377  -2.539 -13.976
  458    HB2  GLU  55           2HB      GLU  55  -3.917  -3.859 -12.923
  459    HB3  GLU  55           1HB      GLU  55  -5.189  -3.437 -11.790
  460    HG2  GLU  55           2HG      GLU  55  -5.272  -5.782 -12.662
  461    HG3  GLU  55           1HG      GLU  55  -6.753  -4.855 -12.868
  462    H    ASP  56           HN       ASP  56  -7.023  -1.299 -12.209
  463    HA   ASP  56           HA       ASP  56  -5.422   1.110 -11.858
  464    HB2  ASP  56           2HB      ASP  56  -8.303   0.458 -11.302
  465    HB3  ASP  56           1HB      ASP  56  -7.549   1.910 -10.660
  466    H    PHE  57           HN       PHE  57  -4.711   1.875  -9.942
  467    HA   PHE  57           HA       PHE  57  -3.980   0.056  -7.948
  468    HB2  PHE  57           2HB      PHE  57  -2.838   2.226  -8.375
  469    HB3  PHE  57           1HB      PHE  57  -4.230   3.066  -7.705
  470    HD1  PHE  57           2HD      PHE  57  -4.651   3.062  -5.308
  471    HD2  PHE  57           1HD      PHE  57  -1.283   1.045  -6.951
  472    HE1  PHE  57           2HE      PHE  57  -3.648   2.911  -3.068
  473    HE2  PHE  57           1HE      PHE  57  -0.280   0.893  -4.714
  474    HZ   PHE  57           HZ       PHE  57  -1.460   1.827  -2.768
  475    H    GLU  58           HN       GLU  58  -6.646   2.357  -8.134
  476    HA   GLU  58           HA       GLU  58  -7.648   2.021  -5.542
  477    HB2  GLU  58           2HB      GLU  58  -9.116   2.725  -8.076
  478    HB3  GLU  58           1HB      GLU  58  -9.771   2.889  -6.455
  479    HG2  GLU  58           2HG      GLU  58  -7.947   4.472  -5.931
  480    HG3  GLU  58           1HG      GLU  58  -7.426   4.366  -7.615
  481    H    SER  59           HN       SER  59  -8.406   0.315  -8.551
  482    HA   SER  59           HA       SER  59 -10.518  -1.242  -7.554
  483    HB2  SER  59           2HB      SER  59  -9.993  -0.941  -9.976
  484    HB3  SER  59           1HB      SER  59  -8.577  -1.967  -9.764
  485    HG   SER  59           HG       SER  59 -11.282  -2.719  -9.321
  486    H    LEU  60           HN       LEU  60  -7.045  -1.791  -7.687
  487    HA   LEU  60           HA       LEU  60  -7.198  -4.425  -6.640
  488    HB2  LEU  60           2HB      LEU  60  -4.981  -2.501  -7.195
  489    HB3  LEU  60           1HB      LEU  60  -4.656  -3.912  -6.214
  490    HG   LEU  60           HG       LEU  60  -5.201  -5.397  -8.036
  491   HD11  LEU  60          1HD1      LEU  60  -5.904  -2.952  -9.646
  492   HD12  LEU  60          2HD1      LEU  60  -7.052  -4.129  -9.009
  493   HD13  LEU  60          3HD1      LEU  60  -5.876  -4.619 -10.226
  494   HD21  LEU  60          3HD2      LEU  60  -3.490  -4.765  -9.655
  495   HD22  LEU  60          1HD2      LEU  60  -2.950  -4.503  -7.998
  496   HD23  LEU  60          2HD2      LEU  60  -3.461  -3.133  -8.986
  497    H    ALA  61           HN       ALA  61  -6.636  -1.243  -5.251
  498    HA   ALA  61           HA       ALA  61  -6.000  -2.190  -2.645
  499    HB1  ALA  61           1HB      ALA  61  -6.250   0.129  -1.944
  500    HB2  ALA  61           2HB      ALA  61  -7.009   0.525  -3.485
  501    HB3  ALA  61           3HB      ALA  61  -5.318   0.028  -3.438
  502    H    SER  62           HN       SER  62  -8.928  -1.781  -4.347
  503    HA   SER  62           HA       SER  62 -10.499  -1.838  -1.889
  504    HB2  SER  62           2HB      SER  62 -11.415  -1.419  -4.733
  505    HB3  SER  62           1HB      SER  62 -12.403  -1.248  -3.280
  506    HG   SER  62           HG       SER  62 -10.218   0.331  -4.133
  507    H    GLN  63           HN       GLN  63  -9.018  -4.079  -3.515
  508    HA   GLN  63           HA       GLN  63 -11.131  -6.026  -3.048
  509    HB2  GLN  63           2HB      GLN  63  -9.735  -5.618  -5.672
  510    HB3  GLN  63           1HB      GLN  63 -10.367  -7.195  -5.227
  511    HG2  GLN  63           2HG      GLN  63 -12.601  -6.287  -5.049
  512    HG3  GLN  63           1HG      GLN  63 -11.992  -4.667  -5.377
  513   HE21  GLN  63          1HE2      GLN  63 -10.138  -5.516  -7.406
  514   HE22  GLN  63          2HE2      GLN  63 -11.072  -5.926  -8.797
  515    H    PHE  64           HN       PHE  64  -7.871  -6.116  -4.496
  516    HA   PHE  64           HA       PHE  64  -7.217  -8.564  -3.271
  517    HB2  PHE  64           2HB      PHE  64  -5.414  -6.449  -4.446
  518    HB3  PHE  64           1HB      PHE  64  -4.880  -8.053  -3.961
  519    HD1  PHE  64           2HD      PHE  64  -5.889 -10.058  -5.131
  520    HD2  PHE  64           1HD      PHE  64  -6.354  -6.080  -6.535
  521    HE1  PHE  64           2HE      PHE  64  -6.479 -10.917  -7.360
  522    HE2  PHE  64           1HE      PHE  64  -6.948  -6.926  -8.767
  523    HZ   PHE  64           HZ       PHE  64  -7.007  -9.349  -9.181
  524    H    SER  65           HN       SER  65  -6.717  -5.248  -2.269
  525    HA   SER  65           HA       SER  65  -4.933  -5.741  -0.148
  526    HB2  SER  65           2HB      SER  65  -5.418  -3.487  -1.095
  527    HB3  SER  65           1HB      SER  65  -7.017  -3.547  -0.361
  528    HG   SER  65           HG       SER  65  -4.897  -4.043   1.356
  529    H    ASP  66           HN       ASP  66  -5.311  -7.032   1.514
  530    HA   ASP  66           HA       ASP  66  -8.016  -7.676   2.327
  531    HB2  ASP  66           2HB      ASP  66  -6.867  -9.299   3.871
  532    HB3  ASP  66           1HB      ASP  66  -6.522  -9.540   2.165
  533    H    ALA  67           HN       ALA  67  -6.904  -4.997   2.854
  534    HA   ALA  67           HA       ALA  67  -7.151  -4.998   5.783
  535    HB1  ALA  67           1HB      ALA  67  -4.888  -4.402   5.050
  536    HB2  ALA  67           2HB      ALA  67  -5.698  -3.063   5.862
  537    HB3  ALA  67           3HB      ALA  67  -5.557  -3.073   4.104
  538    H    SER  68           HN       SER  68  -7.527  -2.432   6.345
  539    HA   SER  68           HA       SER  68 -10.217  -1.999   5.547
  540    HB2  SER  68           2HB      SER  68  -9.884   0.127   6.971
  541    HB3  SER  68           1HB      SER  68  -9.759  -1.440   7.772
  542    HG   SER  68           HG       SER  68  -8.023  -0.199   8.403
  543    H    SER  69           HN       SER  69  -7.374  -1.225   4.017
  544    HA   SER  69           HA       SER  69  -7.776   1.365   3.049
  545    HB2  SER  69           2HB      SER  69  -6.493  -0.967   1.602
  546    HB3  SER  69           1HB      SER  69  -6.252   0.742   1.240
  547    HG   SER  69           HG       SER  69  -5.769  -0.054   3.863
  548    H    ALA  70           HN       ALA  70  -9.141  -1.701   2.070
  549    HA   ALA  70           HA       ALA  70 -10.266  -0.860  -0.375
  550    HB1  ALA  70           1HB      ALA  70 -11.045  -3.165   1.402
  551    HB2  ALA  70           2HB      ALA  70  -9.808  -3.204   0.145
  552    HB3  ALA  70           3HB      ALA  70 -11.500  -2.960  -0.289
  553    H    LYS  71           HN       LYS  71 -11.063   0.066   2.697
  554    HA   LYS  71           HA       LYS  71 -13.941   0.221   2.176
  555    HB2  LYS  71           2HB      LYS  71 -12.437   0.929   4.695
  556    HB3  LYS  71           1HB      LYS  71 -14.177   0.758   4.519
  557    HG2  LYS  71           2HG      LYS  71 -12.168  -1.465   4.196
  558    HG3  LYS  71           1HG      LYS  71 -13.142  -1.167   5.635
  559    HD2  LYS  71           2HD      LYS  71 -14.291  -1.717   2.900
  560    HD3  LYS  71           1HD      LYS  71 -14.027  -2.955   4.126
  561    HE2  LYS  71           2HE      LYS  71 -15.787  -0.521   4.431
  562    HE3  LYS  71           1HE      LYS  71 -16.347  -2.158   4.104
  563    HZ1  LYS  71           3HZ      LYS  71 -16.548  -1.645   6.439
  564    HZ2  LYS  71           1HZ      LYS  71 -14.904  -1.270   6.545
  565    HZ3  LYS  71           2HZ      LYS  71 -15.393  -2.856   6.223
  566    H    ALA  72           HN       ALA  72 -11.401   1.996   1.347
  567    HA   ALA  72           HA       ALA  72 -12.941   4.478   1.392
  568    HB1  ALA  72           1HB      ALA  72 -11.072   5.795   2.234
  569    HB2  ALA  72           2HB      ALA  72 -10.107   4.331   2.418
  570    HB3  ALA  72           3HB      ALA  72 -11.547   4.567   3.409
  571    H    ARG  73           HN       ARG  73 -12.011   2.468  -0.618
  572    HA   ARG  73           HA       ARG  73 -11.231   2.404  -2.763
  573    HB2  ARG  73           2HB      ARG  73 -11.408   5.399  -2.430
  574    HB3  ARG  73           1HB      ARG  73 -10.928   4.640  -3.939
  575    HG2  ARG  73           2HG      ARG  73 -13.070   3.568  -4.135
  576    HG3  ARG  73           1HG      ARG  73 -13.553   4.166  -2.545
  577    HD2  ARG  73           2HD      ARG  73 -14.479   5.478  -4.452
  578    HD3  ARG  73           1HD      ARG  73 -13.527   6.431  -3.319
  579    HE   ARG  73           HE       ARG  73 -11.770   5.638  -5.299
  580   HH11  ARG  73          1HH1      ARG  73 -14.745   7.499  -5.188
  581   HH12  ARG  73          2HH1      ARG  73 -14.289   8.532  -6.495
  582   HH21  ARG  73          1HH2      ARG  73 -11.170   6.982  -7.008
  583   HH22  ARG  73          2HH2      ARG  73 -12.243   8.239  -7.548
  584    H    GLY  74           HN       GLY  74  -9.356   2.701  -0.369
  585    HA2  GLY  74           2HA      GLY  74  -7.066   2.396  -0.213
  586    HA3  GLY  74           1HA      GLY  74  -6.929   2.760  -1.927
  587    H    ASP  75           HN       ASP  75  -8.731   5.179  -0.638
  588    HA   ASP  75           HA       ASP  75  -6.577   7.069  -0.857
  589    HB2  ASP  75           2HB      ASP  75  -9.004   7.428  -1.563
  590    HB3  ASP  75           1HB      ASP  75  -9.378   7.605   0.144
  591    H    LEU  76           HN       LEU  76  -5.206   7.501   0.758
  592    HA   LEU  76           HA       LEU  76  -5.950   6.904   3.506
  593    HB2  LEU  76           2HB      LEU  76  -3.682   6.376   2.353
  594    HB3  LEU  76           1HB      LEU  76  -3.329   8.073   2.581
  595    HG   LEU  76           HG       LEU  76  -4.018   6.252   4.884
  596   HD11  LEU  76          1HD1      LEU  76  -1.292   6.898   3.773
  597   HD12  LEU  76          2HD1      LEU  76  -2.084   5.323   3.741
  598   HD13  LEU  76          3HD1      LEU  76  -1.612   6.041   5.281
  599   HD21  LEU  76          3HD2      LEU  76  -2.538   8.880   4.737
  600   HD22  LEU  76          1HD2      LEU  76  -2.841   7.942   6.201
  601   HD23  LEU  76          2HD2      LEU  76  -4.189   8.654   5.316
  602    H    GLY  77           HN       GLY  77  -5.427   9.581   1.369
  603    HA2  GLY  77           2HA      GLY  77  -6.459  11.681   1.714
  604    HA3  GLY  77           1HA      GLY  77  -6.407  11.391   3.446
  605    H    ALA  78           HN       ALA  78  -5.609  13.745   2.935
  606    HA   ALA  78           HA       ALA  78  -2.773  13.838   2.352
  607    HB1  ALA  78           1HB      ALA  78  -3.016  16.254   2.599
  608    HB2  ALA  78           2HB      ALA  78  -4.671  16.038   3.164
  609    HB3  ALA  78           3HB      ALA  78  -4.244  15.610   1.508
  610    H    PHE  79           HN       PHE  79  -1.457  13.197   3.906
  611    HA   PHE  79           HA       PHE  79  -2.097  14.000   6.661
  612    HB2  PHE  79           2HB      PHE  79  -0.867  12.010   7.440
  613    HB3  PHE  79           1HB      PHE  79  -2.234  11.577   6.425
  614    HD1  PHE  79           1HD      PHE  79  -1.769  10.967   3.996
  615    HD2  PHE  79           2HD      PHE  79   1.288  11.262   6.943
  616    HE1  PHE  79           1HE      PHE  79  -0.289   9.596   2.592
  617    HE2  PHE  79           2HE      PHE  79   2.774   9.893   5.540
  618    HZ   PHE  79           HZ       PHE  79   1.986   9.059   3.363
  619    H    SER  80           HN       SER  80  -0.193  14.267   8.073
  620    HA   SER  80           HA       SER  80   1.968  15.574   6.582
  621    HB2  SER  80           2HB      SER  80   0.501  17.006   8.073
  622    HB3  SER  80           1HB      SER  80   1.135  16.100   9.445
  623    HG   SER  80           HG       SER  80   2.763  17.488   7.576
  624    H    ARG  81           HN       ARG  81   4.056  15.642   7.945
  625    HA   ARG  81           HA       ARG  81   4.812  12.924   8.451
  626    HB2  ARG  81           2HB      ARG  81   6.329  15.521   8.633
