*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   18-FEB-05   1YWL              
*TITLE     SOLUTION NMR STRUCTURE OF THE PROTEIN EF2693 FROM E.                  
*TITLE    2 FAECALIS: NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET            
*TITLE    3 EFR36                                                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HYPOTHETICAL UPF0213 PROTEIN EF2693;                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECALIS;                          
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: EF2693;                                                        
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)PMGK;                             
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET21                                     
*KEYWDS    ALPHA AND BETA, STRUCTURAL GENOMICS, NORTHEAST STRUCTURAL             
*KEYWDS   2 GENOMICS CONSORTIUM (NESG), PROTEIN STRUCTURE INITIATIVE             
*KEYWDS   3 (PSI)                                                                
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG)                       
*REVDAT   1   29-MAR-05 1YWL    0                                                

# created by  NOESY_Assign Version 2.0.0 Copyright(C) 1995-2003


#E2
#    2 GLU  HB2     2 GLU  QG      6.00       #both,m;dg  EfR36_CNOESY.list10
#    2 GLU  HB3     2 GLU  QG      6.00       #both,m;dg  EfR36_CNOESY.list10
    2 GLU  QB      3 ASN  HD21    6.00       #m;one,both  EfR36_Nnoesy.list10
    2 GLU  QB      3 ASN  HD22    6.00       #m;one,both  EfR36_Nnoesy.list10
    2 GLU  QB     26 GLU  QG      7.00       #m;one,m;one  EfR36_CNOESY.list10
#    2 GLU  HA      2 GLU  HB2     5.00       #,both  EfR36_CNOESY.list10
#    2 GLU  HA      2 GLU  HB3     5.00       #,both  EfR36_CNOESY.list10
    2 GLU  HA      2 GLU  QG      6.00       #,m;dg  EfR36_CNOESY.list10
    2 GLU  HA      3 ASN  HN      5.00       #,  EfR36_Nnoesy.list10
    2 GLU  HA      3 ASN  HA      5.00       #,  EfR36_CNOESY.list10

#N3
    3 ASN  HN      3 ASN  HA      5.00       #,  EfR36_CNOESY.list10
    3 ASN  HN      3 ASN  QB      6.00       #,m;one  EfR36_Nnoesy.list10
    3 ASN  HN     25 THR  HB      5.00       #,  EfR36_Nnoesy.list10
    3 ASN  HN     26 GLU  HA      2.90       #,  EfR36_Nnoesy.list10
#    3 ASN  HA      3 ASN  HB2     5.00       #,both  EfR36_CNOESY.list10
#    3 ASN  HA      3 ASN  HB3     5.00       #,both  EfR36_CNOESY.list10
    3 ASN  HA      4 LYS  HN      3.50       #,  EfR36_Nnoesy.list10
    3 ASN  HA      4 LYS  HA      5.00       #,  EfR36_CNOESY.list10
    3 ASN  HA     25 THR  HB      3.50       #,  EfR36_CNOESY.list10
    3 ASN  HA     26 GLU  QB      6.00       #,m;one  EfR36_CNOESY.list10
    3 ASN  QB      3 ASN  HD21    6.00       #m;one,both  EfR36_Nnoesy.list10
    3 ASN  QB      3 ASN  HD22    6.00       #m;one,both  EfR36_Nnoesy.list10
    3 ASN  QB      3 ASN  HD21    6.00       #m;one,both  EfR36_CNOESY.list10
    3 ASN  QB      3 ASN  HD22    6.00       #m;one,both  EfR36_CNOESY.list10
    3 ASN  QB      4 LYS  HN      6.00       #m;one,  EfR36_Nnoesy.list10
    3 ASN  HD21   26 GLU  HA      5.00       #both,  EfR36_Nnoesy.list10
    3 ASN  HD22   26 GLU  HA      5.00       #both,  EfR36_Nnoesy.list10

#K4
    4 LYS  HN      4 LYS  HA      3.50       #,  EfR36_Nnoesy.list10
    4 LYS  HN      4 LYS  HB2     5.00       #,both  EfR36_CNOESY.list10
    4 LYS  HN      4 LYS  HB3     5.00       #,both  EfR36_CNOESY.list10
    4 LYS  HN      4 LYS  QG      6.00       #,m;dg  EfR36_Nnoesy.list10
    4 LYS  HN     26 GLU  QG      6.00       #,m;one  EfR36_Nnoesy.list10
#    4 LYS  HA      4 LYS  HB2     5.00       #,both  EfR36_CNOESY.list10
#    4 LYS  HA      4 LYS  HB3     5.00       #,both  EfR36_CNOESY.list10
    4 LYS  HA      4 LYS  QG      6.00       #,m;dg  EfR36_CNOESY.list10
    4 LYS  HA      4 LYS  QD      6.00       #,m;dd  EfR36_CNOESY.list10
    4 LYS  HA      5 LYS  HN      2.90       #,  EfR36_Nnoesy.list10
#    4 LYS  QB      4 LYS  QG      7.00       #m;one,m;dg  EfR36_CNOESY.list10
    4 LYS  QB      4 LYS  QD      7.00       #m;one,m;dd  EfR36_CNOESY.list10
    4 LYS  HB2     5 LYS  HN      5.00       #both,  EfR36_Nnoesy.list10
    4 LYS  HB3     5 LYS  HN      5.00       #both,  EfR36_Nnoesy.list10
    4 LYS  HB2    26 GLU  QG      6.00       #both,m;one  EfR36_CNOESY.list10
    4 LYS  HB3    26 GLU  QG      6.00       #both,m;one  EfR36_CNOESY.list10
#    4 LYS  QG      4 LYS  QD      7.00       #m;dg,m;dd  EfR36_CNOESY.list10
    4 LYS  QG      4 LYS  QE      7.00       #m;dg,m;de  EfR36_CNOESY.list10
    4 LYS  QG      5 LYS  HN      6.00       #m;dg,  EfR36_Nnoesy.list10
    4 LYS  QG      5 LYS  HA      6.00       #m;dg,  EfR36_CNOESY.list10
    4 LYS  QG      5 LYS  QB      7.00       #m;dg,m;db  EfR36_CNOESY.list10
#    4 LYS  QD      4 LYS  QE      7.00       #m;dd,m;de  EfR36_CNOESY.list10

#K5
    5 LYS  HN      5 LYS  HA      3.50       #,  EfR36_CNOESY.list10
    5 LYS  HN      5 LYS  QB      6.00       #,m;db  EfR36_Nnoesy.list10
    5 LYS  HN      5 LYS  QG      6.00       #,m;dg  EfR36_CNOESY.list10
    5 LYS  HN      5 LYS  QD      6.00       #,m;dd  EfR36_CNOESY.list10
    5 LYS  HN      5 LYS  QE      6.00       #,m;de  EfR36_Nnoesy.list10
    5 LYS  HN     25 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
#    5 LYS  HA      5 LYS  QB      6.00       #,m;db  EfR36_CNOESY.list10
    5 LYS  HA      5 LYS  QG      6.00       #,m;dg  EfR36_CNOESY.list10
    5 LYS  HA      5 LYS  QD      6.00       #,m;dd  EfR36_CNOESY.list10
    5 LYS  HA      6 SER  HN      2.90       #,  EfR36_Nnoesy.list10
    5 LYS  HA     25 THR  HB      5.00       #,  EfR36_CNOESY.list10
    5 LYS  QB      5 LYS  QD      7.00       #m;db,m;dd  EfR36_CNOESY.list10
    5 LYS  QB      5 LYS  QE      7.00       #m;db,m;de  EfR36_CNOESY.list10
    5 LYS  QB      6 SER  HN      6.00       #m;db,  EfR36_CNOESY.list10
    5 LYS  QG      5 LYS  QE      7.00       #m;dg,m;de  EfR36_CNOESY.list10
    5 LYS  QG      6 SER  HN      6.00       #m;dg,  EfR36_CNOESY.list10
#    5 LYS  QD      5 LYS  QE      7.00       #m;dd,m;de  EfR36_CNOESY.list10

#S6
    6 SER  HN      6 SER  HA      5.00       #,  EfR36_CNOESY.list10
    6 SER  HN      6 SER  HB2     5.00       #,both  EfR36_CNOESY.list10
    6 SER  HN      6 SER  HB3     5.00       #,both  EfR36_CNOESY.list10
    6 SER  HN      7 HIS  HN      5.00       #,  EfR36_Nnoesy.list10
#    6 SER  HA      6 SER  HB2     5.00       #,both  EfR36_CNOESY.list10
#    6 SER  HA      6 SER  HB3     5.00       #,both  EfR36_CNOESY.list10
    6 SER  HA      7 HIS  HN      3.50       #,  EfR36_CNOESY.list10
    6 SER  HA     60 GLU  HA      5.00       #,  EfR36_CNOESY.list10
    6 SER  HB2     7 HIS  HN      5.00       #both,  EfR36_Nnoesy.list10
    6 SER  HB3     7 HIS  HN      5.00       #both,  EfR36_Nnoesy.list10
    6 SER  QB     58 LYS  QG      7.00       #m;one,m;one  EfR36_CNOESY.list10
    6 SER  QB     59 PHE  QB      7.00       #m;one,m;one  EfR36_CNOESY.list10
    6 SER  HB2    60 GLU  HA      5.00       #both,  EfR36_CNOESY.list10
    6 SER  HB3    60 GLU  HA      5.00       #both,  EfR36_CNOESY.list10
    6 SER  HB2     8 TYR  QE      7.00       #both,r;de  EfR36_CNOESY.list10
    6 SER  HB3     8 TYR  QE      7.00       #both,r;de  EfR36_CNOESY.list10

#H7
    7 HIS  HN      7 HIS  HA      5.00       #,  EfR36_CNOESY.list10
    7 HIS  HN      7 HIS  HB2     5.00       #,both  EfR36_Nnoesy.list10
    7 HIS  HN      7 HIS  HB3     5.00       #,both  EfR36_Nnoesy.list10
    7 HIS  HN     59 PHE  HN      5.00       #,  EfR36_Nnoesy.list10
    7 HIS  HN     65 ALA  QB      6.00       #,m;Me  EfR36_Nnoesy.list10
#    7 HIS  HA      7 HIS  HB2     5.00       #,both  EfR36_CNOESY.list10
#    7 HIS  HA      7 HIS  HB3     5.00       #,both  EfR36_CNOESY.list10
    7 HIS  HA      7 HIS  HD2     5.00       #,  EfR36_CNOESY.list10
    7 HIS  HA      8 TYR  HN      3.50       #,  EfR36_Nnoesy.list10
    7 HIS  HA      8 TYR  QB      6.00       #,m;one  EfR36_CNOESY.list10
    7 HIS  HA     23 TYR  QB      6.00       #,m;one  EfR36_CNOESY.list10
    7 HIS  HA     25 THR  HA      5.00       #,  EfR36_CNOESY.list10
    7 HIS  HA     25 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
    7 HIS  HB2     7 HIS  HD2     5.00       #both,  EfR36_CNOESY.list10
    7 HIS  HB3     7 HIS  HD2     5.00       #both,  EfR36_CNOESY.list10
    7 HIS  HB2     8 TYR  HN      5.00       #both,  EfR36_Nnoesy.list10
    7 HIS  HB3     8 TYR  HN      5.00       #both,  EfR36_Nnoesy.list10
    7 HIS  HB2    65 ALA  QB      6.00       #both,m;Me  EfR36_CNOESY.list10
    7 HIS  HB3    65 ALA  QB      6.00       #both,m;Me  EfR36_CNOESY.list10
    7 HIS  QB     23 TYR  QD      8.00       #m;one,r;dd  EfR36_CNOESY.list10
    7 HIS  HD2    25 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10

#Y8
    8 TYR  HN      8 TYR  HA      5.00       #,  EfR36_Nnoesy.list10
    8 TYR  HN      8 TYR  HB2     5.00       #,both  EfR36_Nnoesy.list10
    8 TYR  HN      8 TYR  HB3     5.00       #,both  EfR36_Nnoesy.list10
    8 TYR  HN     24 THR  HN      5.00       #,  EfR36_Nnoesy.list10
    8 TYR  HN     25 THR  HA      5.00       #,  EfR36_Nnoesy.list10
    8 TYR  HN     25 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
    8 TYR  HN      8 TYR  QD      7.00       #,r;dd  EfR36_Nnoesy.list10
#    8 TYR  HA      8 TYR  HB2     5.00       #,both  EfR36_CNOESY.list10
#    8 TYR  HA      8 TYR  HB3     5.00       #,both  EfR36_CNOESY.list10
    8 TYR  HA      9 PHE  HN      3.50       #,  EfR36_CNOESY.list10
    8 TYR  HA     57 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
    8 TYR  HA     58 LYS  HA      5.00       #,  EfR36_CNOESY.list10
    8 TYR  HA     59 PHE  HN      5.00       #,  EfR36_Nnoesy.list10
    8 TYR  HB2     9 PHE  HN      5.00       #both,  EfR36_Nnoesy.list10
    8 TYR  HB3     9 PHE  HN      5.00       #both,  EfR36_Nnoesy.list10
    8 TYR  QB     24 THR  HN      6.00       #m;one,  EfR36_Nnoesy.list10
    8 TYR  QB     24 THR  QG2     7.00       #m;one,m;Me  EfR36_CNOESY.list10
    8 TYR  HB2     8 TYR  QD      7.00       #both,r;dd  EfR36_CNOESY.list10
    8 TYR  HB3     8 TYR  QD      7.00       #both,r;dd  EfR36_CNOESY.list10
    8 TYR  QB     10 TYR  QD      8.00       #m;one,r;dd  EfR36_CNOESY.list10

#F9
    9 PHE  HN      9 PHE  HA      5.00       #,  EfR36_CNOESY.list10
    9 PHE  HN      9 PHE  HB2     5.00       #,both  EfR36_Nnoesy.list10
    9 PHE  HN      9 PHE  HB3     5.00       #,both  EfR36_Nnoesy.list10
    9 PHE  HN     57 GLU  HN      3.50       #,  EfR36_Nnoesy.list10
    9 PHE  HN     58 LYS  HA      5.00       #,  EfR36_Nnoesy.list10
    9 PHE  HN      9 PHE  QD      7.00       #,r;dd  EfR36_Nnoesy.list10
    9 PHE  HN     59 PHE  QD      7.00       #,r;dd  EfR36_Nnoesy.list10
    9 PHE  HN     59 PHE  QE      7.00       #,r;de  EfR36_Nnoesy.list10
#    9 PHE  HA      9 PHE  HB2     5.00       #,both  EfR36_CNOESY.list10
#    9 PHE  HA      9 PHE  HB3     5.00       #,both  EfR36_CNOESY.list10
    9 PHE  HA     10 TYR  HN      3.50       #,  EfR36_Nnoesy.list10
    9 PHE  HA     23 TYR  HA      5.00       #,  EfR36_CNOESY.list10
    9 PHE  HA      9 PHE  QD      6.00       #,m;dd  EfR36_CNOESY.list10
    9 PHE  QB     56 THR  HA      6.00       #m;one,  EfR36_CNOESY.list10
    9 PHE  HB2    57 GLU  HN      5.00       #both,  EfR36_CNOESY.list10
    9 PHE  HB3    57 GLU  HN      5.00       #both,  EfR36_CNOESY.list10
    9 PHE  QB     57 GLU  HB2     6.00       #m;one,both  EfR36_CNOESY.list10
    9 PHE  QB     57 GLU  HB3     6.00       #m;one,both  EfR36_CNOESY.list10
    9 PHE  HB2    68 ALA  QB      6.00       #both,m;Me  EfR36_CNOESY.list10
    9 PHE  HB3    68 ALA  QB      6.00       #both,m;Me  EfR36_CNOESY.list10
    9 PHE  HB2     9 PHE  QD      7.00       #both,r;dd  EfR36_CNOESY.list10
    9 PHE  HB3     9 PHE  QD      7.00       #both,r;dd  EfR36_CNOESY.list10
    9 PHE  HB2    59 PHE  QD      7.00       #both,r;dd  EfR36_CNOESY.list10
    9 PHE  HB3    59 PHE  QD      7.00       #both,r;dd  EfR36_CNOESY.list10

#Y10
   10 TYR  HN     10 TYR  HA      5.00       #,  EfR36_Nnoesy.list10
   10 TYR  HN     10 TYR  HB2     5.00       #,both  EfR36_Nnoesy.list10
   10 TYR  HN     10 TYR  HB3     5.00       #,both  EfR36_Nnoesy.list10
   10 TYR  HN     22 GLY  HN      5.00       #,  EfR36_Nnoesy.list10
   10 TYR  HN     10 TYR  QD      7.00       #,r;dd  EfR36_Nnoesy.list10
#   10 TYR  HA     10 TYR  HB2     5.00       #,both  EfR36_CNOESY.list10
#   10 TYR  HA     10 TYR  HB3     5.00       #,both  EfR36_CNOESY.list10
   10 TYR  HA     11 VAL  HN      3.50       #,  EfR36_Nnoesy.list10
   10 TYR  HA     11 VAL  HB      5.00       #,  EfR36_CNOESY.list10
   10 TYR  HA     11 VAL  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   10 TYR  HA     55 HIS  HN      5.00       #,  EfR36_Nnoesy.list10
   10 TYR  HA     56 THR  HA      5.00       #,  EfR36_CNOESY.list10
   10 TYR  HA     56 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   10 TYR  HA     57 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
   10 TYR  HB2    11 VAL  HN      5.00       #both,  EfR36_CNOESY.list10
   10 TYR  HB3    11 VAL  HN      5.00       #both,  EfR36_Nnoesy.list10
   10 TYR  QB     53 MET  HG2     6.00       #m;one,both  EfR36_CNOESY.list10
   10 TYR  QB     53 MET  HG3     6.00       #m;one,both  EfR36_CNOESY.list10
   10 TYR  HB2    53 MET  QE      6.00       #both,m;Me  EfR36_CNOESY.list10
   10 TYR  HB3    53 MET  QE      6.00       #both,m;Me  EfR36_CNOESY.list10
   10 TYR  HB2    56 THR  QG2     6.00       #both,m;Me  EfR36_CNOESY.list10
   10 TYR  HB3    56 THR  QG2     6.00       #both,m;Me  EfR36_CNOESY.list10
   10 TYR  HB2    10 TYR  QD      7.00       #both,r;dd  EfR36_CNOESY.list10
   10 TYR  HB3    10 TYR  QD      7.00       #both,r;dd  EfR36_CNOESY.list10