  627    HB3  ARG  81           1HB      ARG  81   7.051  13.955   8.974
  628    HG2  ARG  81           2HG      ARG  81   6.699  13.228   6.731
  629    HG3  ARG  81           1HG      ARG  81   5.748  14.666   6.363
  630    HD2  ARG  81           2HD      ARG  81   8.658  14.667   7.141
  631    HD3  ARG  81           1HD      ARG  81   8.054  14.774   5.488
  632    HE   ARG  81           HE       ARG  81   7.001  16.783   7.267
  633   HH11  ARG  81          1HH1      ARG  81   9.597  15.958   5.061
  634   HH12  ARG  81          2HH1      ARG  81  10.035  17.599   4.757
  635   HH21  ARG  81          1HH2      ARG  81   7.559  18.963   6.846
  636   HH22  ARG  81          2HH2      ARG  81   8.863  19.321   5.767
  637    H    GLY  82           HN       GLY  82   5.635  12.065  10.350
  638    HA2  GLY  82           2HA      GLY  82   6.014  11.959  12.654
  639    HA3  GLY  82           1HA      GLY  82   5.306  13.562  12.828
  640    H    GLN  83           HN       GLN  83   3.585  11.324  10.901
  641    HA   GLN  83           HA       GLN  83   1.724  10.843  13.143
  642    HB2  GLN  83           2HB      GLN  83   0.963  11.424  10.278
  643    HB3  GLN  83           1HB      GLN  83  -0.150  11.085  11.594
  644    HG2  GLN  83           2HG      GLN  83   0.668  13.135  12.735
  645    HG3  GLN  83           1HG      GLN  83   1.635  13.489  11.304
  646   HE21  GLN  83          1HE2      GLN  83  -0.425  12.429   9.503
  647   HE22  GLN  83          2HE2      GLN  83  -1.692  13.607   9.469
  648    H    MET  84           HN       MET  84   3.167   9.665  10.182
  649    HA   MET  84           HA       MET  84   1.765   7.101  10.523
  650    HB2  MET  84           2HB      MET  84   1.766   8.454   8.316
  651    HB3  MET  84           1HB      MET  84   3.424   7.907   8.145
  652    HG2  MET  84           2HG      MET  84   1.944   6.491   6.886
  653    HG3  MET  84           1HG      MET  84   2.656   5.583   8.219
  654    HE1  MET  84           3HE      MET  84  -0.527   7.441   6.896
  655    HE2  MET  84           1HE      MET  84  -0.290   8.224   8.459
  656    HE3  MET  84           2HE      MET  84  -1.683   7.175   8.202
  657    H    GLN  85           HN       GLN  85   3.139   5.139   9.975
  658    HA   GLN  85           HA       GLN  85   5.396   4.986  11.639
  659    HB2  GLN  85           2HB      GLN  85   4.521   3.184   9.368
  660    HB3  GLN  85           1HB      GLN  85   5.835   2.802  10.466
  661    HG2  GLN  85           2HG      GLN  85   3.936   1.606  11.215
  662    HG3  GLN  85           1HG      GLN  85   4.180   2.935  12.345
  663   HE21  GLN  85          1HE2      GLN  85   2.059   2.888  13.031
  664   HE22  GLN  85          2HE2      GLN  85   0.750   3.444  12.050
  665    H    LYS  86           HN       LYS  86   7.560   5.197  11.252
  666    HA   LYS  86           HA       LYS  86   8.368   7.045   9.387
  667    HB2  LYS  86           2HB      LYS  86   9.601   6.242  11.493
  668    HB3  LYS  86           1HB      LYS  86  10.320   5.025  10.448
  669    HG2  LYS  86           2HG      LYS  86  11.130   6.836   8.971
  670    HG3  LYS  86           1HG      LYS  86  10.516   8.007  10.136
  671    HD2  LYS  86           2HD      LYS  86  11.996   7.009  11.849
  672    HD3  LYS  86           1HD      LYS  86  12.655   5.935  10.612
  673    HE2  LYS  86           2HE      LYS  86  12.771   8.953  10.613
  674    HE3  LYS  86           1HE      LYS  86  14.114   7.858  10.935
  675    HZ1  LYS  86           3HZ      LYS  86  14.179   8.682   8.663
  676    HZ2  LYS  86           1HZ      LYS  86  12.627   8.072   8.363
  677    HZ3  LYS  86           2HZ      LYS  86  13.914   7.015   8.674
  678    HA   PRO  87           HA       PRO  87  10.243   3.484   6.534
  679    HB2  PRO  87           2HB      PRO  87   8.238   1.357   7.093
  680    HB3  PRO  87           1HB      PRO  87   9.973   1.214   6.784
  681    HG2  PRO  87           2HG      PRO  87   9.021   0.895   9.240
  682    HG3  PRO  87           1HG      PRO  87  10.540   1.769   8.968
  683    HD2  PRO  87           2HD      PRO  87   7.811   2.848   9.552
  684    HD3  PRO  87           1HD      PRO  87   9.387   3.374  10.176
  685    H    PHE  88           HN       PHE  88   6.888   4.067   7.208
  686    HA   PHE  88           HA       PHE  88   6.120   3.695   4.407
  687    HB2  PHE  88           2HB      PHE  88   4.677   2.750   6.204
  688    HB3  PHE  88           1HB      PHE  88   4.422   4.372   6.828
  689    HD1  PHE  88           1HD      PHE  88   3.208   6.047   5.357
  690    HD2  PHE  88           2HD      PHE  88   3.340   1.884   4.491
  691    HE1  PHE  88           1HE      PHE  88   1.247   6.294   3.897
  692    HE2  PHE  88           2HE      PHE  88   1.379   2.129   3.024
  693    HZ   PHE  88           HZ       PHE  88   0.332   4.334   2.727
  694    H    GLU  89           HN       GLU  89   6.289   6.138   6.931
  695    HA   GLU  89           HA       GLU  89   5.118   8.251   5.483
  696    HB2  GLU  89           2HB      GLU  89   5.482   8.037   7.995
  697    HB3  GLU  89           1HB      GLU  89   7.136   8.542   7.695
  698    HG2  GLU  89           2HG      GLU  89   6.416  10.662   6.880
  699    HG3  GLU  89           1HG      GLU  89   4.727  10.156   6.912
  700    H    ASP  90           HN       ASP  90   8.539   7.363   6.012
  701    HA   ASP  90           HA       ASP  90   9.580   9.499   4.463
  702    HB2  ASP  90           2HB      ASP  90  10.728   6.881   5.372
  703    HB3  ASP  90           1HB      ASP  90  11.614   7.904   4.250
  704    H    ALA  91           HN       ALA  91   8.268   6.414   3.643
  705    HA   ALA  91           HA       ALA  91   9.394   6.324   1.008
  706    HB1  ALA  91           1HB      ALA  91   7.917   4.412   0.658
  707    HB2  ALA  91           2HB      ALA  91   7.090   4.764   2.175
  708    HB3  ALA  91           3HB      ALA  91   8.783   4.271   2.189
  709    H    SER  92           HN       SER  92   6.287   7.269   2.400
  710    HA   SER  92           HA       SER  92   5.026   7.737  -0.096
  711    HB2  SER  92           2HB      SER  92   3.385   9.063   1.390
  712    HB3  SER  92           1HB      SER  92   3.549   7.333   1.686
  713    HG   SER  92           HG       SER  92   4.669   7.728   3.500
  714    H    PHE  93           HN       PHE  93   6.644   9.877   2.235
  715    HA   PHE  93           HA       PHE  93   6.158  12.219   0.672
  716    HB2  PHE  93           2HB      PHE  93   7.862  11.648   3.076
  717    HB3  PHE  93           1HB      PHE  93   7.997  13.187   2.230
  718    HD1  PHE  93           1HD      PHE  93   5.708  11.007   4.139
  719    HD2  PHE  93           2HD      PHE  93   6.346  14.867   2.464
  720    HE1  PHE  93           1HE      PHE  93   3.773  11.867   5.391
  721    HE2  PHE  93           2HE      PHE  93   4.411  15.734   3.714
  722    HZ   PHE  93           HZ       PHE  93   3.123  14.233   5.180
  723    H    ALA  94           HN       ALA  94   8.338   9.680   0.315
  724    HA   ALA  94           HA       ALA  94  10.422  11.221  -0.972
  725    HB1  ALA  94           1HB      ALA  94  11.438   9.061  -1.484
  726    HB2  ALA  94           2HB      ALA  94   9.985   8.233  -0.922
  727    HB3  ALA  94           3HB      ALA  94  10.977   9.140   0.217
  728    H    LEU  95           HN       LEU  95   7.450   9.816  -1.796
  729    HA   LEU  95           HA       LEU  95   8.002   9.462  -4.595
  730    HB2  LEU  95           2HB      LEU  95   5.399   9.496  -3.076
  731    HB3  LEU  95           1HB      LEU  95   5.573   9.057  -4.760
  732    HG   LEU  95           HG       LEU  95   6.730   7.555  -2.417
  733   HD11  LEU  95          1HD1      LEU  95   4.452   6.895  -4.276
  734   HD12  LEU  95          2HD1      LEU  95   4.304   7.382  -2.588
  735   HD13  LEU  95          3HD1      LEU  95   5.081   5.855  -2.999
  736   HD21  LEU  95          3HD2      LEU  95   7.317   5.851  -4.084
  737   HD22  LEU  95          1HD2      LEU  95   8.152   7.373  -4.393
  738   HD23  LEU  95          2HD2      LEU  95   6.755   6.918  -5.369
  739    H    ARG  96           HN       ARG  96   7.384  10.782  -6.238
  740    HA   ARG  96           HA       ARG  96   6.804  13.534  -5.545
  741    HB2  ARG  96           2HB      ARG  96   7.103  13.961  -7.963
  742    HB3  ARG  96           1HB      ARG  96   8.479  13.119  -7.269
  743    HG2  ARG  96           2HG      ARG  96   7.642  11.007  -8.193
  744    HG3  ARG  96           1HG      ARG  96   6.280  11.874  -8.908
  745    HD2  ARG  96           2HD      ARG  96   7.812  13.197 -10.254
  746    HD3  ARG  96           1HD      ARG  96   9.188  12.395  -9.503
  747    HE   ARG  96           HE       ARG  96   7.756  10.336 -10.549
  748   HH11  ARG  96          1HH1      ARG  96   9.073  13.311 -11.876
  749   HH12  ARG  96          2HH1      ARG  96   9.262  12.670 -13.470
  750   HH21  ARG  96          1HH2      ARG  96   8.024   9.480 -12.657
  751   HH22  ARG  96          2HH2      ARG  96   8.667  10.474 -13.919
  752    H    THR  97           HN       THR  97   5.051  14.665  -6.848
  753    HA   THR  97           HA       THR  97   2.576  13.480  -6.358
  754    HB   THR  97           HB       THR  97   3.235  15.727  -8.284
  755    HG1  THR  97           1HG      THR  97   2.313  15.825  -5.578
  756   HG21  THR  97          3HG2      THR  97   0.888  16.401  -7.947
  757   HG22  THR  97          1HG2      THR  97   0.618  14.949  -6.983
  758   HG23  THR  97          2HG2      THR  97   1.005  14.809  -8.698
  759    H    GLY  98           HN       GLY  98   1.687  11.776  -7.327
  760    HA2  GLY  98           2HA      GLY  98   0.773  10.579  -9.103
  761    HA3  GLY  98           1HA      GLY  98   1.693  11.573 -10.225
  762    H    GLU  99           HN       GLU  99   2.929   9.787  -7.438
  763    HA   GLU  99           HA       GLU  99   4.390   8.049  -9.307
  764    HB2  GLU  99           2HB      GLU  99   5.778   9.907  -8.283
  765    HB3  GLU  99           1HB      GLU  99   5.540   9.119  -6.733
  766    HG2  GLU  99           2HG      GLU  99   7.686   8.543  -7.719
  767    HG3  GLU  99           1HG      GLU  99   6.648   7.124  -7.556
  768    H    MET 100           HN       MET 100   4.871   5.948  -8.555
  769    HA   MET 100           HA       MET 100   3.299   5.148  -6.202
  770    HB2  MET 100           2HB      MET 100   2.291   4.400  -8.351
  771    HB3  MET 100           1HB      MET 100   3.761   3.495  -8.687
  772    HG2  MET 100           2HG      MET 100   3.380   2.099  -6.737
  773    HG3  MET 100           1HG      MET 100   1.946   3.034  -6.327
  774    HE1  MET 100           3HE      MET 100   3.581   0.512  -8.799
  775    HE2  MET 100           1HE      MET 100   3.171   1.831  -9.896
  776    HE3  MET 100           2HE      MET 100   2.323   0.288 -10.015
  777    H    SER 101           HN       SER 101   4.192   3.838  -4.764
  778    HA   SER 101           HA       SER 101   7.058   3.362  -4.939
  779    HB2  SER 101           2HB      SER 101   6.390   4.405  -2.908
  780    HB3  SER 101           1HB      SER 101   5.039   3.295  -2.693
  781    HG   SER 101           HG       SER 101   6.422   1.708  -2.114
  782    H    GLY 102           HN       GLY 102   7.918   1.286  -4.224
  783    HA2  GLY 102           2HA      GLY 102   6.383  -0.926  -5.305
  784    HA3  GLY 102           1HA      GLY 102   8.068  -0.968  -4.799
  785    HA   PRO 103           HA       PRO 103   5.819  -3.234  -1.527
  786    HB2  PRO 103           2HB      PRO 103   7.864  -4.897  -0.890
  787    HB3  PRO 103           1HB      PRO 103   6.778  -5.196  -2.250
  788    HG2  PRO 103           2HG      PRO 103   9.533  -4.040  -2.242
  789    HG3  PRO 103           1HG      PRO 103   8.804  -5.192  -3.374
  790    HD2  PRO 103           2HD      PRO 103   9.076  -2.531  -3.903
  791    HD3  PRO 103           1HD      PRO 103   7.785  -3.536  -4.593
  792    H    VAL 104           HN       VAL 104   5.684  -1.666   0.044
  793    HA   VAL 104           HA       VAL 104   8.084  -0.879   1.504
  794    HB   VAL 104           HB       VAL 104   5.212   0.011   1.867
  795   HG11  VAL 104          1HG1      VAL 104   7.760   1.142   3.016
  796   HG12  VAL 104          2HG1      VAL 104   6.515   0.269   3.908
  797   HG13  VAL 104          3HG1      VAL 104   6.151   1.840   3.196
  798   HG21  VAL 104          3HG2      VAL 104   5.920   2.082   0.761
  799   HG22  VAL 104          1HG2      VAL 104   6.078   0.682  -0.298
  800   HG23  VAL 104          2HG2      VAL 104   7.508   1.374   0.468
  801    H    PHE 105           HN       PHE 105   8.714  -1.957   3.244
  802    HA   PHE 105           HA       PHE 105   6.812  -3.738   4.580
  803    HB2  PHE 105           2HB      PHE 105   9.832  -3.621   4.705
  804    HB3  PHE 105           1HB      PHE 105   8.836  -4.762   5.600
  805    HD1  PHE 105           2HD      PHE 105  10.079  -3.805   2.290
  806    HD2  PHE 105           1HD      PHE 105   7.799  -6.633   4.504
  807    HE1  PHE 105           2HE      PHE 105  10.127  -5.339   0.371
  808    HE2  PHE 105           1HE      PHE 105   7.845  -8.174   2.589
  809    HZ   PHE 105           HZ       PHE 105   9.010  -7.524   0.517
  810    H    THR 106           HN       THR 106   6.193  -3.452   6.639
  811    HA   THR 106           HA       THR 106   7.490  -1.309   8.175
  812    HB   THR 106           HB       THR 106   4.515  -1.870   8.149
  813    HG1  THR 106           1HG      THR 106   6.110  -0.389   6.490
  814   HG21  THR 106          3HG2      THR 106   4.374   0.270   9.351
  815   HG22  THR 106          1HG2      THR 106   6.133   0.400   9.327
  816   HG23  THR 106          2HG2      THR 106   5.356  -0.893  10.240
  817    H    ASP 107           HN       ASP 107   5.065  -3.899   8.579
  818    HA   ASP 107           HA       ASP 107   6.664  -5.125  10.660
  819    HB2  ASP 107           2HB      ASP 107   5.370  -3.449  11.918
  820    HB3  ASP 107           1HB      ASP 107   3.878  -4.086  11.238
  821    H    SER 108           HN       SER 108   3.274  -5.161   9.575
  822    HA   SER 108           HA       SER 108   3.615  -8.007   8.939
  823    HB2  SER 108           2HB      SER 108   1.155  -6.622  10.017
  824    HB3  SER 108           1HB      SER 108   1.249  -8.318   9.553
  825    HG   SER 108           HG       SER 108   2.931  -7.141  11.532
  826    H    GLY 109           HN       GLY 109   3.554  -8.293   6.824
  827    HA2  GLY 109           2HA      GLY 109   2.394  -8.418   4.778
  828    HA3  GLY 109           1HA      GLY 109   1.357  -7.108   5.315
  829    H    ILE 110           HN       ILE 110   1.890  -6.586   2.975
  830    HA   ILE 110           HA       ILE 110   4.288  -4.885   2.940
  831    HB   ILE 110           HB       ILE 110   3.040  -6.304   0.572
  832   HG12  ILE 110          2HG1      ILE 110   5.662  -6.835   1.993
  833   HG13  ILE 110          1HG1      ILE 110   4.229  -7.846   2.097
  834   HG21  ILE 110          1HG2      ILE 110   5.507  -4.584   0.791
  835   HG22  ILE 110          2HG2      ILE 110   4.013  -4.180  -0.057
  836   HG23  ILE 110          3HG2      ILE 110   5.032  -5.496  -0.639
  837   HD11  ILE 110          3HD1      ILE 110   4.405  -8.331  -0.291
  838   HD12  ILE 110          1HD1      ILE 110   5.868  -8.791   0.579
  839   HD13  ILE 110          2HD1      ILE 110   5.844  -7.316  -0.388
  840    H    HIS 111           HN       HIS 111   4.015  -2.810   2.291
  841    HA   HIS 111           HA       HIS 111   1.245  -1.969   1.727
  842    HB2  HIS 111           2HB      HIS 111   3.514  -0.291   2.832
  843    HB3  HIS 111           1HB      HIS 111   1.844   0.210   2.633
  844    HD1  HIS 111           1HD      HIS 111   0.503   0.109   4.721
  845    HD2  HIS 111           2HD      HIS 111   3.726  -2.513   4.815
  846    HE1  HIS 111           1HE      HIS 111   0.517  -0.873   7.034
  847    HE2  HIS 111           2HE      HIS 111   2.512  -2.394   7.093
  848    H    ILE 112           HN       ILE 112   0.841  -0.928  -0.144
  849    HA   ILE 112           HA       ILE 112   3.152  -0.016  -1.736
  850    HB   ILE 112           HB       ILE 112   0.386  -0.508  -2.823
  851   HG12  ILE 112          2HG1      ILE 112   2.719  -2.440  -2.846
  852   HG13  ILE 112          1HG1      ILE 112   1.243  -2.637  -1.906
  853   HG21  ILE 112          1HG2      ILE 112   3.074  -0.301  -4.166
  854   HG22  ILE 112          2HG2      ILE 112   1.821   0.939  -4.148
  855   HG23  ILE 112          3HG2      ILE 112   1.538  -0.588  -4.984
  856   HD11  ILE 112          3HD1      ILE 112   1.214  -4.025  -3.900
  857   HD12  ILE 112          1HD1      ILE 112   1.431  -2.598  -4.911
  858   HD13  ILE 112          2HD1      ILE 112  -0.047  -2.796  -3.974
  859    H    ILE 113           HN       ILE 113   3.104   2.097  -2.483
  860    HA   ILE 113           HA       ILE 113   0.926   3.763  -1.404
  861    HB   ILE 113           HB       ILE 113   3.829   4.566  -1.538
  862   HG12  ILE 113          2HG1      ILE 113   2.268   3.731   0.913
  863   HG13  ILE 113          1HG1      ILE 113   3.440   2.710   0.087
  864   HG21  ILE 113          1HG2      ILE 113   1.467   5.833  -0.147
  865   HG22  ILE 113          2HG2      ILE 113   2.226   6.413  -1.627
  866   HG23  ILE 113          3HG2      ILE 113   3.127   6.428  -0.112
  867   HD11  ILE 113          3HD1      ILE 113   4.409   3.742   2.052
  868   HD12  ILE 113          1HD1      ILE 113   4.017   5.343   1.425
  869   HD13  ILE 113          2HD1      ILE 113   5.196   4.333   0.590
  870    H    LEU 114           HN       LEU 114   0.082   5.206  -2.794
  871    HA   LEU 114           HA       LEU 114   1.645   5.933  -5.172
  872    HB2  LEU 114           2HB      LEU 114  -0.183   4.212  -5.653
  873    HB3  LEU 114           1HB      LEU 114  -1.341   5.454  -5.229
  874    HG   LEU 114           HG       LEU 114   0.663   5.862  -7.450
  875   HD11  LEU 114          1HD1      LEU 114  -2.095   4.672  -7.666
  876   HD12  LEU 114          2HD1      LEU 114  -0.572   3.832  -7.958
  877   HD13  LEU 114          3HD1      LEU 114  -1.068   5.151  -9.017
  878   HD21  LEU 114          3HD2      LEU 114  -0.995   7.470  -8.252
  879   HD22  LEU 114          1HD2      LEU 114  -0.482   7.860  -6.611
  880   HD23  LEU 114          2HD2      LEU 114  -2.042   7.085  -6.887
  881    H    ARG 115           HN       ARG 115   2.079   8.009  -4.908
  882    HA   ARG 115           HA       ARG 115   0.450   9.664  -3.231
  883    HB2  ARG 115           2HB      ARG 115   2.864   9.969  -3.238
  884    HB3  ARG 115           1HB      ARG 115   2.829  10.369  -4.951
  885    HG2  ARG 115           2HG      ARG 115   1.547  12.370  -4.488
  886    HG3  ARG 115           1HG      ARG 115   1.486  11.956  -2.775
  887    HD2  ARG 115           2HD      ARG 115   3.849  12.236  -2.556
  888    HD3  ARG 115           1HD      ARG 115   4.040  12.411  -4.301
  889    HE   ARG 115           HE       ARG 115   2.257  14.372  -3.361
  890   HH11  ARG 115          1HH1      ARG 115   5.683  13.583  -3.229
  891   HH12  ARG 115          2HH1      ARG 115   6.181  15.233  -3.108
  892   HH21  ARG 115          1HH2      ARG 115   2.901  16.522  -3.181
  893   HH22  ARG 115          2HH2      ARG 115   4.580  16.924  -3.088
  894    H    THR 116           HN       THR 116  -1.402  10.428  -3.890
  895    HA   THR 116           HA       THR 116  -2.053  10.778  -6.655
  896    HB   THR 116           HB       THR 116  -3.679  11.730  -4.296
  897    HG1  THR 116           1HG      THR 116  -4.094   9.163  -5.326
  898   HG21  THR 116          3HG2      THR 116  -5.565  11.149  -5.769
  899   HG22  THR 116          1HG2      THR 116  -4.429  10.636  -7.017
  900   HG23  THR 116          2HG2      THR 116  -4.497  12.329  -6.528
  901    H    GLU 117           HN       GLU 117  -1.447  12.876  -3.862
  902    HA   GLU 117           HA       GLU 117  -0.950  15.118  -5.671
  903    HB2  GLU 117           2HB      GLU 117  -2.737  15.229  -3.240
  904    HB3  GLU 117           1HB      GLU 117  -2.124  16.643  -4.075
  905    HG2  GLU 117           2HG      GLU 117  -3.310  15.999  -6.086
  906    HG3  GLU 117           1HG      GLU 117  -3.886  14.534  -5.292
  Start of MODEL   10
    1    H1   GLY   1           1HT      GLY   1   1.887  26.740   1.625
    2    H2   GLY   1           2HT      GLY   1   2.721  27.885   2.544
    3    H3   GLY   1           3HT      GLY   1   1.579  26.875   3.278
    4    HA2  GLY   1           1HA      GLY   1   3.857  26.176   3.755
    5    HA3  GLY   1           2HA      GLY   1   2.924  24.955   2.899
    6    H    SER   2           HN       SER   2   5.452  24.521   2.694
    7    HA   SER   2           HA       SER   2   6.528  25.906   0.372
    8    HB2  SER   2           2HB      SER   2   8.023  25.516   2.290
    9    HB3  SER   2           1HB      SER   2   7.756  23.779   2.146
   10    HG   SER   2           HG       SER   2   9.336  23.781   0.791
   11    H    HIS   3           HN       HIS   3   6.910  24.933  -1.585
   12    HA   HIS   3           HA       HIS   3   5.321  22.605  -2.196
   13    HB2  HIS   3           2HB      HIS   3   7.166  24.289  -3.898
   14    HB3  HIS   3           1HB      HIS   3   6.244  22.925  -4.516
   15    HD1  HIS   3           1HD      HIS   3   5.998  26.509  -3.801
   16    HD2  HIS   3           2HD      HIS   3   3.377  23.346  -4.424
   17    HE1  HIS   3           1HE      HIS   3   3.774  27.563  -4.298
   18    HE2  HIS   3           2HE      HIS   3   2.275  25.634  -4.884
   19    H    MET   4           HN       MET   4   8.733  23.420  -1.986
   20    HA   MET   4           HA       MET   4   9.578  20.732  -2.572
   21    HB2  MET   4           2HB      MET   4  11.089  23.123  -1.498
   22    HB3  MET   4           1HB      MET   4  11.832  21.579  -1.894
   23    HG2  MET   4           2HG      MET   4  10.440  23.442  -3.802
   24    HG3  MET   4           1HG      MET   4  12.175  23.166  -3.678
   25    HE1  MET   4           3HE      MET   4  12.503  19.462  -4.909
   26    HE2  MET   4           1HE      MET   4  12.290  19.990  -3.242
   27    HE3  MET   4           2HE      MET   4  13.358  20.887  -4.319
   28    H    GLU   5           HN       GLU   5  10.045  19.168  -1.138
   29    HA   GLU   5           HA       GLU   5   9.761  17.952   0.745
   30    HB2  GLU   5           2HB      GLU   5  10.888  20.494   1.937
   31    HB3  GLU   5           1HB      GLU   5  10.566  19.064   2.902
   32    HG2  GLU   5           2HG      GLU   5  12.892  19.135   2.344
   33    HG3  GLU   5           1HG      GLU   5  12.142  17.796   1.486
   34    HA   PRO   6           HA       PRO   6   5.626  20.057   1.291
   35    HB2  PRO   6           2HB      PRO   6   4.698  17.291   0.803
   36    HB3  PRO   6           1HB      PRO   6   4.168  18.802   0.058
   37    HG2  PRO   6           2HG      PRO   6   5.653  17.049  -1.300
   38    HG3  PRO   6           1HG      PRO   6   5.890  18.797  -1.492
   39    HD2  PRO   6           2HD      PRO   6   7.492  16.830   0.097
   40    HD3  PRO   6           1HD      PRO   6   8.050  18.167  -0.932
   41    H    ALA   7           HN       ALA   7   4.434  20.096   3.089
   42    HA   ALA   7           HA       ALA   7   5.321  18.555   5.346
   43    HB1  ALA   7           1HB      ALA   7   3.069  20.556   5.160
   44    HB2  ALA   7           2HB      ALA   7   4.753  20.963   5.485
   45    HB3  ALA   7           3HB      ALA   7   3.852  19.977   6.631
   46    H    ARG   8           HN       ARG   8   2.511  18.740   3.268
   47    HA   ARG   8           HA       ARG   8   1.566  16.190   4.360
   48    HB2  ARG   8           2HB      ARG   8  -0.153  18.592   3.717
   49    HB3  ARG   8           1HB      ARG   8  -0.777  16.984   4.046
   50    HG2  ARG   8           2HG      ARG   8   0.227  17.101   6.300
   51    HG3  ARG   8           1HG      ARG   8   0.732  18.757   5.952
   52    HD2  ARG   8           2HD      ARG   8  -1.584  19.403   5.610
   53    HD3  ARG   8           1HD      ARG   8  -2.105  17.747   5.909
   54    HE   ARG   8           HE       ARG   8  -0.611  18.709   8.103
   55   HH11  ARG   8          1HH1      ARG   8  -3.743  19.062   6.561
   56   HH12  ARG   8          2HH1      ARG   8  -4.553  19.506   8.020
   57   HH21  ARG   8          1HH2      ARG   8  -1.695  19.290  10.047
   58   HH22  ARG   8          2HH2      ARG   8  -3.388  19.635  10.011
   59    H    VAL   9           HN       VAL   9   0.854  14.765   2.849