#V11
   11 VAL  HN     11 VAL  HA      5.00       #,  EfR36_Nnoesy.list10
   11 VAL  HN     11 VAL  HB      5.00       #,  EfR36_Nnoesy.list10
   11 VAL  HN     11 VAL  QG1     6.00       #,m;bothMe  EfR36_Nnoesy.list10
   11 VAL  HN     11 VAL  QG2     6.00       #,m;bothMe  EfR36_Nnoesy.list10
   11 VAL  HN     55 HIS  HN      5.00       #,  EfR36_Nnoesy.list10
   11 VAL  HN     55 HIS  QB      6.00       #,m;one  EfR36_Nnoesy.list10
   11 VAL  HN     56 THR  HA      5.00       #,  EfR36_Nnoesy.list10
   11 VAL  HN     56 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
#   11 VAL  HA     11 VAL  HB      5.00       #,  EfR36_CNOESY.list10
   11 VAL  HA     11 VAL  QG1     6.00       #,m;bothMe  EfR36_CNOESY.list10
   11 VAL  HA     11 VAL  QG2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   11 VAL  HA     12 LEU  HN      3.50       #,  EfR36_Nnoesy.list10
   11 VAL  HA     21 GLY  HA1     5.00       #,both  EfR36_CNOESY.list10
   11 VAL  HA     21 GLY  HA2     5.00       #,both  EfR36_CNOESY.list10
   11 VAL  HA     22 GLY  HN      5.00       #,  EfR36_Nnoesy.list10
#   11 VAL  HB     11 VAL  QG1     6.00       #,m;bothMe  EfR36_CNOESY.list10
#   11 VAL  HB     11 VAL  QG2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   11 VAL  HB     54 ILE  HN      5.00       #,  EfR36_Nnoesy.list10
   11 VAL  HB     54 ILE  QD1     6.00       #,m;Me  EfR36_CNOESY.list10
   11 VAL  HB     55 HIS  HN      5.00       #,  EfR36_Nnoesy.list10
   11 VAL  HB     55 HIS  HB2     5.00       #,both  EfR36_CNOESY.list10
   11 VAL  HB     55 HIS  HB3     5.00       #,both  EfR36_CNOESY.list10
   11 VAL  HB     84 LEU  QD2     6.00       #,m;Me  EfR36_CNOESY.list10
#   11 VAL  QG1    11 VAL  QG2     7.00       #m;Me,m;Me  EfR36_CNOESY.list10
   11 VAL  QG1    12 LEU  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   11 VAL  QG1    12 LEU  HA      6.00       #m;Me,  EfR36_CNOESY.list10
   11 VAL  QG1    19 PHE  HA      6.00       #m;Me,  EfR36_CNOESY.list10
   11 VAL  QG1    19 PHE  HB2     6.00       #m;Me,both  EfR36_CNOESY.list10
   11 VAL  QG1    19 PHE  HB3     6.00       #m;Me,both  EfR36_CNOESY.list10
   11 VAL  QG1    20 TYR  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   11 VAL  QG2    21 GLY  HA1     6.00       #m;Me,both  EfR36_CNOESY.list10
   11 VAL  QG2    21 GLY  HA2     6.00       #m;Me,both  EfR36_CNOESY.list10
   11 VAL  QG2    22 GLY  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   11 VAL  QG2    54 ILE  QG1     7.00       #m;Me,m;dg  EfR36_CNOESY.list10
   11 VAL  QG1    54 ILE  QD1     7.00       #m;bothMe,m;Me  EfR36_CNOESY.list10
   11 VAL  QG2    54 ILE  QD1     7.00       #m;bothMe,m;Me  EfR36_CNOESY.list10
   11 VAL  QG1    55 HIS  HN      6.00       #m;bothMe,  EfR36_Nnoesy.list10
   11 VAL  QG2    55 HIS  HN      6.00       #m;bothMe,  EfR36_Nnoesy.list10
   11 VAL  QG1    55 HIS  QB      7.00       #m;bothMe,m;one  EfR36_CNOESY.list10
   11 VAL  QG2    55 HIS  QB      7.00       #m;bothMe,m;one  EfR36_CNOESY.list10
   11 VAL  QG2    55 HIS  QB      7.00       #m;bothMe,m;one  EfR36_CNOESY.list10
   11 VAL  QG2    80 LYS  QG      7.00       #m;Me,m;dg  EfR36_CNOESY.list10
   11 VAL  QG1    84 LEU  QD1     7.00       #m;bothMe,m;Me  EfR36_CNOESY.list10
   11 VAL  QG1    84 LEU  QD2     7.00       #m;bothMe,m;Me  EfR36_CNOESY.list10
   11 VAL  QG2    84 LEU  QD2     7.00       #m;bothMe,m;Me  EfR36_CNOESY.list10
   11 VAL  QG2    72 PHE  HZ      6.00       #m;Me,  EfR36_CNOESY.list10

#L12
   12 LEU  HN     12 LEU  HA      5.00       #,  EfR36_Nnoesy.list10
   12 LEU  HN     12 LEU  QB      6.00       #,m;one  EfR36_Nnoesy.list10
   12 LEU  HN     12 LEU  QQD     6.70       #,s;dMe  EfR36_Nnoesy.list10
   12 LEU  HN     20 TYR  HN      5.00       #,  EfR36_Nnoesy.list10
#   12 LEU  HA     12 LEU  HB2     5.00       #,both  EfR36_CNOESY.list10
#   12 LEU  HA     12 LEU  HB3     5.00       #,both  EfR36_CNOESY.list10
   12 LEU  HA     12 LEU  HG      5.00       #,  EfR36_CNOESY.list10
   12 LEU  HA     12 LEU  QQD     6.70       #,s;dMe  EfR36_CNOESY.list10
   12 LEU  HA     13 LEU  HN      3.50       #,  EfR36_Nnoesy.list10
   12 LEU  HA     52 ILE  HN      5.00       #,  EfR36_CNOESY.list10
   12 LEU  HA     53 MET  HA      5.00       #,  EfR36_CNOESY.list10
   12 LEU  HA     54 ILE  HN      5.00       #,  EfR36_Nnoesy.list10
   12 LEU  HA     54 ILE  QD1     6.00       #,m;Me  EfR36_CNOESY.list10
#   12 LEU  QB     12 LEU  HG      6.00       #m;one,  EfR36_CNOESY.list10
   12 LEU  HB2    12 LEU  QD1     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   12 LEU  HB2    12 LEU  QD2     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   12 LEU  HB3    12 LEU  QD1     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   12 LEU  HB3    12 LEU  QD2     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   12 LEU  QB     13 LEU  HN      6.00       #m;one,  EfR36_CNOESY.list10
   12 LEU  QB     13 LEU  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   12 LEU  QB     20 TYR  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   12 LEU  QB     51 VAL  HB      6.00       #m;one,  EfR36_CNOESY.list10
   12 LEU  QB     52 ILE  HN      6.00       #m;one,  EfR36_Nnoesy.list10
#   12 LEU  HG     12 LEU  QD1     6.00       #,m;bothMe  EfR36_CNOESY.list10
#   12 LEU  HG     12 LEU  QD2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   12 LEU  HG     53 MET  QE      6.00       #,m;Me  EfR36_CNOESY.list10
#   12 LEU  QQD    12 LEU  QQD     9.80       #q;dMe,q;dMe  EfR36_CNOESY.list10
   12 LEU  QQD    13 LEU  HN      7.40       #q;dMe,  EfR36_Nnoesy.list10
   12 LEU  QQD    20 TYR  QB      8.40       #q;dMe,m;one  EfR36_CNOESY.list10
   12 LEU  QQD    31 LEU  QD1     8.40       #q;dMe,m;bothMe  EfR36_CNOESY.list10
   12 LEU  QQD    31 LEU  QD2     8.40       #q;dMe,m;bothMe  EfR36_CNOESY.list10
   12 LEU  QD1    51 VAL  HB      6.00       #m;bothMe,  EfR36_CNOESY.list10
   12 LEU  QD2    51 VAL  HB      6.00       #m;bothMe,  EfR36_CNOESY.list10
   12 LEU  QD1    51 VAL  QG1     7.00       #m;bothMe,m;bothMe  EfR36_CNOESY.list10
   12 LEU  QD1    51 VAL  QG2     7.00       #m;bothMe,m;bothMe  EfR36_CNOESY.list10
   12 LEU  QD2    51 VAL  QG1     7.00       #m;bothMe,m;bothMe  EfR36_CNOESY.list10
   12 LEU  QD2    51 VAL  QG2     7.00       #m;bothMe,m;bothMe  EfR36_CNOESY.list10
   12 LEU  QQD    52 ILE  HN      7.40       #q;dMe,  EfR36_CNOESY.list10
   12 LEU  QQD    53 MET  HA      7.40       #q;dMe,  EfR36_CNOESY.list10
   12 LEU  QQD    53 MET  QB      8.40       #q;dMe,m;one  EfR36_CNOESY.list10
   12 LEU  QQD    53 MET  HG2     7.40       #q;dMe,both  EfR36_CNOESY.list10
   12 LEU  QQD    53 MET  HG3     7.40       #q;dMe,both  EfR36_CNOESY.list10
   12 LEU  QQD    53 MET  QE      8.40       #q;dMe,m;Me  EfR36_CNOESY.list10

#L13
   13 LEU  HN     13 LEU  HA      5.00       #,  EfR36_Nnoesy.list10
   13 LEU  HN     13 LEU  HB2     5.00       #,both  EfR36_Nnoesy.list10
   13 LEU  HN     13 LEU  HB3     5.00       #,both  EfR36_Nnoesy.list10
   13 LEU  HN     13 LEU  HG      5.00       #,  EfR36_Nnoesy.list10
   13 LEU  HN     13 LEU  QD1     6.00       #,m;bothMe  EfR36_CNOESY.list10
   13 LEU  HN     13 LEU  QD2     6.00       #,m;Me  EfR36_Nnoesy.list10
   13 LEU  HN     52 ILE  HN      5.00       #,  EfR36_Nnoesy.list10
   13 LEU  HN     52 ILE  HG12    5.00       #,both  EfR36_CNOESY.list10
   13 LEU  HN     52 ILE  HG13    5.00       #,both  EfR36_CNOESY.list10
   13 LEU  HN     52 ILE  QD1     6.00       #,m;Me  EfR36_CNOESY.list10
   13 LEU  HN     53 MET  HA      5.00       #,  EfR36_Nnoesy.list10
   13 LEU  HN     54 ILE  QD1     6.00       #,m;Me  EfR36_CNOESY.list10
#   13 LEU  HA     13 LEU  HB2     5.00       #,both  EfR36_CNOESY.list10
#   13 LEU  HA     13 LEU  HB3     5.00       #,both  EfR36_CNOESY.list10
   13 LEU  HA     13 LEU  HG      5.00       #,  EfR36_CNOESY.list10
   13 LEU  HA     13 LEU  QD1     6.00       #,m;bothMe  EfR36_CNOESY.list10
   13 LEU  HA     13 LEU  QD2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   13 LEU  HA     14 CYS  HN      3.50       #,  EfR36_Nnoesy.list10
   13 LEU  HA     19 PHE  HA      5.00       #,  EfR36_CNOESY.list10
   13 LEU  HA     52 ILE  QG1     6.00       #,m;one  EfR36_CNOESY.list10
   13 LEU  HA     54 ILE  QD1     6.00       #,m;Me  EfR36_CNOESY.list10
#   13 LEU  HB2    13 LEU  HG      5.00       #both,  EfR36_CNOESY.list10
#   13 LEU  HB3    13 LEU  HG      5.00       #both,  EfR36_CNOESY.list10
   13 LEU  HB2    13 LEU  QD1     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   13 LEU  HB2    13 LEU  QD2     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   13 LEU  HB3    13 LEU  QD1     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   13 LEU  HB3    13 LEU  QD2     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   13 LEU  QB     14 CYS  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   13 LEU  QB     52 ILE  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   13 LEU  HB2    52 ILE  QG1     6.00       #both,m;one  EfR36_CNOESY.list10
   13 LEU  HB3    52 ILE  QG1     6.00       #both,m;one  EfR36_CNOESY.list10
   13 LEU  HB2    52 ILE  QD1     6.00       #both,m;Me  EfR36_CNOESY.list10
   13 LEU  HB3    52 ILE  QD1     6.00       #both,m;Me  EfR36_CNOESY.list10
   13 LEU  HB2    54 ILE  QG2     6.00       #both,m;Me  EfR36_CNOESY.list10
   13 LEU  HB3    54 ILE  QG2     6.00       #both,m;Me  EfR36_CNOESY.list10
   13 LEU  HB2    54 ILE  QD1     6.00       #both,m;Me  EfR36_CNOESY.list10
   13 LEU  HB3    54 ILE  QD1     6.00       #both,m;Me  EfR36_CNOESY.list10
#   13 LEU  HG     13 LEU  QD2     6.00       #,m;Me  EfR36_CNOESY.list10
   13 LEU  HG     14 CYS  HN      5.00       #,  EfR36_CNOESY.list10
   13 LEU  HG     14 CYS  HA      5.00       #,  EfR36_CNOESY.list10
#   13 LEU  QD1    13 LEU  QD2     7.00       #m;Me,m;Me  EfR36_CNOESY.list10
   13 LEU  QD1    14 CYS  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   13 LEU  QD2    14 CYS  HN      6.00       #m;bothMe,  EfR36_CNOESY.list10
   13 LEU  QD1    17 GLY  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   13 LEU  QD1    17 GLY  HA1     6.00       #m;Me,both  EfR36_CNOESY.list10
   13 LEU  QD1    17 GLY  HA2     6.00       #m;Me,both  EfR36_CNOESY.list10
   13 LEU  QD1    18 SER  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   13 LEU  QD2    52 ILE  HN      6.00       #m;Me,  EfR36_CNOESY.list10
   13 LEU  QD1    52 ILE  QG1     7.00       #m;bothMe,m;one  EfR36_CNOESY.list10
   13 LEU  QD2    52 ILE  QG1     7.00       #m;bothMe,m;one  EfR36_CNOESY.list10
   13 LEU  QD1    52 ILE  QG2     7.00       #m;bothMe,m;Me  EfR36_CNOESY.list10
   13 LEU  QD2    52 ILE  QG2     7.00       #m;bothMe,m;Me  EfR36_CNOESY.list10
   13 LEU  QD1    52 ILE  QD1     7.00       #m;bothMe,m;Me  EfR36_CNOESY.list10
   13 LEU  QD2    52 ILE  QD1     7.00       #m;bothMe,m;Me  EfR36_CNOESY.list10
   13 LEU  QD1    54 ILE  QG2     7.00       #m;Me,m;Me  EfR36_CNOESY.list10
   13 LEU  QD1    19 PHE  QE      8.00       #m;Me,r;de  EfR36_CNOESY.list10
   13 LEU  QD1    19 PHE  HZ      6.00       #m;Me,  EfR36_CNOESY.list10

#C14
   14 CYS  HN     14 CYS  HA      5.00       #,  EfR36_Nnoesy.list10
   14 CYS  HN     14 CYS  QB      6.00       #,m;one  EfR36_Nnoesy.list10
   14 CYS  HN     18 SER  HN      5.00       #,  EfR36_Nnoesy.list10
   14 CYS  HN     19 PHE  HA      5.00       #,  EfR36_Nnoesy.list10
#   14 CYS  HA     14 CYS  HB2     5.00       #,both  EfR36_CNOESY.list10
#   14 CYS  HA     14 CYS  HB3     5.00       #,both  EfR36_CNOESY.list10
   14 CYS  HA     15 GLN  HN      5.00       #,  EfR36_CNOESY.list10
   14 CYS  HA     15 GLN  QB      6.00       #,m;one  EfR36_CNOESY.list10
   14 CYS  HA     51 VAL  HA      5.00       #,  EfR36_CNOESY.list10
   14 CYS  HA     51 VAL  QG1     6.00       #,m;Me  EfR36_CNOESY.list10
   14 CYS  HA     52 ILE  HN      5.00       #,  EfR36_Nnoesy.list10
   14 CYS  QB     16 ASP  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   14 CYS  HB2    18 SER  HN      5.00       #both,  EfR36_Nnoesy.list10
   14 CYS  HB3    18 SER  HN      5.00       #both,  EfR36_Nnoesy.list10
   14 CYS  QB     50 PRO  QD      7.00       #m;one,m;dd  EfR36_CNOESY.list10
   14 CYS  QB     51 VAL  QG1     7.00       #m;one,m;Me  EfR36_CNOESY.list10