   60    HA   VAL   9           HA       VAL   9   0.521  15.693   0.088
   61    HB   VAL   9           HB       VAL   9   1.764  13.730  -0.778
   62   HG11  VAL   9          1HG1      VAL   9   2.909  15.862  -0.651
   63   HG12  VAL   9          2HG1      VAL   9   4.031  14.540  -0.327
   64   HG13  VAL   9          3HG1      VAL   9   3.408  15.516   1.004
   65   HG21  VAL   9          3HG2      VAL   9   2.594  13.322   2.095
   66   HG22  VAL   9          1HG2      VAL   9   3.251  12.458   0.704
   67   HG23  VAL   9          2HG2      VAL   9   1.556  12.256   1.150
   68    H    ARG  10           HN       ARG  10  -0.628  14.148  -1.253
   69    HA   ARG  10           HA       ARG  10  -2.451  12.504   0.365
   70    HB2  ARG  10           2HB      ARG  10  -3.497  14.241  -1.058
   71    HB3  ARG  10           1HB      ARG  10  -2.767  13.483  -2.470
   72    HG2  ARG  10           2HG      ARG  10  -4.035  11.459  -2.072
   73    HG3  ARG  10           1HG      ARG  10  -4.750  12.180  -0.630
   74    HD2  ARG  10           2HD      ARG  10  -5.718  13.952  -2.051
   75    HD3  ARG  10           1HD      ARG  10  -5.076  13.124  -3.470
   76    HE   ARG  10           HE       ARG  10  -6.622  11.340  -1.920
   77   HH11  ARG  10          1HH1      ARG  10  -6.944  14.051  -4.140
   78   HH12  ARG  10          2HH1      ARG  10  -8.545  13.601  -4.627
   79   HH21  ARG  10          1HH2      ARG  10  -8.728  10.773  -2.562
   80   HH22  ARG  10          2HH2      ARG  10  -9.569  11.740  -3.734
   81    H    CYS  11           HN       CYS  11  -2.094  10.399   0.354
   82    HA   CYS  11           HA       CYS  11  -1.043   9.193  -2.087
   83    HB2  CYS  11           2HB      CYS  11   0.079   8.673   0.671
   84    HB3  CYS  11           1HB      CYS  11   0.542   7.835  -0.804
   85    HG   CYS  11           HG       CYS  11   0.888  11.010  -1.369
   86    H    SER  12           HN       SER  12  -1.735   7.194  -2.517
   87    HA   SER  12           HA       SER  12  -3.835   6.110  -0.809
   88    HB2  SER  12           2HB      SER  12  -2.965   5.267  -3.588
   89    HB3  SER  12           1HB      SER  12  -4.431   4.762  -2.747
   90    HG   SER  12           HG       SER  12  -4.949   6.417  -4.161
   91    H    HIS  13           HN       HIS  13  -3.733   3.946  -0.057
   92    HA   HIS  13           HA       HIS  13  -1.081   2.717  -0.277
   93    HB2  HIS  13           2HB      HIS  13  -0.908   2.299   2.060
   94    HB3  HIS  13           1HB      HIS  13  -1.313   3.997   1.873
   95    HD1  HIS  13           1HD      HIS  13  -1.948   1.599   4.189
   96    HD2  HIS  13           2HD      HIS  13  -4.546   3.901   1.912
   97    HE1  HIS  13           1HE      HIS  13  -4.103   1.631   5.460
   98    HE2  HIS  13           2HE      HIS  13  -5.600   3.169   4.163
   99    H    LEU  14           HN       LEU  14  -1.029   0.631  -0.592
  100    HA   LEU  14           HA       LEU  14  -3.512  -0.921  -0.260
  101    HB2  LEU  14           2HB      LEU  14  -2.625  -0.592  -2.628
  102    HB3  LEU  14           1HB      LEU  14  -1.216  -1.511  -2.149
  103    HG   LEU  14           HG       LEU  14  -3.987  -2.692  -1.983
  104   HD11  LEU  14          1HD1      LEU  14  -2.114  -2.744  -4.346
  105   HD12  LEU  14          2HD1      LEU  14  -3.668  -1.916  -4.270
  106   HD13  LEU  14          3HD1      LEU  14  -3.601  -3.676  -4.187
  107   HD21  LEU  14          3HD2      LEU  14  -2.773  -4.807  -2.177
  108   HD22  LEU  14          1HD2      LEU  14  -2.193  -3.873  -0.798
  109   HD23  LEU  14          2HD2      LEU  14  -1.246  -3.930  -2.286
  110    H    LEU  15           HN       LEU  15  -3.392  -2.576   1.168
  111    HA   LEU  15           HA       LEU  15  -0.702  -3.355   2.053
  112    HB2  LEU  15           2HB      LEU  15  -1.866  -1.926   3.711
  113    HB3  LEU  15           1HB      LEU  15  -3.161  -3.096   3.792
  114    HG   LEU  15           HG       LEU  15  -1.396  -3.060   5.683
  115   HD11  LEU  15          1HD1      LEU  15  -2.071  -5.656   4.318
  116   HD12  LEU  15          2HD1      LEU  15  -3.069  -4.796   5.490
  117   HD13  LEU  15          3HD1      LEU  15  -1.521  -5.477   5.985
  118   HD21  LEU  15          3HD2      LEU  15   0.576  -4.435   5.302
  119   HD22  LEU  15          1HD2      LEU  15   0.578  -3.021   4.250
  120   HD23  LEU  15          2HD2      LEU  15   0.144  -4.604   3.601
  121    H    VAL  16           HN       VAL  16  -0.286  -5.333   1.514
  122    HA   VAL  16           HA       VAL  16  -2.453  -7.296   1.375
  123    HB   VAL  16           HB       VAL  16  -0.909  -7.022  -0.605
  124   HG11  VAL  16          1HG1      VAL  16   1.144  -8.199   1.256
  125   HG12  VAL  16          2HG1      VAL  16   1.153  -6.573   0.576
  126   HG13  VAL  16          3HG1      VAL  16   1.342  -7.972  -0.482
  127   HG21  VAL  16          3HG2      VAL  16  -0.563  -9.423  -0.976
  128   HG22  VAL  16          1HG2      VAL  16  -2.158  -9.078  -0.307
  129   HG23  VAL  16          2HG2      VAL  16  -0.888  -9.724   0.732
  130    H    LYS  17           HN       LYS  17  -2.465  -9.069   2.717
  131    HA   LYS  17           HA       LYS  17  -0.523  -8.929   4.911
  132    HB2  LYS  17           2HB      LYS  17  -3.238 -10.253   4.838
  133    HB3  LYS  17           1HB      LYS  17  -2.175 -10.168   6.240
  134    HG2  LYS  17           2HG      LYS  17  -2.325  -7.720   6.194
  135    HG3  LYS  17           1HG      LYS  17  -3.420  -7.820   4.820
  136    HD2  LYS  17           2HD      LYS  17  -4.724  -7.491   6.804
  137    HD3  LYS  17           1HD      LYS  17  -4.976  -9.150   6.257
  138    HE2  LYS  17           2HE      LYS  17  -3.565 -10.017   7.943
  139    HE3  LYS  17           1HE      LYS  17  -2.935  -8.418   8.339
  140    HZ1  LYS  17           3HZ      LYS  17  -4.542  -9.211   9.962
  141    HZ2  LYS  17           1HZ      LYS  17  -5.739  -9.307   8.770
  142    HZ3  LYS  17           2HZ      LYS  17  -5.091  -7.803   9.194
  143    H    HIS  18           HN       HIS  18   0.020 -11.039   5.952
  144    HA   HIS  18           HA       HIS  18   0.279 -13.153   3.949
  145    HB2  HIS  18           2HB      HIS  18   2.609 -13.589   4.622
  146    HB3  HIS  18           1HB      HIS  18   2.416 -11.979   3.957
  147    HD1  HIS  18           1HD      HIS  18   4.449 -13.404   6.263
  148    HD2  HIS  18           2HD      HIS  18   1.756 -10.261   6.614
  149    HE1  HIS  18           1HE      HIS  18   5.236 -12.058   8.222
  150    HE2  HIS  18           2HE      HIS  18   3.712 -10.065   8.297
  151    H    SER  19           HN       SER  19   0.638 -15.256   4.761
  152    HA   SER  19           HA       SER  19  -1.191 -16.088   6.602
  153    HB2  SER  19           2HB      SER  19   0.009 -17.479   4.885
  154    HB3  SER  19           1HB      SER  19   1.371 -17.567   6.001
  155    HG   SER  19           HG       SER  19  -1.280 -18.434   6.538
  156    H    GLN  20           HN       GLN  20   2.329 -16.055   7.266
  157    HA   GLN  20           HA       GLN  20   1.841 -16.477  10.059
  158    HB2  GLN  20           2HB      GLN  20   4.424 -15.762   8.661
  159    HB3  GLN  20           1HB      GLN  20   4.269 -16.349  10.311
  160    HG2  GLN  20           2HG      GLN  20   3.599 -17.864   7.800
  161    HG3  GLN  20           1HG      GLN  20   4.994 -18.126   8.844
  162   HE21  GLN  20          1HE2      GLN  20   4.696 -19.108  10.838
  163   HE22  GLN  20          2HE2      GLN  20   3.260 -19.985  11.229
  164    H    SER  21           HN       SER  21   0.554 -14.693  10.588
  165    HA   SER  21           HA       SER  21   2.116 -12.277  11.091
  166    HB2  SER  21           2HB      SER  21   0.004 -10.954  10.523
  167    HB3  SER  21           1HB      SER  21   0.887 -11.643   9.161
  168    HG   SER  21           HG       SER  21  -0.683 -13.048   8.813
  169    H    ARG  22           HN       ARG  22   0.568 -10.767  12.530
  170    HA   ARG  22           HA       ARG  22   0.124 -12.329  14.899
  171    HB2  ARG  22           2HB      ARG  22  -0.472  -9.400  14.476
  172    HB3  ARG  22           1HB      ARG  22  -0.241 -10.229  16.007
  173    HG2  ARG  22           2HG      ARG  22   2.108 -10.736  15.237
  174    HG3  ARG  22           1HG      ARG  22   1.818  -9.606  13.916
  175    HD2  ARG  22           2HD      ARG  22   2.922  -8.425  15.657
  176    HD3  ARG  22           1HD      ARG  22   1.243  -7.880  15.625
  177    HE   ARG  22           HE       ARG  22   0.988  -9.643  17.485
  178   HH11  ARG  22          1HH1      ARG  22   3.777  -7.577  16.989
  179   HH12  ARG  22          2HH1      ARG  22   4.280  -7.636  18.642
  180   HH21  ARG  22          1HH2      ARG  22   1.631  -9.718  19.674
  181   HH22  ARG  22          2HH2      ARG  22   3.045  -8.868  20.189
  182    H    ARG  23           HN       ARG  23  -1.793 -10.638  12.521
  183    HA   ARG  23           HA       ARG  23  -4.161 -12.036  13.544
  184    HB2  ARG  23           2HB      ARG  23  -4.077  -9.189  12.520
  185    HB3  ARG  23           1HB      ARG  23  -5.547 -10.081  12.874
  186    HG2  ARG  23           2HG      ARG  23  -3.419  -9.290  14.852
  187    HG3  ARG  23           1HG      ARG  23  -5.021  -8.567  14.681
  188    HD2  ARG  23           2HD      ARG  23  -6.043 -10.720  15.263
  189    HD3  ARG  23           1HD      ARG  23  -4.440 -11.429  15.445
  190    HE   ARG  23           HE       ARG  23  -5.581  -9.335  17.165
  191   HH11  ARG  23          1HH1      ARG  23  -3.264 -11.922  16.626
  192   HH12  ARG  23          2HH1      ARG  23  -2.772 -11.994  18.284
  193   HH21  ARG  23          1HH2      ARG  23  -4.922  -9.439  19.362
  194   HH22  ARG  23          2HH2      ARG  23  -3.709 -10.572  19.840
  195    HA   PRO  24           HA       PRO  24  -3.498 -13.210   9.181
  196    HB2  PRO  24           2HB      PRO  24  -4.920 -15.646   9.990
  197    HB3  PRO  24           1HB      PRO  24  -3.299 -15.470   9.313
  198    HG2  PRO  24           2HG      PRO  24  -3.694 -16.174  11.881
  199    HG3  PRO  24           1HG      PRO  24  -2.321 -15.166  11.385
  200    HD2  PRO  24           2HD      PRO  24  -4.924 -14.344  12.625
  201    HD3  PRO  24           1HD      PRO  24  -3.273 -13.805  13.011
  202    H    SER  25           HN       SER  25  -6.248 -12.448  10.944
  203    HA   SER  25           HA       SER  25  -8.143 -13.275   8.911
  204    HB2  SER  25           2HB      SER  25  -8.603 -11.600  11.389
  205    HB3  SER  25           1HB      SER  25  -9.846 -12.329  10.373
  206    HG   SER  25           HG       SER  25  -8.537 -14.372  10.915
  207    H    SER  26           HN       SER  26  -9.207 -11.951   7.492
  208    HA   SER  26           HA       SER  26  -8.563  -9.097   7.475
  209    HB2  SER  26           2HB      SER  26  -8.107  -9.202   5.076
  210    HB3  SER  26           1HB      SER  26  -6.980 -10.235   5.962
  211    H    TRP  27           HN       TRP  27  -9.925  -8.304   5.259
  212    HA   TRP  27           HA       TRP  27 -12.655  -8.990   5.972
  213    HB2  TRP  27           2HB      TRP  27 -13.353  -7.072   4.829
  214    HB3  TRP  27           1HB      TRP  27 -11.771  -6.600   5.424
  215    HD1  TRP  27           1HD      TRP  27  -9.726  -6.771   3.465
  216    HE1  TRP  27           1HE      TRP  27  -9.859  -6.168   0.991
  217    HE3  TRP  27           3HE      TRP  27 -14.797  -6.964   2.876
  218    HZ2  TRP  27           2HZ      TRP  27 -11.860  -5.810  -0.982
  219    HZ3  TRP  27           3HZ      TRP  27 -15.742  -6.475   0.656
  220    HH2  TRP  27           2HH      TRP  27 -14.302  -5.908  -1.232
  221    H    ARG  28           HN       ARG  28 -10.333 -10.120   3.885
  222    HA   ARG  28           HA       ARG  28 -12.268 -11.108   1.911
  223    HB2  ARG  28           2HB      ARG  28  -9.245 -11.054   1.863
  224    HB3  ARG  28           1HB      ARG  28 -10.247 -11.768   0.610
  225    HG2  ARG  28           2HG      ARG  28 -10.312  -8.867   1.410
  226    HG3  ARG  28           1HG      ARG  28  -9.399  -9.521   0.048
  227    HD2  ARG  28           2HD      ARG  28 -12.391  -9.725   0.391
  228    HD3  ARG  28           1HD      ARG  28 -11.566  -8.539  -0.618
  229    HE   ARG  28           HE       ARG  28 -10.932 -11.295  -1.216
  230   HH11  ARG  28          1HH1      ARG  28 -13.045  -8.586  -1.909
  231   HH12  ARG  28          2HH1      ARG  28 -13.490  -9.153  -3.477
  232   HH21  ARG  28          1HH2      ARG  28 -11.536 -12.072  -3.302
  233   HH22  ARG  28          2HH2      ARG  28 -12.648 -11.158  -4.259
  234    H    GLN  29           HN       GLN  29  -9.792 -12.152   4.213
  235    HA   GLN  29           HA       GLN  29 -10.891 -14.877   4.032
  236    HB2  GLN  29           2HB      GLN  29  -7.970 -14.141   4.297
  237    HB3  GLN  29           1HB      GLN  29  -8.615 -15.771   4.383
  238    HG2  GLN  29           2HG      GLN  29  -8.232 -15.919   2.211
  239    HG3  GLN  29           1HG      GLN  29  -9.568 -14.796   1.976
  240   HE21  GLN  29          1HE2      GLN  29  -8.062 -12.581   3.238
  241   HE22  GLN  29          2HE2      GLN  29  -6.904 -12.074   2.058
  242    H    GLU  30           HN       GLU  30 -10.506 -16.152   5.958
  243    HA   GLU  30           HA       GLU  30 -10.626 -14.535   8.375
  244    HB2  GLU  30           2HB      GLU  30 -12.248 -16.388   7.970
  245    HB3  GLU  30           1HB      GLU  30 -10.910 -17.525   8.024
  246    HG2  GLU  30           2HG      GLU  30 -10.445 -16.707  10.348
  247    HG3  GLU  30           1HG      GLU  30 -11.967 -15.822  10.256
  248    H    LYS  31           HN       LYS  31  -8.567 -16.683   6.647
  249    HA   LYS  31           HA       LYS  31  -6.380 -16.104   8.440
  250    HB2  LYS  31           2HB      LYS  31  -5.771 -18.611   8.433
  251    HB3  LYS  31           1HB      LYS  31  -7.026 -18.070   9.535
  252    HG2  LYS  31           2HG      LYS  31  -8.722 -18.822   7.862
  253    HG3  LYS  31           1HG      LYS  31  -7.405 -19.506   6.912
  254    HD2  LYS  31           2HD      LYS  31  -7.974 -20.245   9.782
  255    HD3  LYS  31           1HD      LYS  31  -8.596 -21.141   8.398
  256    HE2  LYS  31           2HE      LYS  31  -5.678 -20.676   9.014
  257    HE3  LYS  31           1HE      LYS  31  -6.567 -22.159   9.349
  258    HZ1  LYS  31           3HZ      LYS  31  -5.389 -22.435   7.318
  259    HZ2  LYS  31           1HZ      LYS  31  -5.997 -20.992   6.685
  260    HZ3  LYS  31           2HZ      LYS  31  -7.025 -22.303   6.934
  261    H    ILE  32           HN       ILE  32  -5.111 -15.159   7.005
  262    HA   ILE  32           HA       ILE  32  -4.965 -15.575   4.265
  263    HB   ILE  32           HB       ILE  32  -2.613 -14.736   5.977
  264   HG12  ILE  32          2HG1      ILE  32  -4.599 -13.405   6.575
  265   HG13  ILE  32          1HG1      ILE  32  -3.395 -12.430   5.747
  266   HG21  ILE  32          1HG2      ILE  32  -3.343 -14.098   3.122
  267   HG22  ILE  32          2HG2      ILE  32  -2.053 -15.175   3.657
  268   HG23  ILE  32          3HG2      ILE  32  -1.957 -13.447   3.996
  269   HD11  ILE  32          3HD1      ILE  32  -5.635 -11.893   4.999
  270   HD12  ILE  32          1HD1      ILE  32  -5.894 -13.570   4.522
  271   HD13  ILE  32          2HD1      ILE  32  -4.689 -12.592   3.685
  272    H    THR  33           HN       THR  33  -4.004 -17.040   2.974
  273    HA   THR  33           HA       THR  33  -2.533 -19.215   4.269
  274    HB   THR  33           HB       THR  33  -3.627 -19.185   1.451
  275    HG1  THR  33           1HG      THR  33  -5.540 -19.472   2.281
  276   HG21  THR  33          3HG2      THR  33  -3.594 -21.636   1.760
  277   HG22  THR  33          1HG2      THR  33  -2.879 -21.412   3.355
  278   HG23  THR  33          2HG2      THR  33  -1.984 -20.929   1.914
  279    H    ARG  34           HN       ARG  34  -2.237 -16.701   1.862
  280    HA   ARG  34           HA       ARG  34   0.121 -17.708   0.629
  281    HB2  ARG  34           2HB      ARG  34   0.140 -15.740  -0.645
  282    HB3  ARG  34           1HB      ARG  34  -1.564 -15.985  -0.307
  283    HG2  ARG  34           2HG      ARG  34  -1.372 -14.355   1.555
  284    HG3  ARG  34           1HG      ARG  34   0.291 -14.049   1.060
  285    HD2  ARG  34           2HD      ARG  34  -0.849 -12.346  -0.000
  286    HD3  ARG  34           1HD      ARG  34  -0.770 -13.573  -1.263
  287    HE   ARG  34           HE       ARG  34  -3.067 -14.004  -0.963
  288   HH11  ARG  34          1HH1      ARG  34  -1.903 -11.496   1.187
  289   HH12  ARG  34          2HH1      ARG  34  -3.472 -10.809   1.450
  290   HH21  ARG  34          1HH2      ARG  34  -5.173 -13.108  -0.562
  291   HH22  ARG  34          2HH2      ARG  34  -5.312 -11.733   0.497
  292    H    THR  35           HN       THR  35   2.221 -17.412   1.139
  293    HA   THR  35           HA       THR  35   2.847 -16.266   3.700
  294    HB   THR  35           HB       THR  35   3.972 -18.341   2.925
  295    HG1  THR  35           1HG      THR  35   5.386 -17.594   4.296
  296   HG21  THR  35          3HG2      THR  35   4.161 -17.833   0.550
  297   HG22  THR  35          1HG2      THR  35   5.747 -18.198   1.225
  298   HG23  THR  35          2HG2      THR  35   5.291 -16.525   0.903
  299    H    LYS  36           HN       LYS  36   5.090 -14.953   3.634
  300    HA   LYS  36           HA       LYS  36   4.448 -12.394   2.649
  301    HB2  LYS  36           2HB      LYS  36   5.947 -12.776   4.563
  302    HB3  LYS  36           1HB      LYS  36   7.146 -13.477   3.485
  303    HG2  LYS  36           2HG      LYS  36   7.304 -11.301   2.316
  304    HG3  LYS  36           1HG      LYS  36   6.189 -10.621   3.503
  305    HD2  LYS  36           2HD      LYS  36   7.764 -11.178   5.293
  306    HD3  LYS  36           1HD      LYS  36   8.877 -11.852   4.102
  307    HE2  LYS  36           2HE      LYS  36   8.984  -9.629   3.013
  308    HE3  LYS  36           1HE      LYS  36   7.969  -8.982   4.301
  309    HZ1  LYS  36           3HZ      LYS  36   9.687  -9.601   5.899
  310    HZ2  LYS  36           1HZ      LYS  36  10.303  -8.553   4.725
  311    HZ3  LYS  36           2HZ      LYS  36  10.650 -10.200   4.649
  312    H    GLU  37           HN       GLU  37   6.514 -14.944   1.390
  313    HA   GLU  37           HA       GLU  37   7.679 -13.504  -0.726
  314    HB2  GLU  37           2HB      GLU  37   7.064 -16.459  -0.670
  315    HB3  GLU  37           1HB      GLU  37   8.296 -15.652  -1.631
  316    HG2  GLU  37           2HG      GLU  37   9.452 -15.008   0.444
  317    HG3  GLU  37           1HG      GLU  37   8.244 -15.903   1.365
  318    H    GLU  38           HN       GLU  38   4.763 -15.490  -0.547
  319    HA   GLU  38           HA       GLU  38   4.003 -15.297  -3.247
  320    HB2  GLU  38           2HB      GLU  38   2.389 -15.734  -0.739
  321    HB3  GLU  38           1HB      GLU  38   1.701 -15.817  -2.354
  322    HG2  GLU  38           2HG      GLU  38   3.968 -17.532  -1.386
  323    HG3  GLU  38           1HG      GLU  38   2.272 -18.019  -1.379
  324    H    ALA  39           HN       ALA  39   3.322 -13.301  -0.430
  325    HA   ALA  39           HA       ALA  39   1.479 -11.554  -1.599
  326    HB1  ALA  39           1HB      ALA  39   2.064 -10.007   0.199
  327    HB2  ALA  39           2HB      ALA  39   3.497 -10.965   0.567
  328    HB3  ALA  39           3HB      ALA  39   1.892 -11.650   0.814
  329    H    LEU  40           HN       LEU  40   5.010 -11.455  -1.439
  330    HA   LEU  40           HA       LEU  40   5.401  -8.971  -2.673
  331    HB2  LEU  40           2HB      LEU  40   7.144 -10.209  -1.439
  332    HB3  LEU  40           1HB      LEU  40   7.183 -11.419  -2.698
  333    HG   LEU  40           HG       LEU  40   9.067  -9.668  -2.613
  334   HD11  LEU  40          1HD1      LEU  40   7.598 -10.125  -5.197
  335   HD12  LEU  40          2HD1      LEU  40   8.785 -11.206  -4.466
  336   HD13  LEU  40          3HD1      LEU  40   9.278  -9.612  -5.039
  337   HD21  LEU  40          3HD2      LEU  40   8.635  -7.586  -3.812
  338   HD22  LEU  40          1HD2      LEU  40   7.663  -7.695  -2.343
  339   HD23  LEU  40          2HD2      LEU  40   6.924  -7.996  -3.917
  340    H    GLU  41           HN       GLU  41   5.185 -12.224  -4.057
  341    HA   GLU  41           HA       GLU  41   5.692 -11.605  -6.731
  342    HB2  GLU  41           2HB      GLU  41   3.820 -13.698  -5.606
  343    HB3  GLU  41           1HB      GLU  41   4.423 -13.658  -7.258
  344    HG2  GLU  41           2HG      GLU  41   6.156 -13.912  -4.813
  345    HG3  GLU  41           1HG      GLU  41   5.600 -15.263  -5.797
  346    H    LEU  42           HN       LEU  42   2.652 -11.627  -4.936
  347    HA   LEU  42           HA       LEU  42   1.022 -10.832  -7.109
  348    HB2  LEU  42           2HB      LEU  42   0.680 -10.968  -4.150
  349    HB3  LEU  42           1HB      LEU  42  -0.471 -10.026  -5.073
  350    HG   LEU  42           HG       LEU  42  -1.095 -12.012  -6.366
  351   HD11  LEU  42          1HD1      LEU  42   0.842 -13.496  -4.598
  352   HD12  LEU  42          2HD1      LEU  42   1.027 -13.203  -6.327
  353   HD13  LEU  42          3HD1      LEU  42  -0.284 -14.227  -5.742
  354   HD21  LEU  42          3HD2      LEU  42  -2.199 -13.253  -4.568
  355   HD22  LEU  42          1HD2      LEU  42  -2.320 -11.511  -4.328
  356   HD23  LEU  42          2HD2      LEU  42  -1.165 -12.453  -3.386
  357    H    ILE  43           HN       ILE  43   2.710  -9.040  -4.571
  358    HA   ILE  43           HA       ILE  43   1.681  -6.495  -5.067
  359    HB   ILE  43           HB       ILE  43   4.418  -7.320  -4.082
  360   HG12  ILE  43          2HG1      ILE  43   2.520  -7.855  -2.611
  361   HG13  ILE  43          1HG1      ILE  43   3.566  -6.633  -1.897
  362   HG21  ILE  43          1HG2      ILE  43   3.261  -4.539  -4.233
  363   HG22  ILE  43          2HG2      ILE  43   4.687  -5.141  -5.079
  364   HG23  ILE  43          3HG2      ILE  43   4.703  -4.980  -3.322
  365   HD11  ILE  43          3HD1      ILE  43   1.235  -6.106  -1.523
  366   HD12  ILE  43          1HD1      ILE  43   0.927  -6.135  -3.258
  367   HD13  ILE  43          2HD1      ILE  43   1.978  -4.898  -2.567
  368    H    ASN  44           HN       ASN  44   4.580  -8.029  -6.460
  369    HA   ASN  44           HA       ASN  44   5.241  -5.929  -8.188
  370    HB2  ASN  44           2HB      ASN  44   5.735  -8.897  -8.408
  371    HB3  ASN  44           1HB      ASN  44   6.348  -7.747  -9.593
  372   HD21  ASN  44          1HD2      ASN  44   7.838  -9.489  -7.860
  373   HD22  ASN  44          2HD2      ASN  44   8.835  -8.477  -6.877
  374    H    GLY  45           HN       GLY  45   2.975  -8.583  -8.540
  375    HA2  GLY  45           2HA      GLY  45   2.332  -8.231 -11.253
  376    HA3  GLY  45           1HA      GLY  45   1.276  -8.943 -10.037
  377    H    TYR  46           HN       TYR  46   0.900  -6.814  -8.324
  378    HA   TYR  46           HA       TYR  46  -1.112  -5.325  -9.611
  379    HB2  TYR  46           2HB      TYR  46   0.354  -4.516  -7.087
  380    HB3  TYR  46           1HB      TYR  46  -1.252  -4.005  -7.583
  381    HD1  TYR  46           1HD      TYR  46  -2.275  -6.752  -8.451
  382    HD2  TYR  46           2HD      TYR  46  -0.158  -5.447  -5.000
  383    HE1  TYR  46           1HE      TYR  46  -3.234  -8.613  -7.163
  384    HE2  TYR  46           2HE      TYR  46  -1.106  -7.306  -3.706
  385    HH   TYR  46           HH       TYR  46  -2.720  -9.916  -5.156
  386    H    ILE  47           HN       ILE  47   2.192  -4.511  -8.672
  387    HA   ILE  47           HA       ILE  47   2.258  -1.865  -9.530
  388    HB   ILE  47           HB       ILE  47   4.495  -3.909  -9.507
  389   HG12  ILE  47          2HG1      ILE  47   3.740  -1.754  -7.516
  390   HG13  ILE  47          1HG1      ILE  47   3.457  -3.479  -7.312
  391   HG21  ILE  47          1HG2      ILE  47   5.061  -2.074 -11.002
  392   HG22  ILE  47          2HG2      ILE  47   6.032  -1.997  -9.532
  393   HG23  ILE  47          3HG2      ILE  47   4.664  -0.904  -9.741
  394   HD11  ILE  47          3HD1      ILE  47   5.387  -2.748  -6.041
  395   HD12  ILE  47          1HD1      ILE  47   6.146  -2.140  -7.513
  396   HD13  ILE  47          2HD1      ILE  47   5.870  -3.871  -7.313
  397    H    GLN  48           HN       GLN  48   2.978  -4.849 -11.319
  398    HA   GLN  48           HA       GLN  48   3.768  -3.709 -13.744