#Q15
   15 GLN  HN     15 GLN  HA      5.00       #,  EfR36_Nnoesy.list10
   15 GLN  HN     15 GLN  HB2     5.00       #,both  EfR36_Nnoesy.list10
   15 GLN  HN     15 GLN  HB3     5.00       #,both  EfR36_Nnoesy.list10
   15 GLN  HN     15 GLN  HG2     5.00       #,both  EfR36_CNOESY.list10
   15 GLN  HN     15 GLN  HG3     5.00       #,both  EfR36_CNOESY.list10
#   15 GLN  HA     15 GLN  HB2     5.00       #,both  EfR36_CNOESY.list10
#   15 GLN  HA     15 GLN  HB3     5.00       #,both  EfR36_CNOESY.list10
   15 GLN  HA     15 GLN  HG2     5.00       #,both  EfR36_CNOESY.list10
   15 GLN  HA     15 GLN  HG3     5.00       #,both  EfR36_CNOESY.list10
   15 GLN  HA     15 GLN  HE21    5.00       #,both  EfR36_Nnoesy.list10
   15 GLN  HA     15 GLN  HE22    5.00       #,both  EfR36_Nnoesy.list10
   15 GLN  HA     16 ASP  HN      5.00       #,  EfR36_Nnoesy.list10
   15 GLN  HA     17 GLY  HN      5.00       #,  EfR36_Nnoesy.list10
#   15 GLN  HB2    15 GLN  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   15 GLN  HB2    15 GLN  HG3     5.00       #both,both  EfR36_CNOESY.list10
#   15 GLN  HB3    15 GLN  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   15 GLN  HB3    15 GLN  HG3     5.00       #both,both  EfR36_CNOESY.list10
   15 GLN  HB2    15 GLN  QE2     6.00       #both,m;one  EfR36_Nnoesy.list10
   15 GLN  HB3    15 GLN  QE2     6.00       #both,m;one  EfR36_Nnoesy.list10
   15 GLN  HB3    15 GLN  QE2     6.00       #both,m;one  EfR36_Nnoesy.list10
   15 GLN  QB     16 ASP  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   15 GLN  QB     50 PRO  QD      7.00       #m;one,m;dd  EfR36_CNOESY.list10
   15 GLN  HG2    15 GLN  HE21    5.00       #both,both  EfR36_CNOESY.list10
   15 GLN  HG2    15 GLN  HE22    5.00       #both,both  EfR36_CNOESY.list10
   15 GLN  HG3    15 GLN  HE21    5.00       #both,both  EfR36_CNOESY.list10
   15 GLN  HG3    15 GLN  HE22    5.00       #both,both  EfR36_CNOESY.list10
   15 GLN  QG     50 PRO  QB      7.00       #m;one,m;one  EfR36_CNOESY.list10
   15 GLN  QG     50 PRO  QG      7.00       #m;one,m;dg  EfR36_CNOESY.list10
   15 GLN  HG2    50 PRO  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   15 GLN  HG3    50 PRO  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   15 GLN  QE2    50 PRO  QB      7.00       #m;one,m;one  EfR36_Nnoesy.list10
   15 GLN  HE21   50 PRO  QG      6.00       #both,m;dg  EfR36_Nnoesy.list10
   15 GLN  HE22   50 PRO  QG      6.00       #both,m;dg  EfR36_Nnoesy.list10
   15 GLN  HE21   50 PRO  QD      6.00       #both,m;dd  EfR36_Nnoesy.list10
   15 GLN  HE22   50 PRO  QD      6.00       #both,m;dd  EfR36_Nnoesy.list10

#D16
   16 ASP  HN     16 ASP  HA      5.00       #,  EfR36_Nnoesy.list10
   16 ASP  HN     16 ASP  HB2     5.00       #,both  EfR36_Nnoesy.list10
   16 ASP  HN     16 ASP  HB3     5.00       #,both  EfR36_Nnoesy.list10
   16 ASP  HN     17 GLY  HN      3.50       #,  EfR36_Nnoesy.list10
   16 ASP  HN     18 SER  HN      5.00       #,  EfR36_Nnoesy.list10
#   16 ASP  HA     16 ASP  HB2     5.00       #,both  EfR36_CNOESY.list10
#   16 ASP  HA     16 ASP  HB3     5.00       #,both  EfR36_CNOESY.list10
   16 ASP  HA     17 GLY  HN      5.00       #,  EfR36_Nnoesy.list10

#G17
   17 GLY  HN     17 GLY  HA1     5.00       #,both  EfR36_CNOESY.list10
   17 GLY  HN     17 GLY  HA2     5.00       #,both  EfR36_CNOESY.list10
   17 GLY  HN     18 SER  HN      3.50       #,  EfR36_Nnoesy.list10
   17 GLY  HA1    18 SER  HN      5.00       #both,  EfR36_Nnoesy.list10
   17 GLY  HA2    18 SER  HN      5.00       #both,  EfR36_Nnoesy.list10

#S18
   18 SER  HN     18 SER  HA      5.00       #,  EfR36_CNOESY.list10
   18 SER  HN     18 SER  QB      6.00       #,m;one  EfR36_Nnoesy.list10
   18 SER  HN     19 PHE  HN      5.00       #,  EfR36_Nnoesy.list10
#   18 SER  HA     18 SER  HB2     5.00       #,both  EfR36_CNOESY.list10
#   18 SER  HA     18 SER  HB3     5.00       #,both  EfR36_CNOESY.list10
   18 SER  HA     19 PHE  HN      3.50       #,  EfR36_Nnoesy.list10
   18 SER  QB     19 PHE  HN      6.00       #m;one,  EfR36_Nnoesy.list10

#F19
   19 PHE  HN     19 PHE  HA      5.00       #,  EfR36_Nnoesy.list10
   19 PHE  HN     19 PHE  HB2     5.00       #,both  EfR36_Nnoesy.list10
   19 PHE  HN     19 PHE  HB3     5.00       #,both  EfR36_Nnoesy.list10
   19 PHE  HN     19 PHE  QD      7.00       #,r;dd  EfR36_Nnoesy.list10
#   19 PHE  HA     19 PHE  HB2     5.00       #,both  EfR36_CNOESY.list10
#   19 PHE  HA     19 PHE  HB3     5.00       #,both  EfR36_CNOESY.list10
   19 PHE  HA     20 TYR  HN      5.00       #,  EfR36_Nnoesy.list10
   19 PHE  HA     19 PHE  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   19 PHE  QB     20 TYR  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   19 PHE  QB     19 PHE  QD      8.00       #m;one,r;dd  EfR36_CNOESY.list10

#Y20
   20 TYR  HN     20 TYR  QB      6.00       #,m;one  EfR36_Nnoesy.list10

#G21
   21 GLY  HN     21 GLY  HA1     5.00       #,both  EfR36_Nnoesy.list10
   21 GLY  HN     21 GLY  HA2     5.00       #,both  EfR36_Nnoesy.list10
   21 GLY  HN     22 GLY  HN      5.00       #,  EfR36_Nnoesy.list10
   21 GLY  HA1    22 GLY  HN      5.00       #both,  EfR36_CNOESY.list10
   21 GLY  HA2    22 GLY  HN      5.00       #both,  EfR36_CNOESY.list10

#G22
   22 GLY  HN     22 GLY  HA1     5.00       #,both  EfR36_Nnoesy.list10
   22 GLY  HN     22 GLY  HA2     5.00       #,both  EfR36_Nnoesy.list10
   22 GLY  HN     23 TYR  HN      5.00       #,  EfR36_Nnoesy.list10
   22 GLY  HA1    23 TYR  HN      5.00       #both,  EfR36_Nnoesy.list10
   22 GLY  HA2    23 TYR  HN      5.00       #both,  EfR36_Nnoesy.list10
   22 GLY  QA     23 TYR  QD      7.60       #i;one,r;dd  EfR36_CNOESY.list10

#Y23
   23 TYR  HN     23 TYR  HA      5.00       #,  EfR36_Nnoesy.list10
   23 TYR  HN     23 TYR  HB2     5.00       #,both  EfR36_Nnoesy.list10
   23 TYR  HN     23 TYR  HB3     5.00       #,both  EfR36_Nnoesy.list10
   23 TYR  HN     23 TYR  QD      7.00       #,r;dd  EfR36_CNOESY.list10
#   23 TYR  HA     23 TYR  HB2     5.00       #,both  EfR36_CNOESY.list10
#   23 TYR  HA     23 TYR  HB3     5.00       #,both  EfR36_CNOESY.list10
   23 TYR  HA     24 THR  HN      3.50       #,  EfR36_Nnoesy.list10
   23 TYR  HA     23 TYR  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   23 TYR  HB2    24 THR  HN      5.00       #both,  EfR36_Nnoesy.list10
   23 TYR  HB3    24 THR  HN      5.00       #both,  EfR36_Nnoesy.list10
   23 TYR  HB2    23 TYR  QD      7.00       #both,r;dd  EfR36_CNOESY.list10
   23 TYR  HB3    23 TYR  QD      7.00       #both,r;dd  EfR36_CNOESY.list10
   23 TYR  QB     59 PHE  QD      8.00       #m;one,r;dd  EfR36_CNOESY.list10

#T24
   24 THR  HN     24 THR  HB      5.00       #,  EfR36_Nnoesy.list10
   24 THR  HN     24 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
#   24 THR  HB     24 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   24 THR  HB     25 THR  HN      5.00       #,  EfR36_Nnoesy.list10
   24 THR  QG2    26 GLU  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   24 THR  QG2    26 GLU  HA      6.00       #m;Me,  EfR36_CNOESY.list10
   24 THR  QG2    27 PRO  HA      6.00       #m;Me,  EfR36_CNOESY.list10
   24 THR  QG2    27 PRO  HB2     6.00       #m;Me,both  EfR36_CNOESY.list10
   24 THR  QG2    27 PRO  HB3     6.00       #m;Me,both  EfR36_CNOESY.list10
   24 THR  QG2    27 PRO  QG      7.00       #m;Me,m;one  EfR36_CNOESY.list10
   24 THR  QG2    27 PRO  HD2     6.00       #m;Me,both  EfR36_CNOESY.list10
   24 THR  QG2    27 PRO  HD3     6.00       #m;Me,both  EfR36_CNOESY.list10
   24 THR  QG2    30 ARG  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   24 THR  QG2    30 ARG  QG      7.00       #m;Me,m;one  EfR36_CNOESY.list10

#T25
   25 THR  HN     25 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
   25 THR  HN     26 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
#   25 THR  HA     25 THR  HB      5.00       #,  EfR36_CNOESY.list10
   25 THR  HA     25 THR  QG2     5.60       #,i;Me  EfR36_CNOESY.list10
   25 THR  HA     26 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
   25 THR  HA     26 GLU  HA      5.00       #,  EfR36_CNOESY.list10
#   25 THR  HB     25 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10

#E26
   26 GLU  HN     26 GLU  HA      2.90       #,  EfR36_Nnoesy.list10
   26 GLU  HN     26 GLU  HB2     5.00       #,both  EfR36_Nnoesy.list10
   26 GLU  HN     26 GLU  HB3     5.00       #,both  EfR36_Nnoesy.list10
   26 GLU  HN     26 GLU  HG2     5.00       #,both  EfR36_Nnoesy.list10
   26 GLU  HN     26 GLU  HG3     5.00       #,both  EfR36_Nnoesy.list10
   26 GLU  HN     27 PRO  HD2     5.00       #,both  EfR36_Nnoesy.list10
   26 GLU  HN     27 PRO  HD3     5.00       #,both  EfR36_Nnoesy.list10
#   26 GLU  HA     26 GLU  HB2     5.00       #,both  EfR36_CNOESY.list10
#   26 GLU  HA     26 GLU  HB3     5.00       #,both  EfR36_CNOESY.list10
   26 GLU  HA     26 GLU  HG2     5.00       #,both  EfR36_CNOESY.list10
   26 GLU  HA     26 GLU  HG3     5.00       #,both  EfR36_CNOESY.list10
   26 GLU  HA     27 PRO  QG      6.00       #,m;one  EfR36_CNOESY.list10
   26 GLU  HA     27 PRO  HD2     5.00       #,both  EfR36_CNOESY.list10
   26 GLU  HA     27 PRO  HD3     5.00       #,both  EfR36_CNOESY.list10
   26 GLU  HA     28 GLU  HN      3.50       #,  EfR36_Nnoesy.list10
   26 GLU  HA     29 ARG  HN      5.00       #,  EfR36_Nnoesy.list10
#   26 GLU  HB2    26 GLU  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   26 GLU  HB2    26 GLU  HG3     5.00       #both,both  EfR36_CNOESY.list10
#   26 GLU  HB3    26 GLU  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   26 GLU  HB3    26 GLU  HG3     5.00       #both,both  EfR36_CNOESY.list10
   26 GLU  QB     28 GLU  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   26 GLU  HB2    29 ARG  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   26 GLU  HB3    29 ARG  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   26 GLU  QB     30 ARG  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   26 GLU  QG     28 GLU  QG      7.00       #m;one,m;dg  EfR36_CNOESY.list10
   26 GLU  QG     29 ARG  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   26 GLU  HG2    29 ARG  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   26 GLU  HG3    29 ARG  QD      6.00       #both,m;dd  EfR36_CNOESY.list10

#P27
#   27 PRO  HA     27 PRO  HB2     5.00       #,both  EfR36_CNOESY.list10
#   27 PRO  HA     27 PRO  HB3     5.00       #,both  EfR36_CNOESY.list10
#   27 PRO  HA     27 PRO  HG2     5.00       #,both  EfR36_CNOESY.list10
#   27 PRO  HA     27 PRO  HG3     5.00       #,both  EfR36_CNOESY.list10
#   27 PRO  HA     27 PRO  HD2     5.00       #,both  EfR36_CNOESY.list10
#   27 PRO  HA     27 PRO  HD3     5.00       #,both  EfR36_CNOESY.list10
   27 PRO  HA     28 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
   27 PRO  HA     30 ARG  HN      5.00       #,  EfR36_Nnoesy.list10
   27 PRO  HA     30 ARG  QB      6.00       #,m;db  EfR36_CNOESY.list10
   27 PRO  HA     30 ARG  QG      6.00       #,m;one  EfR36_CNOESY.list10
   27 PRO  HA     30 ARG  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   27 PRO  HA     31 LEU  HN      3.50       #,  EfR36_Nnoesy.list10
#   27 PRO  HB2    27 PRO  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   27 PRO  HB2    27 PRO  HG3     5.00       #both,both  EfR36_CNOESY.list10
#   27 PRO  HB3    27 PRO  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   27 PRO  HB3    27 PRO  HG3     5.00       #both,both  EfR36_CNOESY.list10
#   27 PRO  HB2    27 PRO  QD      6.00       #both,m;one  EfR36_CNOESY.list10
#   27 PRO  HB3    27 PRO  QD      6.00       #both,m;one  EfR36_CNOESY.list10
#   27 PRO  HB3    27 PRO  QD      6.00       #both,m;one  EfR36_CNOESY.list10
   27 PRO  HB2    28 GLU  HN      5.00       #both,  EfR36_CNOESY.list10
   27 PRO  HB3    28 GLU  HN      5.00       #both,  EfR36_CNOESY.list10
   27 PRO  QB     31 LEU  QQD     8.40       #m;one,q;dMe  EfR36_CNOESY.list10
#   27 PRO  HG2    27 PRO  HD2     5.00       #both,both  EfR36_CNOESY.list10
#   27 PRO  HG2    27 PRO  HD3     5.00       #both,both  EfR36_CNOESY.list10
#   27 PRO  HG3    27 PRO  HD2     5.00       #both,both  EfR36_CNOESY.list10
#   27 PRO  HG3    27 PRO  HD3     5.00       #both,both  EfR36_CNOESY.list10
   27 PRO  HG2    28 GLU  HN      5.00       #both,  EfR36_Nnoesy.list10
   27 PRO  HG3    28 GLU  HN      5.00       #both,  EfR36_Nnoesy.list10
   27 PRO  QG     28 GLU  QG      7.00       #m;one,m;dg  EfR36_CNOESY.list10
   27 PRO  QG     53 MET  QE      7.00       #m;one,m;Me  EfR36_CNOESY.list10
   27 PRO  HD2    28 GLU  HN      5.00       #both,  EfR36_Nnoesy.list10
   27 PRO  HD3    28 GLU  HN      5.00       #both,  EfR36_Nnoesy.list10

#E28
   28 GLU  HN     28 GLU  HA      3.50       #,  EfR36_Nnoesy.list10
   28 GLU  HN     28 GLU  QB      4.50       #,m;db  EfR36_Nnoesy.list10
   28 GLU  HN     28 GLU  QG      6.00       #,m;dg  EfR36_Nnoesy.list10
   28 GLU  HN     29 ARG  HN      3.50       #,  EfR36_Nnoesy.list10
   28 GLU  HN     30 ARG  HN      5.00       #,  EfR36_Nnoesy.list10
#   28 GLU  HA     28 GLU  QB      4.50       #,m;db  EfR36_CNOESY.list10
   28 GLU  HA     28 GLU  QG      6.00       #,m;dg  EfR36_CNOESY.list10
   28 GLU  HA     29 ARG  HN      5.00       #,  EfR36_Nnoesy.list10
   28 GLU  HA     30 ARG  HN      5.00       #,  EfR36_Nnoesy.list10
   28 GLU  HA     31 LEU  HN      5.00       #,  EfR36_CNOESY.list10
   28 GLU  HA     31 LEU  HB2     5.00       #,both  EfR36_CNOESY.list10
   28 GLU  HA     31 LEU  HB3     5.00       #,both  EfR36_CNOESY.list10
#   28 GLU  QB     28 GLU  QG      7.00       #m;db,m;dg  EfR36_CNOESY.list10
   28 GLU  QB     29 ARG  HN      6.00       #m;db,  EfR36_CNOESY.list10
   28 GLU  QB     29 ARG  HG2     6.00       #m;db,both  EfR36_CNOESY.list10
   28 GLU  QB     29 ARG  HG3     6.00       #m;db,both  EfR36_CNOESY.list10
   28 GLU  QG     29 ARG  HN      6.00       #m;dg,  EfR36_Nnoesy.list10
   28 GLU  QG     31 LEU  QQD     8.40       #m;dg,q;dMe  EfR36_CNOESY.list10