  399    HB2  GLN  48           2HB      GLN  48   2.246  -6.286 -13.296
  400    HB3  GLN  48           1HB      GLN  48   3.032  -5.833 -14.798
  401    HG2  GLN  48           2HG      GLN  48   4.375  -6.367 -12.161
  402    HG3  GLN  48           1HG      GLN  48   4.382  -7.411 -13.580
  403   HE21  GLN  48          1HE2      GLN  48   5.693  -4.588 -12.094
  404   HE22  GLN  48          2HE2      GLN  48   6.932  -4.296 -13.258
  405    H    LYS  49           HN       LYS  49   0.527  -4.693 -12.679
  406    HA   LYS  49           HA       LYS  49  -0.808  -3.977 -15.037
  407    HB2  LYS  49           2HB      LYS  49  -1.832  -4.227 -12.214
  408    HB3  LYS  49           1HB      LYS  49  -2.867  -4.018 -13.620
  409    HG2  LYS  49           2HG      LYS  49  -1.939  -6.108 -14.561
  410    HG3  LYS  49           1HG      LYS  49  -1.016  -6.327 -13.074
  411    HD2  LYS  49           2HD      LYS  49  -3.080  -6.426 -11.789
  412    HD3  LYS  49           1HD      LYS  49  -4.022  -6.141 -13.254
  413    HE2  LYS  49           2HE      LYS  49  -2.228  -8.513 -12.738
  414    HE3  LYS  49           1HE      LYS  49  -3.988  -8.514 -12.649
  415    HZ1  LYS  49           3HZ      LYS  49  -3.197  -9.403 -14.752
  416    HZ2  LYS  49           1HZ      LYS  49  -2.390  -7.959 -15.094
  417    HZ3  LYS  49           2HZ      LYS  49  -4.074  -7.980 -15.002
  418    H    ILE  50           HN       ILE  50  -0.182  -2.122 -12.087
  419    HA   ILE  50           HA       ILE  50  -1.729   0.122 -12.872
  420    HB   ILE  50           HB       ILE  50   0.569  -0.033 -10.907
  421   HG12  ILE  50          2HG1      ILE  50  -2.425  -0.057 -10.452
  422   HG13  ILE  50          1HG1      ILE  50  -1.384  -1.474 -10.387
  423   HG21  ILE  50          1HG2      ILE  50  -1.503   2.135 -11.288
  424   HG22  ILE  50          2HG2      ILE  50   0.214   2.266 -11.663
  425   HG23  ILE  50          3HG2      ILE  50  -0.309   2.072  -9.990
  426   HD11  ILE  50          3HD1      ILE  50  -1.917  -0.653  -8.165
  427   HD12  ILE  50          1HD1      ILE  50  -1.226   0.918  -8.571
  428   HD13  ILE  50          2HD1      ILE  50  -0.190  -0.507  -8.494
  429    H    LYS  51           HN       LYS  51   1.715  -0.664 -13.204
  430    HA   LYS  51           HA       LYS  51   2.516   1.799 -14.316
  431    HB2  LYS  51           2HB      LYS  51   3.685  -0.968 -14.637
  432    HB3  LYS  51           1HB      LYS  51   4.456   0.494 -15.229
  433    HG2  LYS  51           2HG      LYS  51   3.790  -0.043 -12.343
  434    HG3  LYS  51           1HG      LYS  51   5.365  -0.307 -13.086
  435    HD2  LYS  51           2HD      LYS  51   5.464   2.090 -13.660
  436    HD3  LYS  51           1HD      LYS  51   3.920   2.331 -12.842
  437    HE2  LYS  51           2HE      LYS  51   5.753   2.958 -11.380
  438    HE3  LYS  51           1HE      LYS  51   4.917   1.543 -10.745
  439    HZ1  LYS  51           3HZ      LYS  51   7.268   1.225 -10.558
  440    HZ2  LYS  51           1HZ      LYS  51   7.511   1.571 -12.192
  441    HZ3  LYS  51           2HZ      LYS  51   6.698   0.164 -11.740
  442    H    SER  52           HN       SER  52   1.542  -1.250 -15.879
  443    HA   SER  52           HA       SER  52   1.807  -0.271 -18.516
  444    HB2  SER  52           2HB      SER  52   0.132  -2.567 -17.479
  445    HB3  SER  52           1HB      SER  52   0.567  -2.290 -19.167
  446    HG   SER  52           HG       SER  52   2.200  -3.519 -18.633
  447    H    GLY  53           HN       GLY  53  -0.826  -0.209 -16.200
  448    HA2  GLY  53           2HA      GLY  53  -2.448   1.556 -16.309
  449    HA3  GLY  53           1HA      GLY  53  -2.281   1.554 -18.057
  450    H    GLU  54           HN       GLU  54  -2.498  -1.480 -16.445
  451    HA   GLU  54           HA       GLU  54  -4.840  -2.231 -17.869
  452    HB2  GLU  54           2HB      GLU  54  -3.458  -3.528 -15.519
  453    HB3  GLU  54           1HB      GLU  54  -4.760  -4.265 -16.435
  454    HG2  GLU  54           2HG      GLU  54  -3.373  -4.274 -18.429
  455    HG3  GLU  54           1HG      GLU  54  -2.072  -3.487 -17.536
  456    H    GLU  55           HN       GLU  55  -4.250  -1.838 -14.393
  457    HA   GLU  55           HA       GLU  55  -7.081  -1.128 -14.043
  458    HB2  GLU  55           2HB      GLU  55  -5.325  -2.846 -12.295
  459    HB3  GLU  55           1HB      GLU  55  -6.845  -2.163 -11.745
  460    HG2  GLU  55           2HG      GLU  55  -6.534  -4.027 -14.082
  461    HG3  GLU  55           1HG      GLU  55  -7.031  -4.504 -12.459
  462    H    ASP  56           HN       ASP  56  -7.441   0.066 -11.997
  463    HA   ASP  56           HA       ASP  56  -5.403   2.116 -11.674
  464    HB2  ASP  56           2HB      ASP  56  -8.250   1.911 -10.662
  465    HB3  ASP  56           1HB      ASP  56  -7.176   3.253 -10.298
  466    H    PHE  57           HN       PHE  57  -4.893   2.867  -9.460
  467    HA   PHE  57           HA       PHE  57  -3.937   0.751  -7.864
  468    HB2  PHE  57           2HB      PHE  57  -2.998   3.083  -7.915
  469    HB3  PHE  57           1HB      PHE  57  -4.405   3.621  -7.008
  470    HD1  PHE  57           1HD      PHE  57  -4.751   2.769  -4.675
  471    HD2  PHE  57           2HD      PHE  57  -1.166   2.066  -6.851
  472    HE1  PHE  57           1HE      PHE  57  -3.587   2.229  -2.579
  473    HE2  PHE  57           2HE      PHE  57   0.000   1.525  -4.761
  474    HZ   PHE  57           HZ       PHE  57  -1.208   1.603  -2.620
  475    H    GLU  58           HN       GLU  58  -6.674   2.945  -7.506
  476    HA   GLU  58           HA       GLU  58  -7.665   1.983  -5.074
  477    HB2  GLU  58           2HB      GLU  58  -9.104   3.268  -7.397
  478    HB3  GLU  58           1HB      GLU  58  -9.801   3.033  -5.802
  479    HG2  GLU  58           2HG      GLU  58  -8.315   4.566  -4.813
  480    HG3  GLU  58           1HG      GLU  58  -7.272   4.592  -6.231
  481    H    SER  59           HN       SER  59  -8.154   0.905  -8.380
  482    HA   SER  59           HA       SER  59 -10.325  -0.830  -7.949
  483    HB2  SER  59           2HB      SER  59  -9.555  -0.054 -10.192
  484    HB3  SER  59           1HB      SER  59  -8.137  -1.084 -10.031
  485    HG   SER  59           HG       SER  59  -9.610  -2.266 -11.173
  486    H    LEU  60           HN       LEU  60  -6.837  -1.323  -7.768
  487    HA   LEU  60           HA       LEU  60  -7.120  -4.133  -7.211
  488    HB2  LEU  60           2HB      LEU  60  -4.697  -2.345  -7.024
  489    HB3  LEU  60           1HB      LEU  60  -4.680  -4.094  -6.918
  490    HG   LEU  60           HG       LEU  60  -5.472  -2.490  -9.354
  491   HD11  LEU  60          1HD1      LEU  60  -3.021  -4.148  -8.807
  492   HD12  LEU  60          2HD1      LEU  60  -3.087  -2.388  -8.888
  493   HD13  LEU  60          3HD1      LEU  60  -3.418  -3.349 -10.328
  494   HD21  LEU  60          3HD2      LEU  60  -5.483  -4.660 -10.500
  495   HD22  LEU  60          1HD2      LEU  60  -6.704  -4.582  -9.233
  496   HD23  LEU  60          2HD2      LEU  60  -5.207  -5.469  -8.958
  497    H    ALA  61           HN       ALA  61  -6.635  -1.183  -5.400
  498    HA   ALA  61           HA       ALA  61  -5.895  -2.310  -2.938
  499    HB1  ALA  61           1HB      ALA  61  -6.542  -0.179  -1.955
  500    HB2  ALA  61           2HB      ALA  61  -7.407   0.254  -3.430
  501    HB3  ALA  61           3HB      ALA  61  -5.652   0.075  -3.456
  502    H    SER  62           HN       SER  62  -9.095  -1.322  -4.134
  503    HA   SER  62           HA       SER  62 -10.479  -2.211  -1.819
  504    HB2  SER  62           2HB      SER  62 -11.501  -1.535  -4.574
  505    HB3  SER  62           1HB      SER  62 -12.512  -1.776  -3.149
  506    HG   SER  62           HG       SER  62 -11.360  -0.038  -2.164
  507    H    GLN  63           HN       GLN  63  -8.838  -4.239  -3.498
  508    HA   GLN  63           HA       GLN  63 -10.885  -6.332  -3.364
  509    HB2  GLN  63           2HB      GLN  63  -9.071  -5.827  -5.720
  510    HB3  GLN  63           1HB      GLN  63  -9.902  -7.351  -5.460
  511    HG2  GLN  63           2HG      GLN  63 -12.050  -6.206  -5.616
  512    HG3  GLN  63           1HG      GLN  63 -11.215  -4.674  -5.862
  513   HE21  GLN  63          1HE2      GLN  63  -9.133  -5.856  -7.498
  514   HE22  GLN  63          2HE2      GLN  63  -9.844  -6.187  -9.035
  515    H    PHE  64           HN       PHE  64  -7.433  -5.779  -4.022
  516    HA   PHE  64           HA       PHE  64  -6.848  -8.416  -2.970
  517    HB2  PHE  64           2HB      PHE  64  -5.074  -6.380  -4.300
  518    HB3  PHE  64           1HB      PHE  64  -4.575  -8.000  -3.818
  519    HD1  PHE  64           2HD      PHE  64  -5.565  -9.975  -4.927
  520    HD2  PHE  64           1HD      PHE  64  -6.332  -6.015  -6.275
  521    HE1  PHE  64           2HE      PHE  64  -6.376 -10.865  -7.069
  522    HE2  PHE  64           1HE      PHE  64  -7.148  -6.897  -8.417
  523    HZ   PHE  64           HZ       PHE  64  -7.171  -9.326  -8.817
  524    H    SER  65           HN       SER  65  -6.930  -5.266  -1.751
  525    HA   SER  65           HA       SER  65  -4.839  -5.723   0.177
  526    HB2  SER  65           2HB      SER  65  -5.496  -3.418  -0.688
  527    HB3  SER  65           1HB      SER  65  -6.963  -3.568   0.277
  528    HG   SER  65           HG       SER  65  -4.677  -4.149   1.672
  529    H    ASP  66           HN       ASP  66  -5.161  -7.183   1.676
  530    HA   ASP  66           HA       ASP  66  -7.682  -8.228   2.396
  531    HB2  ASP  66           2HB      ASP  66  -5.141  -8.453   4.010
  532    HB3  ASP  66           1HB      ASP  66  -6.505  -9.557   4.011
  533    H    ALA  67           HN       ALA  67  -5.842  -5.580   3.612
  534    HA   ALA  67           HA       ALA  67  -7.221  -5.493   6.153
  535    HB1  ALA  67           1HB      ALA  67  -5.903  -3.452   6.544
  536    HB2  ALA  67           2HB      ALA  67  -5.255  -3.579   4.907
  537    HB3  ALA  67           3HB      ALA  67  -4.908  -4.835   6.097
  538    H    SER  68           HN       SER  68  -7.867  -3.048   6.733
  539    HA   SER  68           HA       SER  68 -10.291  -2.588   5.393
  540    HB2  SER  68           2HB      SER  68 -10.235  -0.437   6.812
  541    HB3  SER  68           1HB      SER  68 -10.245  -1.990   7.651
  542    HG   SER  68           HG       SER  68  -8.572  -1.113   8.608
  543    H    SER  69           HN       SER  69  -7.206  -1.769   4.428
  544    HA   SER  69           HA       SER  69  -7.433   0.798   3.383
  545    HB2  SER  69           2HB      SER  69  -5.930  -1.507   2.129
  546    HB3  SER  69           1HB      SER  69  -5.575   0.214   1.963
  547    HG   SER  69           HG       SER  69  -5.639  -0.378   4.558
  548    H    ALA  70           HN       ALA  70  -8.595  -2.283   2.212
  549    HA   ALA  70           HA       ALA  70  -9.227  -1.629  -0.411
  550    HB1  ALA  70           1HB      ALA  70 -10.748  -3.541  -0.312
  551    HB2  ALA  70           2HB      ALA  70 -10.602  -3.561   1.445
  552    HB3  ALA  70           3HB      ALA  70  -9.196  -3.906   0.439
  553    H    LYS  71           HN       LYS  71 -11.316  -1.538   2.494
  554    HA   LYS  71           HA       LYS  71 -13.481  -0.388   0.995
  555    HB2  LYS  71           2HB      LYS  71 -14.732  -0.391   3.059
  556    HB3  LYS  71           1HB      LYS  71 -13.892  -1.921   2.894
  557    HG2  LYS  71           2HG      LYS  71 -12.176  -1.114   4.470
  558    HG3  LYS  71           1HG      LYS  71 -13.099   0.378   4.669
  559    HD2  LYS  71           2HD      LYS  71 -15.043  -1.005   5.406
  560    HD3  LYS  71           1HD      LYS  71 -13.993  -2.422   5.354
  561    HE2  LYS  71           2HE      LYS  71 -14.098  -1.645   7.617
  562    HE3  LYS  71           1HE      LYS  71 -12.494  -1.285   6.984
  563    HZ1  LYS  71           3HZ      LYS  71 -13.355   0.589   8.210
  564    HZ2  LYS  71           1HZ      LYS  71 -14.741   0.636   7.243
  565    HZ3  LYS  71           2HZ      LYS  71 -13.239   1.000   6.576
  566    H    ALA  72           HN       ALA  72 -10.695   0.856   2.235
  567    HA   ALA  72           HA       ALA  72 -11.789   3.503   2.763