#R29
   29 ARG  HN     29 ARG  HA      3.50       #,  EfR36_Nnoesy.list10
   29 ARG  HN     29 ARG  HB2     3.50       #,both  EfR36_CNOESY.list10
   29 ARG  HN     29 ARG  HB3     3.50       #,both  EfR36_CNOESY.list10
   29 ARG  HN     29 ARG  HG2     5.00       #,both  EfR36_Nnoesy.list10
   29 ARG  HN     29 ARG  HG3     5.00       #,both  EfR36_Nnoesy.list10
   29 ARG  HN     29 ARG  QD      6.00       #,m;dd  EfR36_Nnoesy.list10
   29 ARG  HN     30 ARG  HN      3.50       #,  EfR36_Nnoesy.list10
#   29 ARG  HA     29 ARG  HB2     5.00       #,both  EfR36_CNOESY.list10
#   29 ARG  HA     29 ARG  HB3     5.00       #,both  EfR36_CNOESY.list10
   29 ARG  HA     29 ARG  HG2     5.00       #,both  EfR36_CNOESY.list10
   29 ARG  HA     29 ARG  HG3     5.00       #,both  EfR36_CNOESY.list10
   29 ARG  HA     29 ARG  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   29 ARG  HA     30 ARG  HN      5.00       #,  EfR36_Nnoesy.list10
   29 ARG  HA     31 LEU  HN      5.00       #,  EfR36_Nnoesy.list10
   29 ARG  HA     32 THR  HN      5.00       #,  EfR36_CNOESY.list10
   29 ARG  HA     32 THR  HB      5.00       #,  EfR36_CNOESY.list10
   29 ARG  HA     33 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
#   29 ARG  HB2    29 ARG  QG      6.00       #both,m;one  EfR36_CNOESY.list10
#   29 ARG  HB3    29 ARG  QG      6.00       #both,m;one  EfR36_CNOESY.list10
   29 ARG  HB2    29 ARG  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   29 ARG  HB3    29 ARG  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   29 ARG  QB     30 ARG  HN      6.00       #m;one,  EfR36_CNOESY.list10
#   29 ARG  HG2    29 ARG  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
#   29 ARG  HG3    29 ARG  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   29 ARG  QG     30 ARG  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   29 ARG  QG     32 THR  QG2     7.00       #m;one,m;Me  EfR36_CNOESY.list10
   29 ARG  QG     33 GLU  HN      6.00       #m;one,  EfR36_CNOESY.list10
   29 ARG  QD     30 ARG  HN      6.00       #m;dd,  EfR36_Nnoesy.list10

#R30
   30 ARG  HN     30 ARG  HA      5.00       #,  EfR36_Nnoesy.list10
   30 ARG  HN     30 ARG  QB      6.00       #,m;db  EfR36_Nnoesy.list10
   30 ARG  HN     30 ARG  QG      6.00       #,m;one  EfR36_Nnoesy.list10
   30 ARG  HN     31 LEU  HN      3.50       #,  EfR36_Nnoesy.list10
   30 ARG  HN     31 LEU  QB      6.00       #,m;one  EfR36_Nnoesy.list10
   30 ARG  HA     30 ARG  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   30 ARG  HA     31 LEU  HN      3.50       #,  EfR36_Nnoesy.list10
   30 ARG  HA     33 GLU  QB      6.00       #,m;one  EfR36_CNOESY.list10
#   30 ARG  QB     30 ARG  QG      7.00       #m;db,m;one  EfR36_CNOESY.list10
#   30 ARG  HG2    30 ARG  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
#   30 ARG  HG3    30 ARG  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   30 ARG  QG     31 LEU  HN      6.00       #m;one,  EfR36_CNOESY.list10
   30 ARG  QG     31 LEU  HA      6.00       #m;one,  EfR36_CNOESY.list10
   30 ARG  HG2    33 GLU  QB      6.00       #both,m;one  EfR36_CNOESY.list10
   30 ARG  HG2    33 GLU  QB      6.00       #both,m;one  EfR36_CNOESY.list10
   30 ARG  HG3    33 GLU  QB      6.00       #both,m;one  EfR36_CNOESY.list10
   30 ARG  QG     34 HIS  QB      7.00       #m;one,m;one  EfR36_CNOESY.list10
   30 ARG  QD     31 LEU  HN      6.00       #m;dd,  EfR36_Nnoesy.list10

#L31
   31 LEU  HN     31 LEU  HA      5.00       #,  EfR36_CNOESY.list10
   31 LEU  HN     31 LEU  HB2     5.00       #,both  EfR36_CNOESY.list10
   31 LEU  HN     31 LEU  HB3     5.00       #,both  EfR36_CNOESY.list10
   31 LEU  HN     31 LEU  HG      5.00       #,  EfR36_CNOESY.list10
   31 LEU  HN     31 LEU  QD1     6.00       #,m;bothMe  EfR36_CNOESY.list10
   31 LEU  HN     31 LEU  QD2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   31 LEU  HN     32 THR  HN      3.50       #,  EfR36_Nnoesy.list10
#   31 LEU  HA     31 LEU  HB2     5.00       #,both  EfR36_CNOESY.list10
#   31 LEU  HA     31 LEU  HB3     5.00       #,both  EfR36_CNOESY.list10
   31 LEU  HA     31 LEU  HG      5.00       #,  EfR36_CNOESY.list10
   31 LEU  HA     31 LEU  QD1     6.00       #,m;bothMe  EfR36_CNOESY.list10
   31 LEU  HA     31 LEU  QD2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   31 LEU  HA     32 THR  HN      5.00       #,  EfR36_CNOESY.list10
   31 LEU  HA     34 HIS  QB      6.00       #,m;one  EfR36_CNOESY.list10
#   31 LEU  QB     31 LEU  HG      6.00       #m;one,  EfR36_CNOESY.list10
   31 LEU  HB2    31 LEU  QD1     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   31 LEU  HB2    31 LEU  QD2     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   31 LEU  HB3    31 LEU  QD1     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   31 LEU  HB3    31 LEU  QD2     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   31 LEU  HB2    32 THR  HN      5.00       #both,  EfR36_Nnoesy.list10
   31 LEU  HB3    32 THR  HN      5.00       #both,  EfR36_Nnoesy.list10
#   31 LEU  HG     31 LEU  QD1     6.00       #,m;bothMe  EfR36_CNOESY.list10
#   31 LEU  HG     31 LEU  QD2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   31 LEU  HG     32 THR  HN      5.00       #,  EfR36_Nnoesy.list10
   31 LEU  HG     35 ASN  QD2     6.00       #,m;one  EfR36_Nnoesy.list10
   31 LEU  QD1    32 THR  HN      6.00       #m;bothMe,  EfR36_Nnoesy.list10
   31 LEU  QD2    32 THR  HN      6.00       #m;bothMe,  EfR36_Nnoesy.list10
   31 LEU  QQD    35 ASN  QD2     8.40       #q;dMe,m;one  EfR36_Nnoesy.list10
   31 LEU  QD2    35 ASN  QD2     7.00       #m;bothMe,m;one  EfR36_CNOESY.list10
   31 LEU  QD1    51 VAL  QG1     7.00       #m;bothMe,m;Me  EfR36_CNOESY.list10
   31 LEU  QD2    51 VAL  QG1     7.00       #m;bothMe,m;Me  EfR36_CNOESY.list10
   31 LEU  QQD    53 MET  QE      8.40       #q;dMe,m;Me  EfR36_CNOESY.list10

#T32
   32 THR  HN     32 THR  HA      5.00       #,  EfR36_CNOESY.list10
   32 THR  HN     32 THR  HB      3.50       #,  EfR36_Nnoesy.list10
   32 THR  HN     32 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
   32 THR  HN     33 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
#   32 THR  HA     32 THR  HB      5.00       #,  EfR36_CNOESY.list10
   32 THR  HA     32 THR  QG2     5.60       #,i;Me  EfR36_CNOESY.list10
   32 THR  HA     33 GLU  HN      5.00       #,  EfR36_CNOESY.list10
   32 THR  HA     35 ASN  HB2     5.00       #,both  EfR36_CNOESY.list10
   32 THR  HA     35 ASN  HB3     5.00       #,both  EfR36_CNOESY.list10
#   32 THR  HB     32 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   32 THR  HB     33 GLU  HN      5.00       #,  EfR36_CNOESY.list10
   32 THR  QG2    33 GLU  HN      6.00       #m;Me,  EfR36_CNOESY.list10
   32 THR  QG2    33 GLU  HA      6.00       #m;Me,  EfR36_CNOESY.list10
   32 THR  QG2    33 GLU  QB      7.00       #m;Me,m;one  EfR36_CNOESY.list10
   32 THR  QG2    33 GLU  QG      7.00       #m;Me,m;one  EfR36_CNOESY.list10
   32 THR  QG2    36 SER  QB      7.00       #m;Me,m;one  EfR36_CNOESY.list10

#E33
   33 GLU  HN     33 GLU  HA      5.00       #,  EfR36_Nnoesy.list10
   33 GLU  HN     33 GLU  QB      6.00       #,m;one  EfR36_Nnoesy.list10
   33 GLU  HN     33 GLU  HG2     5.00       #,both  EfR36_Nnoesy.list10
   33 GLU  HN     33 GLU  HG3     5.00       #,both  EfR36_Nnoesy.list10
#   33 GLU  HA     33 GLU  QB      6.00       #,m;one  EfR36_CNOESY.list10
   33 GLU  HA     33 GLU  HG2     5.00       #,both  EfR36_CNOESY.list10
   33 GLU  HA     33 GLU  HG3     5.00       #,both  EfR36_CNOESY.list10
   33 GLU  HA     36 SER  HN      5.00       #,  EfR36_Nnoesy.list10

#H34
#   34 HIS  HA     34 HIS  HB2     5.00       #,both  EfR36_CNOESY.list10
#   34 HIS  HA     34 HIS  HB3     5.00       #,both  EfR36_CNOESY.list10
   34 HIS  HA     38 THR  HN      5.00       #,  EfR36_CNOESY.list10
   34 HIS  QB     35 ASN  QD2     7.00       #m;one,m;one  EfR36_CNOESY.list10
   34 HIS  HE1    35 ASN  QD2     6.00       #,m;one  EfR36_CNOESY.list10

#N35
   35 ASN  HA     36 SER  HN      5.00       #,  EfR36_Nnoesy.list10
   35 ASN  HB2    35 ASN  QD2     6.00       #both,m;one  EfR36_Nnoesy.list10
   35 ASN  HB3    35 ASN  QD2     6.00       #both,m;one  EfR36_Nnoesy.list10
   35 ASN  HB2    36 SER  HN      5.00       #both,  EfR36_Nnoesy.list10
   35 ASN  HB3    36 SER  HN      5.00       #both,  EfR36_Nnoesy.list10
   35 ASN  QD2    51 VAL  QG2     7.00       #m;one,m;Me  EfR36_CNOESY.list10

#S36
   36 SER  HN     36 SER  HA      5.00       #,  EfR36_CNOESY.list10
   36 SER  HN     36 SER  HB2     5.00       #,both  EfR36_CNOESY.list10
   36 SER  HN     36 SER  HB3     5.00       #,both  EfR36_Nnoesy.list10
   36 SER  HN     37 GLY  HN      3.50       #,  EfR36_Nnoesy.list10
#   36 SER  HA     36 SER  HB2     5.00       #,both  EfR36_CNOESY.list10
#   36 SER  HA     36 SER  HB3     5.00       #,both  EfR36_CNOESY.list10
   36 SER  QB     37 GLY  HN      6.00       #m;one,  EfR36_Nnoesy.list10

#T38
   38 THR  HN     38 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
   38 THR  HA     38 THR  QG2     5.60       #,i;Me  EfR36_CNOESY.list10
   38 THR  HA     39 GLY  HN      5.00       #,  EfR36_Nnoesy.list10

#G39
   39 GLY  HN     39 GLY  QA      5.60       #,i;da  EfR36_Nnoesy.list10
   39 GLY  QA     40 ALA  HN      5.60       #i;da,  EfR36_Nnoesy.list10

#A40
   40 ALA  HN     40 ALA  HA      5.00       #,  EfR36_Nnoesy.list10
   40 ALA  HN     40 ALA  QB      5.60       #,i;Me  EfR36_Nnoesy.list10
   40 ALA  HN     41 LYS  HA      5.00       #,  EfR36_CNOESY.list10
#   40 ALA  HA     40 ALA  QB      5.20       #, ;Me  EfR36_CNOESY.list10
   40 ALA  HA     41 LYS  HN      5.00       #,  EfR36_CNOESY.list10

#K41
   41 LYS  HN     41 LYS  HA      5.00       #,  EfR36_CNOESY.list10
   41 LYS  HN     41 LYS  QB      6.00       #,m;db  EfR36_Nnoesy.list10
#   41 LYS  QB     41 LYS  QG      7.00       #m;db,m;dg  EfR36_CNOESY.list10

#Y42
   42 TYR  HN     42 TYR  HA      5.00       #,  EfR36_Nnoesy.list10
   42 TYR  HN     42 TYR  HB2     5.00       #,both  EfR36_Nnoesy.list10
   42 TYR  HN     42 TYR  HB3     5.00       #,both  EfR36_Nnoesy.list10

#L45
   45 LEU  HA     46 ALA  HN      5.00       #,  EfR36_Nnoesy.list10
   45 LEU  QB     45 LEU  QQD     8.40       #m;db,q;dMe  EfR36_CNOESY.list10
   45 LEU  QB     46 ALA  QB      7.00       #m;db,m;Me  EfR36_CNOESY.list10
   45 LEU  QQD    47 LYS  HA      7.40       #q;dMe,  EfR36_CNOESY.list10
   45 LEU  QQD    47 LYS  QE      8.40       #q;dMe,m;de  EfR36_CNOESY.list10

#A46
   46 ALA  HN     46 ALA  QB      5.60       #,i;Me  EfR36_Nnoesy.list10

#K47
   47 LYS  HN     47 LYS  HA      5.00       #,  EfR36_Nnoesy.list10
   47 LYS  HN     47 LYS  HB2     5.00       #,both  EfR36_CNOESY.list10
   47 LYS  HN     47 LYS  HB3     5.00       #,both  EfR36_CNOESY.list10
   47 LYS  HN     47 LYS  QG      6.00       #,m;dg  EfR36_CNOESY.list10
   47 LYS  HN     48 ARG  HN      5.00       #,  EfR36_Nnoesy.list10
#   47 LYS  HA     47 LYS  HB2     5.00       #,both  EfR36_CNOESY.list10
#   47 LYS  HA     47 LYS  HB3     5.00       #,both  EfR36_CNOESY.list10
   47 LYS  HA     47 LYS  QG      6.00       #,m;dg  EfR36_CNOESY.list10
   47 LYS  HA     48 ARG  HN      5.00       #,  EfR36_CNOESY.list10
   47 LYS  HB2    47 LYS  HD2     5.00       #both,both  EfR36_CNOESY.list10
   47 LYS  HB2    47 LYS  HD3     5.00       #both,both  EfR36_CNOESY.list10
   47 LYS  HB3    47 LYS  HD2     5.00       #both,both  EfR36_CNOESY.list10
   47 LYS  HB3    47 LYS  HD3     5.00       #both,both  EfR36_CNOESY.list10
#   47 LYS  QB     47 LYS  QG      7.00       #m;one,m;dg  EfR36_CNOESY.list10
   47 LYS  QB     47 LYS  QE      7.00       #m;one,m;de  EfR36_CNOESY.list10
   47 LYS  QB     48 ARG  HN      6.00       #m;one,  EfR36_Nnoesy.list10
#   47 LYS  HD2    47 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
#   47 LYS  HD3    47 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
   47 LYS  QD     48 ARG  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   47 LYS  QG     47 LYS  QE      7.00       #m;dg,m;de  EfR36_CNOESY.list10
   47 LYS  QG     48 ARG  HN      6.00       #m;dg,  EfR36_Nnoesy.list10

#R48
   48 ARG  HN     48 ARG  HA      5.00       #,  EfR36_Nnoesy.list10
   48 ARG  HN     48 ARG  QB      6.00       #,m;db  EfR36_CNOESY.list10
#   48 ARG  HA     48 ARG  QB      6.00       #,m;db  EfR36_CNOESY.list10

#P50
#   50 PRO  HA     50 PRO  HB2     5.00       #,both  EfR36_CNOESY.list10
#   50 PRO  HA     50 PRO  HB3     5.00       #,both  EfR36_CNOESY.list10
#   50 PRO  HA     50 PRO  QG      6.00       #,m;dg  EfR36_CNOESY.list10
#   50 PRO  HA     50 PRO  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   50 PRO  HA     51 VAL  HA      5.00       #,  EfR36_CNOESY.list10
   50 PRO  HA     51 VAL  QG1     6.00       #,m;bothMe  EfR36_CNOESY.list10
   50 PRO  HA     51 VAL  QG2     6.00       #,m;bothMe  EfR36_CNOESY.list10
#   50 PRO  HB2    50 PRO  QG      6.00       #both,m;dg  EfR36_CNOESY.list10
#   50 PRO  HB3    50 PRO  QG      6.00       #both,m;dg  EfR36_CNOESY.list10
#   50 PRO  HB2    50 PRO  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
#   50 PRO  HB3    50 PRO  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
#   50 PRO  QG     50 PRO  QD      7.00       #m;dg,m;dd  EfR36_CNOESY.list10

#V51
#   51 VAL  HA     51 VAL  HB      5.00       #,  EfR36_CNOESY.list10
   51 VAL  HA     51 VAL  QG1     6.00       #,m;bothMe  EfR36_CNOESY.list10
   51 VAL  HA     51 VAL  QG2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   51 VAL  HA     52 ILE  HN      3.50       #,  EfR36_Nnoesy.list10
#   51 VAL  HB     51 VAL  QG1     6.00       #,m;bothMe  EfR36_CNOESY.list10
#   51 VAL  HB     51 VAL  QG2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   51 VAL  HB     52 ILE  HN      5.00       #,  EfR36_CNOESY.list10
   51 VAL  HB     53 MET  QE      6.00       #,m;Me  EfR36_CNOESY.list10
#   51 VAL  QG1    51 VAL  QG2     7.00       #m;Me,m;Me  EfR36_CNOESY.list10
   51 VAL  QG1    52 ILE  HN      6.00       #m;bothMe,  EfR36_CNOESY.list10
   51 VAL  QG2    52 ILE  HN      6.00       #m;bothMe,  EfR36_CNOESY.list10

#I52
   52 ILE  HN     52 ILE  HA      5.00       #,  EfR36_Nnoesy.list10
   52 ILE  HN     52 ILE  HB      5.00       #,  EfR36_Nnoesy.list10
   52 ILE  HN     52 ILE  HG12    5.00       #,both  EfR36_Nnoesy.list10
   52 ILE  HN     52 ILE  HG13    5.00       #,both  EfR36_Nnoesy.list10
   52 ILE  HN     52 ILE  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   52 ILE  HN     52 ILE  QD1     6.00       #,m;Me  EfR36_CNOESY.list10
   52 ILE  HN     53 MET  HN      5.00       #,  EfR36_Nnoesy.list10
#   52 ILE  HA     52 ILE  HB      5.00       #,  EfR36_CNOESY.list10
   52 ILE  HA     52 ILE  HG12    5.00       #,both  EfR36_CNOESY.list10
   52 ILE  HA     52 ILE  HG13    5.00       #,both  EfR36_CNOESY.list10
   52 ILE  HA     52 ILE  QG2     5.60       #,i;Me  EfR36_CNOESY.list10
   52 ILE  HA     52 ILE  QD1     6.00       #,m;Me  EfR36_CNOESY.list10
   52 ILE  HA     53 MET  HN      2.90       #,  EfR36_Nnoesy.list10
#   52 ILE  HB     52 ILE  HG12    5.00       #,both  EfR36_CNOESY.list10
#   52 ILE  HB     52 ILE  HG13    5.00       #,both  EfR36_CNOESY.list10
#   52 ILE  HB     52 ILE  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   52 ILE  HB     52 ILE  QD1     6.00       #,m;Me  EfR36_CNOESY.list10
   52 ILE  HB     53 MET  HN      5.00       #,  EfR36_CNOESY.list10
   52 ILE  HB     54 ILE  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   52 ILE  HG12   52 ILE  QG2     6.00       #both,m;Me  EfR36_CNOESY.list10
   52 ILE  HG13   52 ILE  QG2     6.00       #both,m;Me  EfR36_CNOESY.list10
#   52 ILE  HG12   52 ILE  QD1     6.00       #both,m;Me  EfR36_CNOESY.list10
#   52 ILE  HG13   52 ILE  QD1     6.00       #both,m;Me  EfR36_CNOESY.list10
   52 ILE  QG1    53 MET  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   52 ILE  QG1    54 ILE  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   52 ILE  QG1    54 ILE  QG1     7.00       #m;one,m;dg  EfR36_CNOESY.list10
   52 ILE  HG12   54 ILE  QG2     6.00       #both,m;Me  EfR36_CNOESY.list10
   52 ILE  HG13   54 ILE  QG2     6.00       #both,m;Me  EfR36_CNOESY.list10
   52 ILE  QG1    54 ILE  QD1     7.00       #m;one,m;Me  EfR36_CNOESY.list10
   52 ILE  QG2    52 ILE  QD1     7.00       #m;Me,m;Me  EfR36_CNOESY.list10
   52 ILE  QG2    53 MET  HN      6.00       #m;Me,  EfR36_CNOESY.list10
   52 ILE  QG2    54 ILE  QG2     7.00       #m;Me,m;Me  EfR36_CNOESY.list10
   52 ILE  QD1    53 MET  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   52 ILE  QD1    54 ILE  QG1     7.00       #m;Me,m;dg  EfR36_CNOESY.list10
   52 ILE  QD1    54 ILE  QG2     7.00       #m;Me,m;Me  EfR36_CNOESY.list10

#M53
   53 MET  HN     53 MET  HA      5.00       #,  EfR36_Nnoesy.list10
   53 MET  HN     53 MET  HB2     5.00       #,both  EfR36_Nnoesy.list10
   53 MET  HN     53 MET  HB3     5.00       #,both  EfR36_CNOESY.list10
   53 MET  HN     53 MET  QE      6.00       #,m;Me  EfR36_CNOESY.list10
   53 MET  HN     54 ILE  HN      5.00       #,  EfR36_Nnoesy.list10
   53 MET  HN     54 ILE  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
#   53 MET  HA     53 MET  HB2     5.00       #,both  EfR36_CNOESY.list10
#   53 MET  HA     53 MET  HB3     5.00       #,both  EfR36_CNOESY.list10
   53 MET  HA     53 MET  HG2     5.00       #,both  EfR36_CNOESY.list10
   53 MET  HA     53 MET  HG3     5.00       #,both  EfR36_CNOESY.list10
   53 MET  HA     53 MET  QE      6.00       #,m;Me  EfR36_CNOESY.list10
   53 MET  HA     54 ILE  HN      3.50       #,  EfR36_Nnoesy.list10
   53 MET  HA     55 HIS  HN      5.00       #,  EfR36_Nnoesy.list10
#   53 MET  HB2    53 MET  QG      6.00       #both,m;one  EfR36_CNOESY.list10
#   53 MET  HB3    53 MET  QG      6.00       #both,m;one  EfR36_CNOESY.list10
#   53 MET  HB3    53 MET  QG      6.00       #both,m;one  EfR36_CNOESY.list10
   53 MET  QB     53 MET  QE      7.00       #m;one,m;Me  EfR36_CNOESY.list10
   53 MET  HG2    53 MET  QE      6.00       #both,m;Me  EfR36_CNOESY.list10
   53 MET  HG3    53 MET  QE      6.00       #both,m;Me  EfR36_CNOESY.list10
   53 MET  HG2    54 ILE  HN      5.00       #both,  EfR36_CNOESY.list10
   53 MET  HG3    54 ILE  HN      5.00       #both,  EfR36_CNOESY.list10
   53 MET  HG2    55 HIS  HN      5.00       #both,  EfR36_CNOESY.list10
   53 MET  HG3    55 HIS  HN      5.00       #both,  EfR36_CNOESY.list10
   53 MET  HG2    56 THR  QG2     6.00       #both,m;Me  EfR36_CNOESY.list10
   53 MET  HG3    56 THR  QG2     6.00       #both,m;Me  EfR36_CNOESY.list10
   53 MET  QE     56 THR  QG2     7.00       #m;Me,m;Me  EfR36_CNOESY.list10

#I54
   54 ILE  HN     54 ILE  HA      5.00       #,  EfR36_Nnoesy.list10
   54 ILE  HN     54 ILE  HB      5.00       #,  EfR36_Nnoesy.list10
   54 ILE  HN     54 ILE  QG1     6.00       #,m;dg  EfR36_Nnoesy.list10
   54 ILE  HN     54 ILE  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   54 ILE  HN     54 ILE  QD1     6.00       #,m;Me  EfR36_CNOESY.list10
   54 ILE  HN     55 HIS  HN      3.50       #,  EfR36_Nnoesy.list10
   54 ILE  HN     55 HIS  QB      6.00       #,m;one  EfR36_Nnoesy.list10
   54 ILE  HN     56 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
#   54 ILE  HA     54 ILE  HB      3.50       #,  EfR36_CNOESY.list10
   54 ILE  HA     54 ILE  QG2     5.60       #,i;Me  EfR36_CNOESY.list10
   54 ILE  HA     54 ILE  QD1     6.00       #,m;Me  EfR36_CNOESY.list10
   54 ILE  HA     55 HIS  HN      5.00       #,  EfR36_Nnoesy.list10
   54 ILE  HA     56 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
#   54 ILE  HB     54 ILE  QG1     6.00       #,m;dg  EfR36_CNOESY.list10
#   54 ILE  HB     54 ILE  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   54 ILE  HB     54 ILE  QD1     6.00       #,m;Me  EfR36_CNOESY.list10
   54 ILE  HB     55 HIS  HN      5.00       #,  EfR36_Nnoesy.list10
   54 ILE  QG1    54 ILE  QG2     7.00       #m;dg,m;Me  EfR36_CNOESY.list10
#   54 ILE  QG1    54 ILE  QD1     7.00       #m;dg,m;Me  EfR36_CNOESY.list10
   54 ILE  QG1    55 HIS  HN      6.00       #m;dg,  EfR36_Nnoesy.list10
   54 ILE  QG2    54 ILE  QD1     7.00       #m;Me,m;Me  EfR36_CNOESY.list10
   54 ILE  QG2    55 HIS  HN      6.00       #m;Me,  EfR36_CNOESY.list10
   54 ILE  QD1    55 HIS  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   54 ILE  QD1    55 HIS  HA      6.00       #m;Me,  EfR36_CNOESY.list10
   54 ILE  QD1    55 HIS  HB2     6.00       #m;Me,both  EfR36_CNOESY.list10
   54 ILE  QD1    55 HIS  HB3     6.00       #m;Me,both  EfR36_CNOESY.list10
   54 ILE  QD1    84 LEU  QD1     7.00       #m;Me,m;bothMe  EfR36_CNOESY.list10
   54 ILE  QD1    84 LEU  QD2     7.00       #m;Me,m;bothMe  EfR36_CNOESY.list10

#H55
   55 HIS  HN     55 HIS  HA      5.00       #,  EfR36_CNOESY.list10
   55 HIS  HN     55 HIS  HB2     5.00       #,both  EfR36_Nnoesy.list10
   55 HIS  HN     55 HIS  HB3     5.00       #,both  EfR36_Nnoesy.list10
   55 HIS  HN     56 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
   55 HIS  HN     84 LEU  QD2     6.00       #,m;Me  EfR36_Nnoesy.list10
#   55 HIS  HA     55 HIS  HB2     5.00       #,both  EfR36_CNOESY.list10
#   55 HIS  HA     55 HIS  HB3     5.00       #,both  EfR36_CNOESY.list10
   55 HIS  HA     55 HIS  HE1     5.00       #,  EfR36_CNOESY.list10
   55 HIS  HA     56 THR  HN      3.50       #,  EfR36_CNOESY.list10
   55 HIS  HA     56 THR  HA      5.00       #,  EfR36_CNOESY.list10
   55 HIS  QB     56 THR  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   55 HIS  QB     56 THR  HA      6.00       #m;one,  EfR36_CNOESY.list10
   55 HIS  HB2    84 LEU  QD2     6.00       #both,m;Me  EfR36_CNOESY.list10
   55 HIS  HB3    84 LEU  QD2     6.00       #both,m;Me  EfR36_CNOESY.list10
   55 HIS  HE1    81 GLU  HN      5.00       #,  EfR36_CNOESY.list10
   55 HIS  HE1    82 GLN  HN      5.00       #,  EfR36_CNOESY.list10
   55 HIS  HE1    83 TYR  QB      6.00       #,m;one  EfR36_CNOESY.list10

#T56
   56 THR  HN     56 THR  HA      5.00       #,  EfR36_CNOESY.list10
   56 THR  HN     56 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
   56 THR  HN     57 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
#   56 THR  HA     56 THR  HB      5.00       #,  EfR36_CNOESY.list10
   56 THR  HA     56 THR  QG2     5.60       #,i;Me  EfR36_CNOESY.list10
   56 THR  HA     57 GLU  HN      3.50       #,  EfR36_Nnoesy.list10
#   56 THR  HB     56 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   56 THR  HB     57 GLU  HN      5.00       #,  EfR36_CNOESY.list10
   56 THR  QG2    57 GLU  HN      6.00       #m;Me,  EfR36_Nnoesy.list10

#E57
   57 GLU  HN     57 GLU  HA      5.00       #,  EfR36_Nnoesy.list10
   57 GLU  HN     57 GLU  HB2     5.00       #,both  EfR36_Nnoesy.list10
   57 GLU  HN     57 GLU  HB3     5.00       #,both  EfR36_Nnoesy.list10
   57 GLU  HN     58 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
#   57 GLU  HA     57 GLU  HB2     5.00       #,both  EfR36_CNOESY.list10
#   57 GLU  HA     57 GLU  HB3     5.00       #,both  EfR36_CNOESY.list10
   57 GLU  HA     57 GLU  HG2     5.00       #,both  EfR36_CNOESY.list10
   57 GLU  HA     57 GLU  HG3     5.00       #,both  EfR36_CNOESY.list10
   57 GLU  HA     58 LYS  HN      2.90       #,  EfR36_CNOESY.list10
#   57 GLU  HB2    57 GLU  QG      6.00       #both,m;one  EfR36_CNOESY.list10
#   57 GLU  HB3    57 GLU  QG      6.00       #both,m;one  EfR36_CNOESY.list10
#   57 GLU  HB3    57 GLU  QG      6.00       #both,m;one  EfR36_CNOESY.list10
   57 GLU  HB2    58 LYS  HN      5.00       #both,  EfR36_Nnoesy.list10
   57 GLU  HB3    58 LYS  HN      5.00       #both,  EfR36_Nnoesy.list10
   57 GLU  HG2    58 LYS  HN      5.00       #both,  EfR36_Nnoesy.list10
   57 GLU  HG3    58 LYS  HN      5.00       #both,  EfR36_Nnoesy.list10

#K58
   58 LYS  HN     58 LYS  HA      5.00       #,  EfR36_CNOESY.list10
   58 LYS  HN     58 LYS  HB2     5.00       #,both  EfR36_Nnoesy.list10
   58 LYS  HN     58 LYS  HB3     5.00       #,both  EfR36_CNOESY.list10
   58 LYS  HN     58 LYS  HG2     5.00       #,both  EfR36_Nnoesy.list10
   58 LYS  HN     58 LYS  HG3     5.00       #,both  EfR36_Nnoesy.list10
   58 LYS  HN     58 LYS  QD      6.00       #,m;one  EfR36_Nnoesy.list10
   58 LYS  HN     58 LYS  QE      6.00       #,m;de  EfR36_Nnoesy.list10
   58 LYS  HN     59 PHE  HN      5.00       #,  EfR36_Nnoesy.list10
#   58 LYS  HA     58 LYS  HB2     5.00       #,both  EfR36_CNOESY.list10
#   58 LYS  HA     58 LYS  HB3     5.00       #,both  EfR36_CNOESY.list10
   58 LYS  HA     58 LYS  HG2     5.00       #,both  EfR36_CNOESY.list10
   58 LYS  HA     58 LYS  HG3     5.00       #,both  EfR36_CNOESY.list10
   58 LYS  HA     59 PHE  HN      3.50       #,  EfR36_Nnoesy.list10
#   58 LYS  HB2    58 LYS  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   58 LYS  HB2    58 LYS  HG3     5.00       #both,both  EfR36_CNOESY.list10
#   58 LYS  HB3    58 LYS  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   58 LYS  HB3    58 LYS  HG3     5.00       #both,both  EfR36_CNOESY.list10
   58 LYS  HB2    58 LYS  QD      6.00       #both,m;one  EfR36_CNOESY.list10
   58 LYS  HB3    58 LYS  QD      6.00       #both,m;one  EfR36_CNOESY.list10
   58 LYS  HB3    58 LYS  QD      6.00       #both,m;one  EfR36_CNOESY.list10
   58 LYS  HB2    58 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
   58 LYS  HB3    58 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
   58 LYS  HB2    59 PHE  HN      5.00       #both,  EfR36_Nnoesy.list10
   58 LYS  HB3    59 PHE  HN      5.00       #both,  EfR36_Nnoesy.list10
#   58 LYS  HG2    58 LYS  HD2     5.00       #both,both  EfR36_CNOESY.list10
#   58 LYS  HG2    58 LYS  HD3     5.00       #both,both  EfR36_CNOESY.list10
#   58 LYS  HG3    58 LYS  HD2     5.00       #both,both  EfR36_CNOESY.list10
#   58 LYS  HG3    58 LYS  HD3     5.00       #both,both  EfR36_CNOESY.list10
   58 LYS  HG2    58 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
   58 LYS  HG3    58 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
   58 LYS  HG2    59 PHE  HN      5.00       #both,  EfR36_Nnoesy.list10
   58 LYS  HG3    59 PHE  HN      5.00       #both,  EfR36_Nnoesy.list10
#   58 LYS  HD2    58 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
#   58 LYS  HD3    58 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10