  568    HB1  ALA  72           1HB      ALA  72 -10.029   2.662   4.254
  569    HB2  ALA  72           2HB      ALA  72  -9.487   4.091   3.375
  570    HB3  ALA  72           3HB      ALA  72  -8.942   2.489   2.875
  571    H    ARG  73           HN       ARG  73 -11.054   1.672   0.199
  572    HA   ARG  73           HA       ARG  73 -10.774   2.021  -2.004
  573    HB2  ARG  73           2HB      ARG  73 -12.334   3.990  -1.487
  574    HB3  ARG  73           1HB      ARG  73 -10.896   4.996  -1.500
  575    HG2  ARG  73           2HG      ARG  73 -12.077   5.092  -3.629
  576    HG3  ARG  73           1HG      ARG  73 -10.473   4.381  -3.821
  577    HD2  ARG  73           2HD      ARG  73 -11.431   2.157  -3.858
  578    HD3  ARG  73           1HD      ARG  73 -13.036   2.814  -3.551
  579    HE   ARG  73           HE       ARG  73 -12.418   4.064  -5.799
  580   HH11  ARG  73          1HH1      ARG  73 -11.953   0.705  -4.917
  581   HH12  ARG  73          2HH1      ARG  73 -12.164   0.108  -6.526
  582   HH21  ARG  73          1HH2      ARG  73 -12.676   3.292  -7.951
  583   HH22  ARG  73          2HH2      ARG  73 -12.572   1.595  -8.269
  584    H    GLY  74           HN       GLY  74  -8.579   2.410   0.154
  585    HA2  GLY  74           2HA      GLY  74  -6.276   2.311  -0.063
  586    HA3  GLY  74           1HA      GLY  74  -6.443   2.757  -1.753
  587    H    ASP  75           HN       ASP  75  -7.931   5.142  -1.328
  588    HA   ASP  75           HA       ASP  75  -5.737   6.923  -0.954
  589    HB2  ASP  75           2HB      ASP  75  -7.399   7.489  -2.584
  590    HB3  ASP  75           1HB      ASP  75  -8.677   7.443  -1.375
  591    H    LEU  76           HN       LEU  76  -5.007   7.819   0.809
  592    HA   LEU  76           HA       LEU  76  -6.603   7.749   3.259
  593    HB2  LEU  76           2HB      LEU  76  -3.694   8.305   2.714
  594    HB3  LEU  76           1HB      LEU  76  -4.424   8.582   4.280
  595    HG   LEU  76           HG       LEU  76  -4.295   5.906   2.900
  596   HD11  LEU  76          1HD1      LEU  76  -2.647   7.024   5.166
  597   HD12  LEU  76          2HD1      LEU  76  -2.074   6.698   3.530
  598   HD13  LEU  76          3HD1      LEU  76  -2.587   5.367   4.565
  599   HD21  LEU  76          3HD2      LEU  76  -4.956   5.051   5.109
  600   HD22  LEU  76          1HD2      LEU  76  -6.190   6.099   4.411
  601   HD23  LEU  76          2HD2      LEU  76  -5.135   6.707   5.685
  602    H    GLY  77           HN       GLY  77  -5.816   9.840   0.749
  603    HA2  GLY  77           2HA      GLY  77  -6.455  12.046   0.474
  604    HA3  GLY  77           1HA      GLY  77  -6.926  12.093   2.171
  605    H    ALA  78           HN       ALA  78  -5.836  14.223   2.015
  606    HA   ALA  78           HA       ALA  78  -2.956  14.198   1.853
  607    HB1  ALA  78           1HB      ALA  78  -3.115  16.587   2.335
  608    HB2  ALA  78           2HB      ALA  78  -4.836  16.412   2.683
  609    HB3  ALA  78           3HB      ALA  78  -4.234  16.134   1.049
  610    H    PHE  79           HN       PHE  79  -1.782  13.442   3.478
  611    HA   PHE  79           HA       PHE  79  -2.730  13.966   6.208
  612    HB2  PHE  79           2HB      PHE  79  -1.590  11.853   6.898
  613    HB3  PHE  79           1HB      PHE  79  -2.955  11.609   5.820
  614    HD1  PHE  79           1HD      PHE  79   0.683  11.403   6.169
  615    HD2  PHE  79           2HD      PHE  79  -2.635  10.779   3.579
  616    HE1  PHE  79           1HE      PHE  79   2.104  10.059   4.676
  617    HE2  PHE  79           2HE      PHE  79  -1.223   9.439   2.083
  618    HZ   PHE  79           HZ       PHE  79   1.151   9.075   2.630
  619    H    SER  80           HN       SER  80  -1.035  14.013   7.846
  620    HA   SER  80           HA       SER  80   1.259  15.522   6.843
  621    HB2  SER  80           2HB      SER  80  -0.269  16.571   8.525
  622    HB3  SER  80           1HB      SER  80   0.182  15.308   9.667
  623    HG   SER  80           HG       SER  80   1.848  16.466  10.137
  624    H    ARG  81           HN       ARG  81   3.291  15.265   8.147
  625    HA   ARG  81           HA       ARG  81   4.102  12.525   8.099
  626    HB2  ARG  81           2HB      ARG  81   5.613  14.904   9.190
  627    HB3  ARG  81           1HB      ARG  81   6.295  13.357   8.713
  628    HG2  ARG  81           2HG      ARG  81   5.624  13.809   6.391
  629    HG3  ARG  81           1HG      ARG  81   5.012  15.385   6.896
  630    HD2  ARG  81           2HD      ARG  81   7.282  15.964   7.689
  631    HD3  ARG  81           1HD      ARG  81   7.862  14.418   7.071
  632    HE   ARG  81           HE       ARG  81   6.531  16.234   5.207
  633   HH11  ARG  81          1HH1      ARG  81   9.528  14.794   6.338
  634   HH12  ARG  81          2HH1      ARG  81  10.414  15.241   4.920
  635   HH21  ARG  81          1HH2      ARG  81   7.711  16.808   3.343
  636   HH22  ARG  81          2HH2      ARG  81   9.382  16.363   3.209
  637    H    GLY  82           HN       GLY  82   3.778  11.115   9.690
  638    HA2  GLY  82           2HA      GLY  82   4.429  10.631  12.039
  639    HA3  GLY  82           1HA      GLY  82   3.668  12.160  12.453
  640    H    GLN  83           HN       GLN  83   2.323  10.011  10.078
  641    HA   GLN  83           HA       GLN  83   0.081   9.525  11.922
  642    HB2  GLN  83           2HB      GLN  83   0.104   9.687   8.907
  643    HB3  GLN  83           1HB      GLN  83  -1.292   9.221   9.865
  644    HG2  GLN  83           2HG      GLN  83   0.122  11.874   9.988
  645    HG3  GLN  83           1HG      GLN  83  -1.406  11.551   9.172
  646   HE21  GLN  83          1HE2      GLN  83  -2.399   9.780  11.236
  647   HE22  GLN  83          2HE2      GLN  83  -2.818  10.774  12.585
  648    H    MET  84           HN       MET  84   2.468   8.066   9.891
  649    HA   MET  84           HA       MET  84   1.389   5.435  10.646
  650    HB2  MET  84           2HB      MET  84   0.966   6.117   8.216
  651    HB3  MET  84           1HB      MET  84   2.703   6.011   7.988
  652    HG2  MET  84           2HG      MET  84   1.439   4.011   7.250
  653    HG3  MET  84           1HG      MET  84   2.693   3.671   8.438
  654    HE1  MET  84           3HE      MET  84  -1.159   4.144   7.833
  655    HE2  MET  84           1HE      MET  84  -0.835   5.298   9.127
  656    HE3  MET  84           2HE      MET  84  -1.812   3.866   9.448
  657    H    GLN  85           HN       GLN  85   3.274   3.738  10.003
  658    HA   GLN  85           HA       GLN  85   5.434   4.234  11.729
  659    HB2  GLN  85           2HB      GLN  85   5.258   2.186   9.507
  660    HB3  GLN  85           1HB      GLN  85   6.365   2.139  10.869
  661    HG2  GLN  85           2HG      GLN  85   3.363   1.941  11.029
  662    HG3  GLN  85           1HG      GLN  85   4.499   0.602  11.173
  663   HE21  GLN  85          1HE2      GLN  85   6.415   2.126  12.735
  664   HE22  GLN  85          2HE2      GLN  85   5.739   2.303  14.311
  665    H    LYS  86           HN       LYS  86   7.688   4.485  11.223
  666    HA   LYS  86           HA       LYS  86   8.143   6.566   9.442
  667    HB2  LYS  86           2HB      LYS  86   9.527   6.092  11.448
  668    HB3  LYS  86           1HB      LYS  86  10.261   4.747  10.592
  669    HG2  LYS  86           2HG      LYS  86  11.647   6.798  10.595
  670    HG3  LYS  86           1HG      LYS  86  11.240   6.229   8.974
  671    HD2  LYS  86           2HD      LYS  86   9.505   7.903   8.774
  672    HD3  LYS  86           1HD      LYS  86   9.755   8.411  10.445
  673    HE2  LYS  86           2HE      LYS  86  11.879   8.558   8.315
  674    HE3  LYS  86           1HE      LYS  86  10.787   9.889   8.690
  675    HZ1  LYS  86           3HZ      LYS  86  12.868  10.145   9.847
  676    HZ2  LYS  86           1HZ      LYS  86  12.710   8.627  10.573
  677    HZ3  LYS  86           2HZ      LYS  86  11.633   9.871  10.959
  678    HA   PRO  87           HA       PRO  87  10.285   3.252   6.411
  679    HB2  PRO  87           2HB      PRO  87   8.304   1.083   6.932
  680    HB3  PRO  87           1HB      PRO  87  10.014   0.961   6.502
  681    HG2  PRO  87           2HG      PRO  87   9.231   0.504   8.990
  682    HG3  PRO  87           1HG      PRO  87  10.723   1.404   8.669
  683    HD2  PRO  87           2HD      PRO  87   8.048   2.411   9.540
  684    HD3  PRO  87           1HD      PRO  87   9.669   2.952  10.019
  685    H    PHE  88           HN       PHE  88   6.935   3.694   7.199
  686    HA   PHE  88           HA       PHE  88   6.043   3.471   4.440
  687    HB2  PHE  88           2HB      PHE  88   4.641   2.620   6.314
  688    HB3  PHE  88           1HB      PHE  88   4.527   4.254   6.947
  689    HD1  PHE  88           1HD      PHE  88   3.324   6.001   5.569
  690    HD2  PHE  88           2HD      PHE  88   3.176   1.845   4.661
  691    HE1  PHE  88           1HE      PHE  88   1.296   6.372   4.230
  692    HE2  PHE  88           2HE      PHE  88   1.150   2.211   3.315
  693    HZ   PHE  88           HZ       PHE  88   0.209   4.478   3.101
  694    H    GLU  89           HN       GLU  89   6.222   5.906   7.011
  695    HA   GLU  89           HA       GLU  89   5.279   8.122   5.576
  696    HB2  GLU  89           2HB      GLU  89   6.040   7.646   8.150
  697    HB3  GLU  89           1HB      GLU  89   7.368   8.649   7.586
  698    HG2  GLU  89           2HG      GLU  89   5.890  10.182   8.473
  699    HG3  GLU  89           1HG      GLU  89   5.526  10.236   6.748
  700    H    ASP  90           HN       ASP  90   8.446   6.677   5.806
  701    HA   ASP  90           HA       ASP  90   9.934   8.792   4.654
  702    HB2  ASP  90           2HB      ASP  90  11.039   7.063   5.951
  703    HB3  ASP  90           1HB      ASP  90  10.514   5.828   4.812
  704    H    ALA  91           HN       ALA  91   8.013   6.237   3.331
  705    HA   ALA  91           HA       ALA  91   9.132   6.540   0.674
  706    HB1  ALA  91           1HB      ALA  91   7.551   4.760   0.056
  707    HB2  ALA  91           2HB      ALA  91   6.903   4.792   1.697
  708    HB3  ALA  91           3HB      ALA  91   8.575   4.310   1.420
  709    H    SER  92           HN       SER  92   6.093   7.211   2.374
  710    HA   SER  92           HA       SER  92   4.588   8.019   0.164
  711    HB2  SER  92           2HB      SER  92   3.263   9.305   1.939
  712    HB3  SER  92           1HB      SER  92   3.421   7.562   2.166
  713    HG   SER  92           HG       SER  92   3.860   8.813   4.084
  714    H    PHE  93           HN       PHE  93   6.613   9.925   2.360
  715    HA   PHE  93           HA       PHE  93   6.077  12.333   0.839
  716    HB2  PHE  93           2HB      PHE  93   7.688  11.821   3.334
  717    HB3  PHE  93           1HB      PHE  93   7.629  13.392   2.541
  718    HD1  PHE  93           1HD      PHE  93   5.734  10.919   4.465
  719    HD2  PHE  93           2HD      PHE  93   5.634  14.741   2.597
  720    HE1  PHE  93           1HE      PHE  93   3.647  11.445   5.660
  721    HE2  PHE  93           2HE      PHE  93   3.549  15.273   3.788
  722    HZ   PHE  93           HZ       PHE  93   2.553  13.624   5.322
  723    H    ALA  94           HN       ALA  94   7.797   9.902  -0.051
  724    HA   ALA  94           HA       ALA  94  10.075  11.521  -0.988
  725    HB1  ALA  94           1HB      ALA  94  11.315   9.445  -1.274
  726    HB2  ALA  94           2HB      ALA  94   9.919   8.518  -0.724
  727    HB3  ALA  94           3HB      ALA  94  10.752   9.602   0.390
  728    H    LEU  95           HN       LEU  95   7.163  10.440  -1.891
  729    HA   LEU  95           HA       LEU  95   7.903   9.655  -4.595
  730    HB2  LEU  95           2HB      LEU  95   5.223   9.762  -3.224
  731    HB3  LEU  95           1HB      LEU  95   5.482   9.221  -4.869
  732    HG   LEU  95           HG       LEU  95   6.573   7.892  -2.393
  733   HD11  LEU  95          1HD1      LEU  95   4.372   7.071  -4.276
  734   HD12  LEU  95          2HD1      LEU  95   4.166   7.636  -2.619
  735   HD13  LEU  95          3HD1      LEU  95   4.997   6.113  -2.935
  736   HD21  LEU  95          3HD2      LEU  95   7.249   6.106  -3.930
  737   HD22  LEU  95          1HD2      LEU  95   8.068   7.623  -4.294