#F59
   59 PHE  HN     59 PHE  HA      5.00       #,  EfR36_Nnoesy.list10
   59 PHE  HN     59 PHE  HB2     5.00       #,both  EfR36_Nnoesy.list10
   59 PHE  HN     59 PHE  HB3     5.00       #,both  EfR36_Nnoesy.list10
   59 PHE  HN     60 GLU  HA      5.00       #,  EfR36_Nnoesy.list10
   59 PHE  HN     59 PHE  QD      7.00       #,r;dd  EfR36_Nnoesy.list10
   59 PHE  HN     59 PHE  QE      7.00       #,r;de  EfR36_Nnoesy.list10
#   59 PHE  HA     59 PHE  HB2     5.00       #,both  EfR36_CNOESY.list10
#   59 PHE  HA     59 PHE  HB3     5.00       #,both  EfR36_CNOESY.list10
   59 PHE  HA     60 GLU  HN      3.50       #,  EfR36_Nnoesy.list10
   59 PHE  HA     61 THR  HN      5.00       #,  EfR36_Nnoesy.list10
   59 PHE  HA     59 PHE  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   59 PHE  HB2    60 GLU  HN      5.00       #both,  EfR36_Nnoesy.list10
   59 PHE  HB3    60 GLU  HN      5.00       #both,  EfR36_Nnoesy.list10
   59 PHE  HB2    61 THR  HN      5.00       #both,  EfR36_Nnoesy.list10
   59 PHE  HB3    61 THR  HN      5.00       #both,  EfR36_Nnoesy.list10
   59 PHE  QB     64 GLU  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   59 PHE  QB     64 GLU  HB2     6.00       #m;one,both  EfR36_CNOESY.list10
   59 PHE  QB     64 GLU  HB3     6.00       #m;one,both  EfR36_CNOESY.list10
   59 PHE  QB     65 ALA  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   59 PHE  QB     65 ALA  QB      7.00       #m;one,m;Me  EfR36_CNOESY.list10
   59 PHE  HB2    59 PHE  QD      7.00       #both,r;dd  EfR36_CNOESY.list10
   59 PHE  HB3    59 PHE  QD      7.00       #both,r;dd  EfR36_CNOESY.list10

#E60
   60 GLU  HN     60 GLU  HA      3.50       #,  EfR36_Nnoesy.list10
   60 GLU  HN     60 GLU  HB2     5.00       #,both  EfR36_CNOESY.list10
   60 GLU  HN     60 GLU  HB3     5.00       #,both  EfR36_CNOESY.list10
   60 GLU  HN     60 GLU  HG2     5.00       #,both  EfR36_Nnoesy.list10
   60 GLU  HN     60 GLU  HG3     5.00       #,both  EfR36_Nnoesy.list10
   60 GLU  HN     61 THR  HN      3.50       #,  EfR36_Nnoesy.list10
   60 GLU  HN     61 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
#   60 GLU  HA     60 GLU  HB2     3.50       #,both  EfR36_CNOESY.list10
#   60 GLU  HA     60 GLU  HB3     3.50       #,both  EfR36_CNOESY.list10
   60 GLU  HA     60 GLU  HG2     5.00       #,both  EfR36_CNOESY.list10
   60 GLU  HA     60 GLU  HG3     5.00       #,both  EfR36_CNOESY.list10
   60 GLU  HA     61 THR  HN      5.00       #,  EfR36_CNOESY.list10
#   60 GLU  HB2    60 GLU  QG      6.00       #both,m;one  EfR36_CNOESY.list10
#   60 GLU  HB2    60 GLU  QG      6.00       #both,m;one  EfR36_CNOESY.list10
#   60 GLU  HB3    60 GLU  QG      6.00       #both,m;one  EfR36_CNOESY.list10
   60 GLU  HB2    61 THR  HN      5.00       #both,  EfR36_Nnoesy.list10
   60 GLU  HB3    61 THR  HN      5.00       #both,  EfR36_Nnoesy.list10
   60 GLU  HB2    61 THR  QG2     6.00       #both,m;Me  EfR36_CNOESY.list10
   60 GLU  HB3    61 THR  QG2     6.00       #both,m;Me  EfR36_CNOESY.list10
   60 GLU  HG2    61 THR  HN      5.00       #both,  EfR36_Nnoesy.list10
   60 GLU  HG3    61 THR  HN      5.00       #both,  EfR36_Nnoesy.list10
   60 GLU  HG2    61 THR  QG2     6.00       #both,m;Me  EfR36_CNOESY.list10
   60 GLU  HG3    61 THR  QG2     6.00       #both,m;Me  EfR36_CNOESY.list10

#T61
   61 THR  HN     61 THR  HB      5.00       #,  EfR36_Nnoesy.list10
   61 THR  HN     61 THR  HA      5.00       #,  EfR36_CNOESY.list10
   61 THR  HN     61 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
   61 THR  HN     62 ARG  HN      5.00       #,  EfR36_Nnoesy.list10
   61 THR  HN     64 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
   61 THR  HN     64 GLU  QB      6.00       #,m;one  EfR36_Nnoesy.list10
   61 THR  HN     64 GLU  QG      6.00       #,m;dg  EfR36_Nnoesy.list10
   61 THR  HN     65 ALA  QB      6.00       #,m;Me  EfR36_Nnoesy.list10
#   61 THR  HB     61 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   61 THR  HB     62 ARG  HN      3.50       #,  EfR36_Nnoesy.list10
   61 THR  HB     62 ARG  HA      5.00       #,  EfR36_CNOESY.list10
   61 THR  HB     63 SER  HN      5.00       #,  EfR36_Nnoesy.list10
   61 THR  HB     64 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
#   61 THR  HA     61 THR  HB      3.50       #,  EfR36_CNOESY.list10
   61 THR  HA     61 THR  QG2     5.60       #,i;Me  EfR36_CNOESY.list10
   61 THR  HA     62 ARG  HN      3.50       #,  EfR36_CNOESY.list10
   61 THR  HA     62 ARG  HA      5.00       #,  EfR36_CNOESY.list10
   61 THR  QG2    62 ARG  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   61 THR  QG2    64 GLU  HN      6.00       #m;Me,  EfR36_Nnoesy.list10

#R62
   62 ARG  HN     62 ARG  HB2     5.00       #,both  EfR36_CNOESY.list10
   62 ARG  HN     62 ARG  HB3     5.00       #,both  EfR36_CNOESY.list10
   62 ARG  HN     62 ARG  QG      6.00       #,m;dg  EfR36_Nnoesy.list10
   62 ARG  HN     62 ARG  QD      6.00       #,m;one  EfR36_Nnoesy.list10
#   62 ARG  HB2    62 ARG  QG      6.00       #both,m;dg  EfR36_CNOESY.list10
#   62 ARG  HB3    62 ARG  QG      6.00       #both,m;dg  EfR36_CNOESY.list10
   62 ARG  HB2    62 ARG  QD      6.00       #both,m;one  EfR36_CNOESY.list10
   62 ARG  HB2    62 ARG  QD      6.00       #both,m;one  EfR36_CNOESY.list10
   62 ARG  HB3    62 ARG  QD      6.00       #both,m;one  EfR36_CNOESY.list10
#   62 ARG  QG     62 ARG  HD2     6.00       #m;dg,both  EfR36_CNOESY.list10
#   62 ARG  QG     62 ARG  HD3     6.00       #m;dg,both  EfR36_CNOESY.list10
   62 ARG  QG     65 ALA  HN      6.00       #m;dg,  EfR36_Nnoesy.list10
   62 ARG  QG     66 THR  HN      6.00       #m;dg,  EfR36_Nnoesy.list10
   62 ARG  QG     66 THR  QG2     7.00       #m;dg,m;Me  EfR36_CNOESY.list10
   62 ARG  QD     66 THR  QG2     7.00       #m;one,m;Me  EfR36_CNOESY.list10

#S63
   63 SER  HN     63 SER  QB      6.00       #,m;one  EfR36_Nnoesy.list10
#   63 SER  HA     63 SER  HB2     3.50       #,both  EfR36_CNOESY.list10
#   63 SER  HA     63 SER  HB3     3.50       #,both  EfR36_CNOESY.list10
   63 SER  HA     64 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
   63 SER  HA     65 ALA  HN      5.00       #,  EfR36_Nnoesy.list10
   63 SER  HA     66 THR  HN      5.00       #,  EfR36_Nnoesy.list10
   63 SER  HA     66 THR  HB      5.00       #,  EfR36_CNOESY.list10
   63 SER  HA     66 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   63 SER  HA     67 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
   63 SER  HB2    64 GLU  HN      5.00       #both,  EfR36_CNOESY.list10
   63 SER  HB3    64 GLU  HN      5.00       #both,  EfR36_CNOESY.list10
   63 SER  HB2    64 GLU  HA      5.00       #both,  EfR36_CNOESY.list10
   63 SER  HB3    64 GLU  HA      5.00       #both,  EfR36_CNOESY.list10
   63 SER  QB     64 GLU  QB      7.00       #m;one,m;one  EfR36_CNOESY.list10

#E64
   64 GLU  HN     64 GLU  HA      5.00       #,  EfR36_CNOESY.list10
   64 GLU  HN     64 GLU  HB2     5.00       #,both  EfR36_CNOESY.list10
   64 GLU  HN     64 GLU  HB3     5.00       #,both  EfR36_CNOESY.list10
   64 GLU  HN     64 GLU  QG      6.00       #,m;dg  EfR36_Nnoesy.list10
   64 GLU  HN     65 ALA  HN      3.50       #,  EfR36_Nnoesy.list10
   64 GLU  HN     65 ALA  QB      6.00       #,m;Me  EfR36_Nnoesy.list10
   64 GLU  HN     66 THR  HN      5.00       #,  EfR36_Nnoesy.list10
   64 GLU  HN     67 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
#   64 GLU  HA     64 GLU  HB2     5.00       #,both  EfR36_CNOESY.list10
#   64 GLU  HA     64 GLU  HB3     5.00       #,both  EfR36_CNOESY.list10
   64 GLU  HA     64 GLU  QG      6.00       #,m;dg  EfR36_CNOESY.list10
   64 GLU  HA     65 ALA  HN      5.00       #,  EfR36_CNOESY.list10
   64 GLU  HA     67 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
   64 GLU  HA     67 LYS  HB2     5.00       #,both  EfR36_CNOESY.list10
   64 GLU  HA     67 LYS  HB3     5.00       #,both  EfR36_CNOESY.list10
   64 GLU  HA     67 LYS  QG      6.00       #,m;one  EfR36_CNOESY.list10
   64 GLU  HA     67 LYS  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   64 GLU  HA     68 ALA  HN      5.00       #,  EfR36_Nnoesy.list10
#   64 GLU  HB2    64 GLU  QG      6.00       #both,m;dg  EfR36_CNOESY.list10
#   64 GLU  HB3    64 GLU  QG      6.00       #both,m;dg  EfR36_CNOESY.list10
   64 GLU  HB2    65 ALA  HN      5.00       #both,  EfR36_CNOESY.list10
   64 GLU  HB3    65 ALA  HN      5.00       #both,  EfR36_CNOESY.list10
   64 GLU  HB2    65 ALA  QB      6.00       #both,m;Me  EfR36_CNOESY.list10
   64 GLU  HB3    65 ALA  QB      6.00       #both,m;Me  EfR36_CNOESY.list10
   64 GLU  QG     65 ALA  HN      6.00       #m;dg,  EfR36_Nnoesy.list10

#A65
   65 ALA  HN     65 ALA  HA      5.00       #,  EfR36_Nnoesy.list10
   65 ALA  HN     65 ALA  QB      5.60       #,i;Me  EfR36_Nnoesy.list10
   65 ALA  HN     66 THR  HN      3.50       #,  EfR36_Nnoesy.list10
   65 ALA  HN     66 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
   65 ALA  HN     67 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
   65 ALA  HN     68 ALA  QB      6.00       #,m;Me  EfR36_Nnoesy.list10
#   65 ALA  HA     65 ALA  QB      5.20       #, ;Me  EfR36_CNOESY.list10
   65 ALA  HA     66 THR  HN      5.00       #,  EfR36_Nnoesy.list10
   65 ALA  HA     68 ALA  HN      5.00       #,  EfR36_CNOESY.list10
   65 ALA  HA     68 ALA  QB      6.00       #,m;Me  EfR36_CNOESY.list10
   65 ALA  HA     69 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
   65 ALA  QB     66 THR  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   65 ALA  QB     66 THR  QG2     7.00       #m;Me,m;Me  EfR36_CNOESY.list10
   65 ALA  QB     68 ALA  HN      6.00       #m;Me,  EfR36_CNOESY.list10
   65 ALA  QB     68 ALA  QB      7.00       #m;Me,m;Me  EfR36_CNOESY.list10

#T66
   66 THR  HN     66 THR  HA      5.00       #,  EfR36_CNOESY.list10
   66 THR  HN     66 THR  HB      5.00       #,  EfR36_CNOESY.list10
   66 THR  HN     66 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
   66 THR  HN     67 LYS  HN      3.50       #,  EfR36_Nnoesy.list10
   66 THR  HN     67 LYS  QB      6.00       #,m;one  EfR36_Nnoesy.list10
   66 THR  HN     68 ALA  HN      5.00       #,  EfR36_Nnoesy.list10
   66 THR  HA     66 THR  QG2     5.60       #,i;Me  EfR36_CNOESY.list10
   66 THR  HA     67 LYS  HN      5.00       #,  EfR36_CNOESY.list10
   66 THR  HA     68 ALA  HN      5.00       #,  EfR36_Nnoesy.list10
   66 THR  HA     69 GLU  HN      5.00       #,  EfR36_CNOESY.list10
   66 THR  HA     69 GLU  HB2     5.00       #,both  EfR36_CNOESY.list10
   66 THR  HA     69 GLU  HB3     5.00       #,both  EfR36_CNOESY.list10
#   66 THR  HB     66 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   66 THR  HB     67 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
   66 THR  QG2    67 LYS  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   66 THR  QG2    67 LYS  HA      6.00       #m;Me,  EfR36_CNOESY.list10
   66 THR  QG2    68 ALA  HN      6.00       #m;Me,  EfR36_CNOESY.list10
   66 THR  QG2    69 GLU  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   66 THR  QG2    70 ALA  HN      6.00       #m;Me,  EfR36_Nnoesy.list10

#K67
   67 LYS  HN     67 LYS  HA      5.00       #,  EfR36_Nnoesy.list10
   67 LYS  HN     67 LYS  HB2     3.50       #,both  EfR36_CNOESY.list10
   67 LYS  HN     67 LYS  HB3     3.50       #,both  EfR36_CNOESY.list10
   67 LYS  HN     67 LYS  HG2     5.00       #,both  EfR36_CNOESY.list10
   67 LYS  HN     67 LYS  HG3     5.00       #,both  EfR36_Nnoesy.list10
   67 LYS  HN     67 LYS  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   67 LYS  HN     67 LYS  QE      6.00       #,m;de  EfR36_Nnoesy.list10
   67 LYS  HN     68 ALA  HN      3.50       #,  EfR36_Nnoesy.list10
   67 LYS  HN     68 ALA  QB      6.00       #,m;Me  EfR36_CNOESY.list10
   67 LYS  HN     69 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
   67 LYS  HN     70 ALA  QB      6.00       #,m;Me  EfR36_Nnoesy.list10
#   67 LYS  HA     67 LYS  HB2     3.50       #,both  EfR36_CNOESY.list10
#   67 LYS  HA     67 LYS  HB3     3.50       #,both  EfR36_CNOESY.list10
   67 LYS  HA     67 LYS  HG2     5.00       #,both  EfR36_CNOESY.list10
   67 LYS  HA     67 LYS  HG3     5.00       #,both  EfR36_CNOESY.list10
   67 LYS  HA     67 LYS  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   67 LYS  HA     67 LYS  QE      6.00       #,m;de  EfR36_CNOESY.list10
   67 LYS  HA     68 ALA  HN      5.00       #,  EfR36_CNOESY.list10
   67 LYS  HA     70 ALA  HN      5.00       #,  EfR36_CNOESY.list10
   67 LYS  HA     70 ALA  QB      6.00       #,m;Me  EfR36_CNOESY.list10
   67 LYS  HA     71 ALA  HN      5.00       #,  EfR36_Nnoesy.list10
#   67 LYS  HB2    67 LYS  QG      6.00       #both,m;one  EfR36_CNOESY.list10
#   67 LYS  HB3    67 LYS  QG      6.00       #both,m;one  EfR36_CNOESY.list10
#   67 LYS  HB3    67 LYS  QG      6.00       #both,m;one  EfR36_CNOESY.list10
   67 LYS  HB2    67 LYS  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   67 LYS  HB3    67 LYS  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   67 LYS  QB     67 LYS  QE      7.00       #m;one,m;de  EfR36_CNOESY.list10
   67 LYS  HB2    68 ALA  HN      5.00       #both,  EfR36_CNOESY.list10
   67 LYS  HB3    68 ALA  HN      5.00       #both,  EfR36_CNOESY.list10
   67 LYS  QB     68 ALA  QB      7.00       #m;one,m;Me  EfR36_CNOESY.list10
#   67 LYS  HG2    67 LYS  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
#   67 LYS  HG3    67 LYS  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   67 LYS  HG2    67 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
   67 LYS  HG3    67 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
   67 LYS  HG2    68 ALA  HN      5.00       #both,  EfR36_Nnoesy.list10
   67 LYS  HG3    68 ALA  HN      5.00       #both,  EfR36_Nnoesy.list10
   67 LYS  QG     68 ALA  HA      6.00       #m;one,  EfR36_CNOESY.list10
   67 LYS  HG2    70 ALA  QB      6.00       #both,m;Me  EfR36_CNOESY.list10
   67 LYS  HG3    70 ALA  QB      6.00       #both,m;Me  EfR36_CNOESY.list10
   67 LYS  QG     71 ALA  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   67 LYS  QG     71 ALA  QB      7.00       #m;one,m;Me  EfR36_CNOESY.list10
#   67 LYS  QD     67 LYS  QE      7.00       #m;dd,m;de  EfR36_CNOESY.list10

#A68
   68 ALA  HN     68 ALA  HA      5.00       #,  EfR36_Nnoesy.list10
   68 ALA  HN     68 ALA  QB      5.60       #,i;Me  EfR36_Nnoesy.list10
   68 ALA  HN     69 GLU  HN      3.50       #,  EfR36_Nnoesy.list10
   68 ALA  HN     69 GLU  QB      6.00       #,m;one  EfR36_Nnoesy.list10
   68 ALA  HN     70 ALA  HN      5.00       #,  EfR36_Nnoesy.list10
#   68 ALA  HA     68 ALA  QB      5.20       #, ;Me  EfR36_CNOESY.list10
   68 ALA  HA     69 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
   68 ALA  HA     71 ALA  QB      6.00       #,m;Me  EfR36_CNOESY.list10
   68 ALA  HA     72 PHE  HN      5.00       #,  EfR36_Nnoesy.list10
   68 ALA  QB     69 GLU  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   68 ALA  QB     69 GLU  QB      7.00       #m;Me,m;one  EfR36_CNOESY.list10
   68 ALA  QB     70 ALA  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   68 ALA  QB     71 ALA  QB      7.00       #m;Me,m;Me  EfR36_CNOESY.list10
   68 ALA  QB     72 PHE  HN      6.00       #m;Me,  EfR36_Nnoesy.list10

#E69
   69 GLU  HN     69 GLU  HA      3.50       #,  EfR36_Nnoesy.list10
   69 GLU  HN     69 GLU  HB2     5.00       #,both  EfR36_CNOESY.list10
   69 GLU  HN     69 GLU  HB3     5.00       #,both  EfR36_CNOESY.list10
   69 GLU  HN     69 GLU  QG      6.00       #,m;one  EfR36_Nnoesy.list10
   69 GLU  HN     70 ALA  HN      3.50       #,  EfR36_Nnoesy.list10
   69 GLU  HN     70 ALA  QB      6.00       #,m;Me  EfR36_Nnoesy.list10
   69 GLU  HN     71 ALA  HN      5.00       #,  EfR36_Nnoesy.list10
#   69 GLU  HA     69 GLU  HB2     5.00       #,both  EfR36_CNOESY.list10
#   69 GLU  HA     69 GLU  HB3     5.00       #,both  EfR36_CNOESY.list10
   69 GLU  HA     69 GLU  HG2     5.00       #,both  EfR36_CNOESY.list10
   69 GLU  HA     69 GLU  HG3     5.00       #,both  EfR36_CNOESY.list10
   69 GLU  HA     70 ALA  HN      5.00       #,  EfR36_Nnoesy.list10
   69 GLU  HA     72 PHE  HN      5.00       #,  EfR36_Nnoesy.list10
   69 GLU  HA     72 PHE  QB      6.00       #,m;one  EfR36_CNOESY.list10
   69 GLU  HA     73 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
#   69 GLU  HB2    69 GLU  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   69 GLU  HB2    69 GLU  HG3     5.00       #both,both  EfR36_CNOESY.list10
#   69 GLU  HB3    69 GLU  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   69 GLU  HB3    69 GLU  HG3     5.00       #both,both  EfR36_CNOESY.list10
   69 GLU  HB2    70 ALA  HN      5.00       #both,  EfR36_CNOESY.list10
   69 GLU  HB3    70 ALA  HN      5.00       #both,  EfR36_CNOESY.list10
   69 GLU  QB     70 ALA  QB      7.00       #m;one,m;Me  EfR36_CNOESY.list10
   69 GLU  HG2    70 ALA  HN      5.00       #both,  EfR36_Nnoesy.list10
   69 GLU  HG3    70 ALA  HN      5.00       #both,  EfR36_Nnoesy.list10

#A70
   70 ALA  HN     70 ALA  HA      5.00       #,  EfR36_Nnoesy.list10
   70 ALA  HN     70 ALA  QB      5.60       #,i;Me  EfR36_Nnoesy.list10
   70 ALA  HN     71 ALA  HN      3.50       #,  EfR36_Nnoesy.list10
   70 ALA  HN     72 PHE  HN      5.00       #,  EfR36_Nnoesy.list10
#   70 ALA  HA     70 ALA  QB      5.20       #, ;Me  EfR36_CNOESY.list10
   70 ALA  HA     71 ALA  HN      5.00       #,  EfR36_Nnoesy.list10
   70 ALA  HA     73 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
   70 ALA  HA     73 LYS  QB      6.00       #,m;db  EfR36_CNOESY.list10
   70 ALA  HA     73 LYS  QG      6.00       #,m;one  EfR36_CNOESY.list10
   70 ALA  HA     73 LYS  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   70 ALA  HA     74 LYS  HN      5.00       #,  EfR36_CNOESY.list10
   70 ALA  QB     71 ALA  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   70 ALA  QB     73 LYS  QB      7.00       #m;Me,m;db  EfR36_CNOESY.list10
   70 ALA  QB     74 LYS  QE      7.00       #m;Me,m;de  EfR36_CNOESY.list10

#A71
   71 ALA  HN     71 ALA  HA      5.00       #,  EfR36_Nnoesy.list10
   71 ALA  HN     71 ALA  QB      5.60       #,i;Me  EfR36_Nnoesy.list10
   71 ALA  HN     72 PHE  HN      3.50       #,  EfR36_Nnoesy.list10
#   71 ALA  HA     71 ALA  QB      5.20       #, ;Me  EfR36_CNOESY.list10
   71 ALA  HA     72 PHE  HN      5.00       #,  EfR36_CNOESY.list10
   71 ALA  HA     74 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
   71 ALA  HA     74 LYS  QB      6.00       #,m;one  EfR36_CNOESY.list10
   71 ALA  HA     74 LYS  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   71 ALA  QB     72 PHE  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   71 ALA  QB     73 LYS  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   71 ALA  QB     74 LYS  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   71 ALA  QB     74 LYS  QB      7.00       #m;Me,m;one  EfR36_CNOESY.list10
   71 ALA  QB     75 LEU  QD1     7.00       #m;Me,m;Me  EfR36_CNOESY.list10

#F72
   72 PHE  HN     72 PHE  HA      5.00       #,  EfR36_Nnoesy.list10
   72 PHE  HN     72 PHE  QB      6.00       #,m;one  EfR36_CNOESY.list10
   72 PHE  HN     72 PHE  QB      3.90       #,m;one  EfR36_Nnoesy.list10
   72 PHE  HN     73 LYS  HN      3.50       #,  EfR36_Nnoesy.list10
   72 PHE  HN     73 LYS  QB      6.00       #,m;db  EfR36_Nnoesy.list10
   72 PHE  HN     74 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
   72 PHE  HN     75 LEU  QB      6.00       #,m;one  EfR36_Nnoesy.list10
#   72 PHE  HA     72 PHE  HB2     5.00       #,both  EfR36_CNOESY.list10
#   72 PHE  HA     72 PHE  HB3     5.00       #,both  EfR36_CNOESY.list10
   72 PHE  HA     75 LEU  HN      5.00       #,  EfR36_Nnoesy.list10
   72 PHE  HA     75 LEU  QB      6.00       #,m;one  EfR36_CNOESY.list10
   72 PHE  HA     75 LEU  HG      5.00       #,  EfR36_CNOESY.list10
   72 PHE  HA     75 LEU  QD1     6.00       #,m;bothMe  EfR36_CNOESY.list10
   72 PHE  HA     75 LEU  QD2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   72 PHE  HA     72 PHE  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   72 PHE  HB2    73 LYS  HN      5.00       #both,  EfR36_CNOESY.list10
   72 PHE  HB3    73 LYS  HN      5.00       #both,  EfR36_CNOESY.list10
   72 PHE  QB     74 LYS  HN      6.00       #m;one,  EfR36_CNOESY.list10
   72 PHE  QB     72 PHE  QD      8.00       #m;one,r;dd  EfR36_CNOESY.list10

#K73
   73 LYS  HN     73 LYS  HA      3.50       #,  EfR36_Nnoesy.list10
   73 LYS  HN     73 LYS  QB      4.50       #,m;db  EfR36_Nnoesy.list10
   73 LYS  HN     73 LYS  HG2     5.00       #,both  EfR36_CNOESY.list10
   73 LYS  HN     73 LYS  HG3     5.00       #,both  EfR36_CNOESY.list10
   73 LYS  HN     73 LYS  QD      6.00       #,m;dd  EfR36_Nnoesy.list10
   73 LYS  HN     74 LYS  HN      3.50       #,  EfR36_Nnoesy.list10
   73 LYS  HN     75 LEU  HN      5.00       #,  EfR36_Nnoesy.list10
#   73 LYS  HA     73 LYS  QB      4.50       #,m;db  EfR36_CNOESY.list10
   73 LYS  HA     73 LYS  HG2     5.00       #,both  EfR36_CNOESY.list10
   73 LYS  HA     73 LYS  HG3     5.00       #,both  EfR36_CNOESY.list10
   73 LYS  HA     73 LYS  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   73 LYS  HA     73 LYS  QE      6.00       #,m;de  EfR36_CNOESY.list10
   73 LYS  HA     74 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
   73 LYS  HA     75 LEU  HN      5.00       #,  EfR36_CNOESY.list10
   73 LYS  HA     80 LYS  HE2     5.00       #,both  EfR36_CNOESY.list10
   73 LYS  HA     80 LYS  HE3     5.00       #,both  EfR36_CNOESY.list10
#   73 LYS  QB     73 LYS  HG2     6.00       #m;db,both  EfR36_CNOESY.list10
#   73 LYS  QB     73 LYS  HG3     6.00       #m;db,both  EfR36_CNOESY.list10
   73 LYS  QB     73 LYS  QD      7.00       #m;db,m;dd  EfR36_CNOESY.list10
   73 LYS  QB     73 LYS  QE      7.00       #m;db,m;de  EfR36_CNOESY.list10
   73 LYS  QB     74 LYS  HN      6.00       #m;db,  EfR36_CNOESY.list10
#   73 LYS  HG2    73 LYS  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
#   73 LYS  HG3    73 LYS  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   73 LYS  QG     73 LYS  QE      7.00       #m;one,m;de  EfR36_CNOESY.list10
#   73 LYS  QD     73 LYS  QE      7.00       #m;dd,m;de  EfR36_CNOESY.list10

#K74
   74 LYS  HN     74 LYS  HA      3.50       #,  EfR36_Nnoesy.list10
   74 LYS  HN     74 LYS  HB2     5.00       #,both  EfR36_Nnoesy.list10
   74 LYS  HN     74 LYS  HB3     5.00       #,both  EfR36_Nnoesy.list10
   74 LYS  HN     74 LYS  HG2     5.00       #,both  EfR36_CNOESY.list10
   74 LYS  HN     74 LYS  HG3     5.00       #,both  EfR36_CNOESY.list10
   74 LYS  HN     74 LYS  QE      6.00       #,m;de  EfR36_CNOESY.list10
   74 LYS  HN     75 LEU  HA      5.00       #,  EfR36_Nnoesy.list10
   74 LYS  HN     75 LEU  QD1     6.00       #,m;bothMe  EfR36_Nnoesy.list10
   74 LYS  HN     75 LEU  QD2     6.00       #,m;bothMe  EfR36_Nnoesy.list10
#   74 LYS  HA     74 LYS  HB2     3.50       #,both  EfR36_CNOESY.list10
#   74 LYS  HA     74 LYS  HB3     3.50       #,both  EfR36_CNOESY.list10
   74 LYS  HA     74 LYS  QG      6.00       #,m;one  EfR36_CNOESY.list10
   74 LYS  HA     74 LYS  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   74 LYS  HA     75 LEU  HN      5.00       #,  EfR36_Nnoesy.list10
#   74 LYS  HB2    74 LYS  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   74 LYS  HB2    74 LYS  HG3     5.00       #both,both  EfR36_CNOESY.list10
#   74 LYS  HB3    74 LYS  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   74 LYS  HB3    74 LYS  HG3     5.00       #both,both  EfR36_CNOESY.list10
   74 LYS  QB     74 LYS  QD      7.00       #m;one,m;dd  EfR36_CNOESY.list10
   74 LYS  QB     74 LYS  QE      7.00       #m;one,m;de  EfR36_CNOESY.list10
   74 LYS  QB     75 LEU  QD2     7.00       #m;one,m;Me  EfR36_CNOESY.list10
#   74 LYS  HG2    74 LYS  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
#   74 LYS  HG3    74 LYS  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   74 LYS  HG2    74 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
   74 LYS  HG3    74 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
#   74 LYS  QD     74 LYS  QE      7.00       #m;dd,m;de  EfR36_CNOESY.list10

#L75
   75 LEU  HN     75 LEU  HA      3.50       #,  EfR36_Nnoesy.list10
   75 LEU  HN     75 LEU  HB2     5.00       #,both  EfR36_CNOESY.list10
   75 LEU  HN     75 LEU  HB3     5.00       #,both  EfR36_CNOESY.list10
   75 LEU  HN     75 LEU  HG      5.00       #,  EfR36_Nnoesy.list10
   75 LEU  HN     75 LEU  QD1     6.00       #,m;bothMe  EfR36_Nnoesy.list10
   75 LEU  HN     75 LEU  QD2     6.00       #,m;bothMe  EfR36_Nnoesy.list10
   75 LEU  HN     76 THR  HN      5.00       #,  EfR36_Nnoesy.list10
   75 LEU  HN     80 LYS  QG      6.00       #,m;dg  EfR36_Nnoesy.list10
   75 LEU  HN     80 LYS  HE2     5.00       #,both  EfR36_Nnoesy.list10
   75 LEU  HN     80 LYS  HE3     5.00       #,both  EfR36_Nnoesy.list10
   75 LEU  HA     75 LEU  HG      5.00       #,  EfR36_CNOESY.list10
   75 LEU  HA     75 LEU  QD1     6.00       #,m;bothMe  EfR36_CNOESY.list10
   75 LEU  HA     75 LEU  QD2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   75 LEU  HA     76 THR  HN      3.50       #,  EfR36_CNOESY.list10
   75 LEU  HA     79 GLN  QB      6.00       #,m;one  EfR36_CNOESY.list10
   75 LEU  HA     80 LYS  QD      6.00       #,m;one  EfR36_CNOESY.list10
   75 LEU  HB2    75 LEU  QD1     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   75 LEU  HB2    75 LEU  QD2     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   75 LEU  HB3    75 LEU  QD1     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   75 LEU  HB3    75 LEU  QD2     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   75 LEU  HB2    76 THR  HN      5.00       #both,  EfR36_Nnoesy.list10
   75 LEU  HB3    76 THR  HN      5.00       #both,  EfR36_Nnoesy.list10
   75 LEU  QB     76 THR  QG2     7.00       #m;one,m;Me  EfR36_CNOESY.list10
   75 LEU  QB     79 GLN  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   75 LEU  QB     79 GLN  HB2     6.00       #m;one,both  EfR36_CNOESY.list10
   75 LEU  QB     79 GLN  HB3     6.00       #m;one,both  EfR36_CNOESY.list10
   75 LEU  QB     79 GLN  QG      7.00       #m;one,m;dg  EfR36_CNOESY.list10
   75 LEU  HB2    80 LYS  HN      5.00       #both,  EfR36_Nnoesy.list10
   75 LEU  HB3    80 LYS  HN      5.00       #both,  EfR36_Nnoesy.list10
   75 LEU  QB     80 LYS  HA      6.00       #m;one,  EfR36_CNOESY.list10
   75 LEU  QB     80 LYS  QG      7.00       #m;one,m;dg  EfR36_CNOESY.list10
   75 LEU  QB     80 LYS  QD      7.00       #m;one,m;one  EfR36_CNOESY.list10
   75 LEU  QB     80 LYS  QE      7.00       #m;one,m;one  EfR36_CNOESY.list10
#   75 LEU  HG     75 LEU  QD1     6.00       #,m;bothMe  EfR36_CNOESY.list10
#   75 LEU  HG     75 LEU  QD2     6.00       #,m;bothMe  EfR36_CNOESY.list10
#   75 LEU  QD1    75 LEU  QD2     7.00       #m;Me,m;Me  EfR36_CNOESY.list10
   75 LEU  QD1    76 THR  HN      6.00       #m;bothMe,  EfR36_Nnoesy.list10
   75 LEU  QD2    76 THR  HN      6.00       #m;bothMe,  EfR36_Nnoesy.list10
   75 LEU  QD2    79 GLN  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   75 LEU  QD2    79 GLN  HA      6.00       #m;Me,  EfR36_CNOESY.list10
   75 LEU  QD1    79 GLN  HB2     6.00       #m;bothMe,both  EfR36_CNOESY.list10
   75 LEU  QD1    79 GLN  HB3     6.00       #m;bothMe,both  EfR36_CNOESY.list10
   75 LEU  QD2    79 GLN  HB2     6.00       #m;bothMe,both  EfR36_CNOESY.list10
   75 LEU  QD2    79 GLN  HB3     6.00       #m;bothMe,both  EfR36_CNOESY.list10
   75 LEU  QD2    79 GLN  QG      7.00       #m;Me,m;dg  EfR36_CNOESY.list10
   75 LEU  QD2    79 GLN  QE2     7.00       #m;Me,m;one  EfR36_CNOESY.list10
   75 LEU  QD1    80 LYS  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   75 LEU  QD1    80 LYS  HA      6.00       #m;Me,  EfR36_CNOESY.list10
   75 LEU  QD1    80 LYS  QG      7.00       #m;Me,m;dg  EfR36_CNOESY.list10
   75 LEU  QD2    80 LYS  QD      7.00       #m;Me,m;one  EfR36_CNOESY.list10
   75 LEU  QD1    83 TYR  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   75 LEU  QD1    83 TYR  HB2     6.00       #m;Me,both  EfR36_CNOESY.list10
   75 LEU  QD1    83 TYR  HB3     6.00       #m;Me,both  EfR36_CNOESY.list10
   75 LEU  QD1    83 TYR  QD      8.00       #m;Me,r;dd  EfR36_CNOESY.list10