  738   HD23  LEU  95          2HD2      LEU  95   6.720   7.086  -5.295
  739    H    ARG  96           HN       ARG  96   7.115  10.711  -6.402
  740    HA   ARG  96           HA       ARG  96   6.636  13.567  -5.990
  741    HB2  ARG  96           2HB      ARG  96   7.292  12.070  -8.539
  742    HB3  ARG  96           1HB      ARG  96   7.288  13.818  -8.323
  743    HG2  ARG  96           2HG      ARG  96   9.159  13.716  -6.842
  744    HG3  ARG  96           1HG      ARG  96   9.086  11.957  -6.790
  745    HD2  ARG  96           2HD      ARG  96  10.874  12.540  -8.233
  746    HD3  ARG  96           1HD      ARG  96   9.559  11.967  -9.253
  747    HE   ARG  96           HE       ARG  96   9.094  14.540  -9.371
  748   HH11  ARG  96          1HH1      ARG  96  12.205  12.924  -9.440
  749   HH12  ARG  96          2HH1      ARG  96  12.948  14.119 -10.447
  750   HH21  ARG  96          1HH2      ARG  96  10.068  16.128 -10.681
  751   HH22  ARG  96          2HH2      ARG  96  11.722  15.960 -11.153
  752    H    THR  97           HN       THR  97   5.162  14.475  -7.934
  753    HA   THR  97           HA       THR  97   2.558  13.608  -7.361
  754    HB   THR  97           HB       THR  97   3.425  15.224  -9.763
  755    HG1  THR  97           1HG      THR  97   2.462  16.597  -7.601
  756   HG21  THR  97          3HG2      THR  97   1.093  14.457  -9.832
  757   HG22  THR  97          1HG2      THR  97   1.177  16.200  -9.585
  758   HG23  THR  97          2HG2      THR  97   0.819  15.133  -8.228
  759    H    GLY  98           HN       GLY  98   1.557  11.822  -8.013
  760    HA2  GLY  98           2HA      GLY  98   0.679  10.258  -9.462
  761    HA3  GLY  98           1HA      GLY  98   1.538  11.043 -10.781
  762    H    GLU  99           HN       GLU  99   3.160  10.011  -7.887
  763    HA   GLU  99           HA       GLU  99   4.501   7.938  -9.479
  764    HB2  GLU  99           2HB      GLU  99   5.880   9.924  -8.864
  765    HB3  GLU  99           1HB      GLU  99   5.642   9.515  -7.175
  766    HG2  GLU  99           2HG      GLU  99   6.886   7.512  -7.401
  767    HG3  GLU  99           1HG      GLU  99   6.916   7.659  -9.158
  768    H    MET 100           HN       MET 100   4.894   5.966  -8.561
  769    HA   MET 100           HA       MET 100   3.548   5.429  -6.005
  770    HB2  MET 100           2HB      MET 100   2.340   4.500  -7.967
  771    HB3  MET 100           1HB      MET 100   3.786   3.608  -8.408
  772    HG2  MET 100           2HG      MET 100   3.642   2.300  -6.381
  773    HG3  MET 100           1HG      MET 100   2.253   3.242  -5.844
  774    HE1  MET 100           3HE      MET 100   2.207   0.392  -9.477
  775    HE2  MET 100           1HE      MET 100   3.600   0.617  -8.420
  776    HE3  MET 100           2HE      MET 100   3.072   1.928  -9.477
  777    H    SER 101           HN       SER 101   4.581   4.051  -4.584
  778    HA   SER 101           HA       SER 101   7.435   3.816  -4.976
  779    HB2  SER 101           2HB      SER 101   7.466   3.099  -2.631
  780    HB3  SER 101           1HB      SER 101   6.538   4.585  -2.809
  781    HG   SER 101           HG       SER 101   5.622   1.955  -2.364
  782    H    GLY 102           HN       GLY 102   8.407   1.693  -4.094
  783    HA2  GLY 102           2HA      GLY 102   7.186  -0.504  -5.551
  784    HA3  GLY 102           1HA      GLY 102   8.790  -0.490  -4.821
  785    HA   PRO 103           HA       PRO 103   5.991  -2.975  -2.081
  786    HB2  PRO 103           2HB      PRO 103   7.810  -4.953  -1.610
  787    HB3  PRO 103           1HB      PRO 103   6.688  -4.974  -2.974
  788    HG2  PRO 103           2HG      PRO 103   9.572  -4.190  -2.904
  789    HG3  PRO 103           1HG      PRO 103   8.692  -5.124  -4.128
  790    HD2  PRO 103           2HD      PRO 103   9.303  -2.504  -4.439
  791    HD3  PRO 103           1HD      PRO 103   7.847  -3.238  -5.140
  792    H    VAL 104           HN       VAL 104   5.927  -1.942  -0.169
  793    HA   VAL 104           HA       VAL 104   8.390  -1.419   1.306
  794    HB   VAL 104           HB       VAL 104   5.527  -0.726   2.030
  795   HG11  VAL 104          1HG1      VAL 104   8.130   0.221   3.227
  796   HG12  VAL 104          2HG1      VAL 104   6.972  -0.869   3.987
  797   HG13  VAL 104          3HG1      VAL 104   6.526   0.806   3.667
  798   HG21  VAL 104          3HG2      VAL 104   6.089   1.560   1.348
  799   HG22  VAL 104          1HG2      VAL 104   6.245   0.432   0.001
  800   HG23  VAL 104          2HG2      VAL 104   7.687   1.014   0.836
  801    H    PHE 105           HN       PHE 105   9.152  -3.061   2.447
  802    HA   PHE 105           HA       PHE 105   7.417  -5.219   3.275
  803    HB2  PHE 105           2HB      PHE 105  10.398  -4.865   3.570
  804    HB3  PHE 105           1HB      PHE 105   9.504  -6.330   3.956
  805    HD1  PHE 105           2HD      PHE 105   8.414  -7.614   2.132
  806    HD2  PHE 105           1HD      PHE 105  11.022  -4.345   1.352
  807    HE1  PHE 105           2HE      PHE 105   8.688  -8.391  -0.185
  808    HE2  PHE 105           1HE      PHE 105  11.300  -5.115  -0.967
  809    HZ   PHE 105           HZ       PHE 105  10.134  -7.141  -1.738
  810    H    THR 106           HN       THR 106   6.513  -5.393   5.175
  811    HA   THR 106           HA       THR 106   7.861  -4.325   7.543
  812    HB   THR 106           HB       THR 106   5.625  -3.628   8.447
  813    HG1  THR 106           1HG      THR 106   4.872  -4.541   5.944
  814   HG21  THR 106          3HG2      THR 106   5.519  -1.495   7.216
  815   HG22  THR 106          1HG2      THR 106   6.552  -2.181   5.959
  816   HG23  THR 106          2HG2      THR 106   7.183  -1.948   7.589
  817    H    ASP 107           HN       ASP 107   6.286  -5.133   9.517
  818    HA   ASP 107           HA       ASP 107   6.522  -7.996   9.377
  819    HB2  ASP 107           2HB      ASP 107   5.401  -6.283  11.606
  820    HB3  ASP 107           1HB      ASP 107   5.852  -7.978  11.727
  821    H    SER 108           HN       SER 108   3.906  -5.661   9.373
  822    HA   SER 108           HA       SER 108   1.814  -7.558   9.733
  823    HB2  SER 108           2HB      SER 108   1.610  -4.823   8.457
  824    HB3  SER 108           1HB      SER 108   0.322  -5.735   9.246
  825    HG   SER 108           HG       SER 108   2.101  -5.602  11.075
  826    H    GLY 109           HN       GLY 109   3.537  -6.281   6.979
  827    HA2  GLY 109           2HA      GLY 109   3.108  -8.305   5.228
  828    HA3  GLY 109           1HA      GLY 109   1.689  -7.285   5.022
  829    H    ILE 110           HN       ILE 110   2.209  -6.663   2.947
  830    HA   ILE 110           HA       ILE 110   4.582  -4.930   2.732
  831    HB   ILE 110           HB       ILE 110   3.254  -6.490   0.495
  832   HG12  ILE 110          2HG1      ILE 110   5.942  -6.911   1.827
  833   HG13  ILE 110          1HG1      ILE 110   4.519  -7.914   2.083
  834   HG21  ILE 110          1HG2      ILE 110   5.718  -4.745   0.507
  835   HG22  ILE 110          2HG2      ILE 110   4.191  -4.398  -0.303
  836   HG23  ILE 110          3HG2      ILE 110   5.191  -5.746  -0.846
  837   HD11  ILE 110          3HD1      ILE 110   6.082  -8.960   0.553
  838   HD12  ILE 110          1HD1      ILE 110   5.988  -7.562  -0.518
  839   HD13  ILE 110          2HD1      ILE 110   4.566  -8.576  -0.263
  840    H    HIS 111           HN       HIS 111   4.262  -2.878   2.108
  841    HA   HIS 111           HA       HIS 111   1.471  -2.081   1.555
  842    HB2  HIS 111           2HB      HIS 111   3.668  -0.271   2.585
  843    HB3  HIS 111           1HB      HIS 111   1.951   0.073   2.506
  844    HD1  HIS 111           1HD      HIS 111   0.637  -0.385   4.596
  845    HD2  HIS 111           2HD      HIS 111   4.342  -2.255   4.606
  846    HE1  HIS 111           1HE      HIS 111   0.927  -1.292   6.921
  847    HE2  HIS 111           2HE      HIS 111   3.119  -2.536   6.861
  848    H    ILE 112           HN       ILE 112   1.017  -0.811  -0.180
  849    HA   ILE 112           HA       ILE 112   3.279   0.078  -1.860
  850    HB   ILE 112           HB       ILE 112   0.465  -0.366  -2.872
  851   HG12  ILE 112          2HG1      ILE 112   2.784  -2.311  -3.036
  852   HG13  ILE 112          1HG1      ILE 112   1.333  -2.533  -2.062
  853   HG21  ILE 112          1HG2      ILE 112   1.913   1.118  -4.176
  854   HG22  ILE 112          2HG2      ILE 112   1.540  -0.359  -5.065
  855   HG23  ILE 112          3HG2      ILE 112   3.117  -0.165  -4.299
  856   HD11  ILE 112          3HD1      ILE 112   1.222  -3.837  -4.108
  857   HD12  ILE 112          1HD1      ILE 112   1.438  -2.374  -5.067
  858   HD13  ILE 112          2HD1      ILE 112  -0.019  -2.587  -4.097
  859    H    ILE 113           HN       ILE 113   3.281   2.244  -2.416
  860    HA   ILE 113           HA       ILE 113   1.041   3.857  -1.385
  861    HB   ILE 113           HB       ILE 113   3.967   4.595  -1.260
  862   HG12  ILE 113          2HG1      ILE 113   2.150   3.785   1.018
  863   HG13  ILE 113          1HG1      ILE 113   3.352   2.732   0.282
  864   HG21  ILE 113          1HG2      ILE 113   1.523   5.932  -0.097
  865   HG22  ILE 113          2HG2      ILE 113   2.485   6.520  -1.451
  866   HG23  ILE 113          3HG2      ILE 113   3.189   6.446   0.165
  867   HD11  ILE 113          3HD1      ILE 113   5.115   4.253   0.978
  868   HD12  ILE 113          1HD1      ILE 113   4.164   3.698   2.354
  869   HD13  ILE 113          2HD1      ILE 113   3.914   5.320   1.705
  870    H    LEU 114           HN       LEU 114   0.331   5.443  -2.725
  871    HA   LEU 114           HA       LEU 114   1.997   6.194  -5.023
  872    HB2  LEU 114           2HB      LEU 114   0.226   4.450  -5.615
  873    HB3  LEU 114           1HB      LEU 114  -0.971   5.671  -5.254
  874    HG   LEU 114           HG       LEU 114   1.145   6.111  -7.361
  875   HD11  LEU 114          1HD1      LEU 114  -1.586   4.893  -7.725
  876   HD12  LEU 114          2HD1      LEU 114  -0.042   4.067  -7.936
  877   HD13  LEU 114          3HD1      LEU 114  -0.494   5.382  -9.021
  878   HD21  LEU 114          3HD2      LEU 114  -0.484   7.702  -8.250
  879   HD22  LEU 114          1HD2      LEU 114  -0.067   8.093  -6.581
  880   HD23  LEU 114          2HD2      LEU 114  -1.600   7.300  -6.945
  881    H    ARG 115           HN       ARG 115   2.282   8.319  -5.003
  882    HA   ARG 115           HA       ARG 115   0.499   9.991  -3.424
  883    HB2  ARG 115           2HB      ARG 115   2.848  10.406  -3.105
  884    HB3  ARG 115           1HB      ARG 115   3.104  10.591  -4.836
  885    HG2  ARG 115           2HG      ARG 115   1.671  12.605  -4.802
  886    HG3  ARG 115           1HG      ARG 115   1.522  12.437  -3.053
  887    HD2  ARG 115           2HD      ARG 115   3.824  12.874  -2.725
  888    HD3  ARG 115           1HD      ARG 115   4.178  12.679  -4.442
  889    HE   ARG 115           HE       ARG 115   2.316  14.806  -3.880
  890   HH11  ARG 115          1HH1      ARG 115   5.743  14.008  -4.052
  891   HH12  ARG 115          2HH1      ARG 115   6.215  15.618  -4.492
  892   HH21  ARG 115          1HH2      ARG 115   2.951  16.919  -4.433
  893   HH22  ARG 115          2HH2      ARG 115   4.626  17.283  -4.701
  894    H    THR 116           HN       THR 116  -1.219  10.872  -4.307
  895    HA   THR 116           HA       THR 116  -1.321  11.276  -7.186
  896    HB   THR 116           HB       THR 116  -3.742  11.939  -6.614
  897    HG1  THR 116           1HG      THR 116  -4.221  10.711  -4.492
  898   HG21  THR 116          3HG2      THR 116  -3.127   9.778  -7.609
  899   HG22  THR 116          1HG2      THR 116  -4.435   9.590  -6.442
  900   HG23  THR 116          2HG2      THR 116  -2.790   9.133  -6.003
  901    H    GLU 117           HN       GLU 117  -1.351  13.069  -4.170
  902    HA   GLU 117           HA       GLU 117  -1.009  15.548  -5.693
  903    HB2  GLU 117           2HB      GLU 117  -2.742  15.208  -3.236
  904    HB3  GLU 117           1HB      GLU 117  -2.341  16.745  -3.978
  905    HG2  GLU 117           2HG      GLU 117  -3.535  16.170  -5.971
  906    HG3  GLU 117           1HG      GLU 117  -3.812  14.533  -5.385