#T76
   76 THR  HN     76 THR  HA      5.00       #,  EfR36_CNOESY.list10
   76 THR  HN     76 THR  HB      5.00       #,  EfR36_Nnoesy.list10
   76 THR  HN     76 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   76 THR  HN     78 LYS  HN      3.50       #,  EfR36_Nnoesy.list10
   76 THR  HN     79 GLN  HN      5.00       #,  EfR36_Nnoesy.list10
   76 THR  HN     79 GLN  HA      5.00       #,  EfR36_Nnoesy.list10
   76 THR  HN     79 GLN  HB2     5.00       #,both  EfR36_CNOESY.list10
   76 THR  HN     79 GLN  HB3     5.00       #,both  EfR36_Nnoesy.list10
   76 THR  HN     79 GLN  QG      6.00       #,m;dg  EfR36_Nnoesy.list10
   76 THR  HN     79 GLN  QE2     6.00       #,m;one  EfR36_Nnoesy.list10
   76 THR  HN     80 LYS  HD2     5.00       #,both  EfR36_Nnoesy.list10
   76 THR  HN     80 LYS  HD3     5.00       #,both  EfR36_Nnoesy.list10
#   76 THR  HA     76 THR  HB      3.50       #,  EfR36_CNOESY.list10
   76 THR  HA     76 THR  QG2     5.60       #,i;Me  EfR36_CNOESY.list10
   76 THR  HA     77 ARG  HN      5.00       #,  EfR36_Nnoesy.list10
   76 THR  HA     78 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
#   76 THR  HB     76 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   76 THR  HB     77 ARG  HN      5.00       #,  EfR36_Nnoesy.list10
   76 THR  HB     78 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
   76 THR  QG2    77 ARG  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   76 THR  QG2    77 ARG  HA      6.00       #m;Me,  EfR36_CNOESY.list10
   76 THR  QG2    78 LYS  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   76 THR  QG2    78 LYS  QB      7.00       #m;Me,m;one  EfR36_CNOESY.list10
   76 THR  QG2    78 LYS  QG      7.00       #m;Me,m;one  EfR36_CNOESY.list10
   76 THR  QG2    79 GLN  HN      6.00       #m;Me,  EfR36_Nnoesy.list10
   76 THR  QG2    79 GLN  HB2     6.00       #m;Me,both  EfR36_CNOESY.list10
   76 THR  QG2    79 GLN  HB3     6.00       #m;Me,both  EfR36_CNOESY.list10
   76 THR  QG2    79 GLN  QG      7.00       #m;Me,m;dg  EfR36_CNOESY.list10
   76 THR  QG2    79 GLN  QE2     7.00       #m;Me,m;one  EfR36_CNOESY.list10
   76 THR  QG2    80 LYS  QD      7.00       #m;Me,m;one  EfR36_CNOESY.list10

#R77
   77 ARG  HN     77 ARG  HA      5.00       #,  EfR36_Nnoesy.list10
   77 ARG  HN     77 ARG  HB2     5.00       #,both  EfR36_Nnoesy.list10
   77 ARG  HN     77 ARG  HB3     5.00       #,both  EfR36_Nnoesy.list10
   77 ARG  HN     77 ARG  HG2     5.00       #,both  EfR36_Nnoesy.list10
   77 ARG  HN     77 ARG  HG3     5.00       #,both  EfR36_Nnoesy.list10
   77 ARG  HN     77 ARG  QD      6.00       #,m;dd  EfR36_Nnoesy.list10
   77 ARG  HN     78 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
#   77 ARG  HA     77 ARG  HB2     5.00       #,both  EfR36_CNOESY.list10
#   77 ARG  HA     77 ARG  HB3     5.00       #,both  EfR36_CNOESY.list10
   77 ARG  HA     77 ARG  QG      6.00       #,m;one  EfR36_CNOESY.list10
   77 ARG  HA     77 ARG  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   77 ARG  HA     80 LYS  QB      6.00       #,m;db  EfR36_CNOESY.list10
   77 ARG  HA     80 LYS  HD2     5.00       #,both  EfR36_CNOESY.list10
   77 ARG  HA     80 LYS  HD3     5.00       #,both  EfR36_CNOESY.list10
#   77 ARG  HB2    77 ARG  QG      6.00       #both,m;one  EfR36_CNOESY.list10
#   77 ARG  HB3    77 ARG  QG      6.00       #both,m;one  EfR36_CNOESY.list10
   77 ARG  HB2    77 ARG  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   77 ARG  HB3    77 ARG  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   77 ARG  HB2    78 LYS  HN      5.00       #both,  EfR36_CNOESY.list10
   77 ARG  HB3    78 LYS  HN      5.00       #both,  EfR36_CNOESY.list10
   77 ARG  QB     81 GLU  QB      7.00       #m;one,m;one  EfR36_CNOESY.list10
#   77 ARG  QG     77 ARG  QD      7.00       #m;one,m;dd  EfR36_CNOESY.list10
   77 ARG  QG     78 LYS  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   77 ARG  QG     78 LYS  QB      7.00       #m;one,m;one  EfR36_CNOESY.list10
   77 ARG  QD     78 LYS  HN      6.00       #m;dd,  EfR36_Nnoesy.list10

#K78
   78 LYS  HN     78 LYS  HA      3.50       #,  EfR36_Nnoesy.list10
   78 LYS  HN     78 LYS  HB2     3.50       #,both  EfR36_CNOESY.list10
   78 LYS  HN     78 LYS  HB3     3.50       #,both  EfR36_CNOESY.list10
   78 LYS  HN     78 LYS  QG      6.00       #,m;one  EfR36_Nnoesy.list10
   78 LYS  HN     79 GLN  HN      3.50       #,  EfR36_Nnoesy.list10
   78 LYS  HN     79 GLN  QB      6.00       #,m;one  EfR36_Nnoesy.list10
   78 LYS  HN     80 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
#   78 LYS  HA     78 LYS  HB2     5.00       #,both  EfR36_CNOESY.list10
#   78 LYS  HA     78 LYS  HB3     5.00       #,both  EfR36_CNOESY.list10
   78 LYS  HA     78 LYS  QG      6.00       #,m;one  EfR36_CNOESY.list10
   78 LYS  HA     78 LYS  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   78 LYS  HA     79 GLN  HN      5.00       #,  EfR36_Nnoesy.list10
   78 LYS  HA     81 GLU  HN      3.50       #,  EfR36_Nnoesy.list10
   78 LYS  HA     81 GLU  HB2     5.00       #,both  EfR36_CNOESY.list10
   78 LYS  HA     81 GLU  HB3     5.00       #,both  EfR36_CNOESY.list10
   78 LYS  HA     81 GLU  QG      6.00       #,m;one  EfR36_CNOESY.list10
   78 LYS  HA     82 GLN  HN      5.00       #,  EfR36_Nnoesy.list10
#   78 LYS  HB2    78 LYS  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   78 LYS  HB2    78 LYS  HG3     5.00       #both,both  EfR36_CNOESY.list10
#   78 LYS  HB3    78 LYS  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   78 LYS  HB3    78 LYS  HG3     5.00       #both,both  EfR36_CNOESY.list10
   78 LYS  HB2    78 LYS  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   78 LYS  HB3    78 LYS  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   78 LYS  QB     78 LYS  QE      7.00       #m;one,m;de  EfR36_CNOESY.list10
   78 LYS  HB2    79 GLN  HN      3.50       #both,  EfR36_Nnoesy.list10
   78 LYS  HB3    79 GLN  HN      5.00       #both,  EfR36_CNOESY.list10
#   78 LYS  HG2    78 LYS  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
#   78 LYS  HG3    78 LYS  QD      6.00       #both,m;dd  EfR36_CNOESY.list10
   78 LYS  HG2    78 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
   78 LYS  HG3    78 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
   78 LYS  HG2    79 GLN  HN      5.00       #both,  EfR36_Nnoesy.list10
   78 LYS  HG3    79 GLN  HN      5.00       #both,  EfR36_Nnoesy.list10
#   78 LYS  QD     78 LYS  QE      7.00       #m;dd,m;de  EfR36_CNOESY.list10

#Q79
   79 GLN  HN     79 GLN  HA      5.00       #,  EfR36_Nnoesy.list10
   79 GLN  HN     79 GLN  HB2     5.00       #,both  EfR36_Nnoesy.list10
   79 GLN  HN     79 GLN  HB3     5.00       #,both  EfR36_Nnoesy.list10
   79 GLN  HN     79 GLN  QG      6.00       #,m;dg  EfR36_CNOESY.list10
   79 GLN  HN     80 LYS  HN      3.50       #,  EfR36_Nnoesy.list10
   79 GLN  HN     82 GLN  HN      5.00       #,  EfR36_Nnoesy.list10
   79 GLN  HN     82 GLN  QB      6.00       #,m;one  EfR36_Nnoesy.list10
#   79 GLN  HA     79 GLN  HB2     5.00       #,both  EfR36_CNOESY.list10
#   79 GLN  HA     79 GLN  HB3     5.00       #,both  EfR36_CNOESY.list10
   79 GLN  HA     79 GLN  QG      6.00       #,m;dg  EfR36_CNOESY.list10
   79 GLN  HA     80 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
   79 GLN  HA     82 GLN  HN      5.00       #,  EfR36_Nnoesy.list10
   79 GLN  HA     82 GLN  QB      4.50       #,m;one  EfR36_CNOESY.list10
#   79 GLN  QB     79 GLN  QG      7.00       #m;one,m;dg  EfR36_CNOESY.list10
   79 GLN  HB2    80 LYS  HN      5.00       #both,  EfR36_Nnoesy.list10
   79 GLN  HB3    80 LYS  HN      5.00       #both,  EfR36_Nnoesy.list10
   79 GLN  QG     79 GLN  HE21    6.00       #m;dg,both  EfR36_Nnoesy.list10
   79 GLN  QG     79 GLN  HE22    6.00       #m;dg,both  EfR36_Nnoesy.list10

#K80
   80 LYS  HN     80 LYS  HA      5.00       #,  EfR36_Nnoesy.list10
   80 LYS  HN     80 LYS  QB      6.00       #,m;db  EfR36_Nnoesy.list10
   80 LYS  HN     80 LYS  QG      6.00       #,m;dg  EfR36_Nnoesy.list10
   80 LYS  HN     80 LYS  QD      6.00       #,m;one  EfR36_Nnoesy.list10
   80 LYS  HN     81 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
   80 LYS  HN     82 GLN  HN      5.00       #,  EfR36_Nnoesy.list10
#   80 LYS  HA     80 LYS  QB      6.00       #,m;db  EfR36_CNOESY.list10
   80 LYS  HA     80 LYS  QG      6.00       #,m;dg  EfR36_CNOESY.list10
   80 LYS  HA     80 LYS  QD      6.00       #,m;one  EfR36_CNOESY.list10
   80 LYS  HA     81 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
   80 LYS  HA     82 GLN  HN      5.00       #,  EfR36_Nnoesy.list10
   80 LYS  HA     83 TYR  HN      5.00       #,  EfR36_Nnoesy.list10
   80 LYS  HA     83 TYR  HB2     5.00       #,both  EfR36_CNOESY.list10
   80 LYS  HA     83 TYR  HB3     5.00       #,both  EfR36_CNOESY.list10
   80 LYS  HA     83 TYR  QD      7.00       #,r;dd  EfR36_CNOESY.list10
   80 LYS  QB     80 LYS  QD      7.00       #m;db,m;one  EfR36_CNOESY.list10
   80 LYS  QB     81 GLU  HN      6.00       #m;db,  EfR36_Nnoesy.list10
#   80 LYS  QG     80 LYS  QD      7.00       #m;dg,m;one  EfR36_CNOESY.list10
   80 LYS  QG     80 LYS  HE2     6.00       #m;dg,both  EfR36_CNOESY.list10
   80 LYS  QG     80 LYS  HE3     6.00       #m;dg,both  EfR36_CNOESY.list10
#   80 LYS  HD2    80 LYS  HE2     5.00       #both,both  EfR36_CNOESY.list10
#   80 LYS  HD2    80 LYS  HE3     5.00       #both,both  EfR36_CNOESY.list10
#   80 LYS  HD3    80 LYS  HE2     5.00       #both,both  EfR36_CNOESY.list10
#   80 LYS  HD3    80 LYS  HE3     5.00       #both,both  EfR36_CNOESY.list10
   80 LYS  QD     81 GLU  HN      6.00       #m;one,  EfR36_Nnoesy.list10

#E81
   81 GLU  HN     81 GLU  HA      5.00       #,  EfR36_CNOESY.list10
   81 GLU  HN     81 GLU  HB2     5.00       #,both  EfR36_CNOESY.list10
   81 GLU  HN     81 GLU  HB3     5.00       #,both  EfR36_CNOESY.list10
   81 GLU  HN     81 GLU  HG2     5.00       #,both  EfR36_CNOESY.list10
   81 GLU  HN     81 GLU  HG3     5.00       #,both  EfR36_Nnoesy.list10
   81 GLU  HN     82 GLN  HN      3.50       #,  EfR36_Nnoesy.list10
   81 GLU  HN     83 TYR  HN      5.00       #,  EfR36_Nnoesy.list10
#   81 GLU  HA     81 GLU  HB2     5.00       #,both  EfR36_CNOESY.list10
#   81 GLU  HA     81 GLU  HB3     5.00       #,both  EfR36_CNOESY.list10
   81 GLU  HA     81 GLU  HG2     5.00       #,both  EfR36_CNOESY.list10
   81 GLU  HA     81 GLU  HG3     5.00       #,both  EfR36_CNOESY.list10
   81 GLU  HA     82 GLN  HN      5.00       #,  EfR36_Nnoesy.list10
   81 GLU  HA     84 LEU  HN      5.00       #,  EfR36_Nnoesy.list10
   81 GLU  HA     84 LEU  QB      6.00       #,m;one  EfR36_CNOESY.list10
   81 GLU  HA     84 LEU  QD1     6.00       #,m;Me  EfR36_CNOESY.list10
   81 GLU  HA     85 LYS  HN      5.00       #,  EfR36_CNOESY.list10
#   81 GLU  HB2    81 GLU  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   81 GLU  HB2    81 GLU  HG3     5.00       #both,both  EfR36_CNOESY.list10
#   81 GLU  HB3    81 GLU  HG2     5.00       #both,both  EfR36_CNOESY.list10
#   81 GLU  HB3    81 GLU  HG3     5.00       #both,both  EfR36_CNOESY.list10
   81 GLU  QB     82 GLN  HN      6.00       #m;one,  EfR36_CNOESY.list10
   81 GLU  QB     82 GLN  HN      4.50       #m;one,  EfR36_Nnoesy.list10
   81 GLU  QG     82 GLN  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   81 GLU  QG     82 GLN  HA      6.00       #m;one,  EfR36_CNOESY.list10
   81 GLU  QG     82 GLN  HE21    6.00       #m;one,both  EfR36_Nnoesy.list10
   81 GLU  QG     82 GLN  HE22    6.00       #m;one,both  EfR36_Nnoesy.list10

#Q82
   82 GLN  HN     82 GLN  HA      5.00       #,  EfR36_Nnoesy.list10
   82 GLN  HN     82 GLN  HB2     3.50       #,both  EfR36_CNOESY.list10
   82 GLN  HN     82 GLN  HB3     3.50       #,both  EfR36_CNOESY.list10
   82 GLN  HN     82 GLN  QG      6.00       #,m;dg  EfR36_Nnoesy.list10
   82 GLN  HN     83 TYR  HN      3.50       #,  EfR36_Nnoesy.list10
   82 GLN  HN     83 TYR  HB2     5.00       #,both  EfR36_Nnoesy.list10
   82 GLN  HN     83 TYR  HB3     5.00       #,both  EfR36_Nnoesy.list10
   82 GLN  HN     85 LYS  QB      6.00       #,m;db  EfR36_Nnoesy.list10
#   82 GLN  HA     82 GLN  HB2     5.00       #,both  EfR36_CNOESY.list10
#   82 GLN  HA     82 GLN  HB3     5.00       #,both  EfR36_CNOESY.list10
   82 GLN  HA     82 GLN  QG      6.00       #,m;dg  EfR36_CNOESY.list10
   82 GLN  HA     83 TYR  HN      5.00       #,  EfR36_CNOESY.list10
   82 GLN  HA     83 TYR  HA      5.00       #,  EfR36_CNOESY.list10
   82 GLN  HA     85 LYS  HN      5.00       #,  EfR36_CNOESY.list10
   82 GLN  HA     85 LYS  QB      6.00       #,m;db  EfR36_CNOESY.list10
   82 GLN  HA     86 THR  HN      5.00       #,  EfR36_CNOESY.list10
#   82 GLN  HB2    82 GLN  QG      6.00       #both,m;dg  EfR36_CNOESY.list10
#   82 GLN  HB3    82 GLN  QG      6.00       #both,m;dg  EfR36_CNOESY.list10
   82 GLN  QB     82 GLN  HE21    6.00       #m;one,both  EfR36_Nnoesy.list10
   82 GLN  QB     82 GLN  HE22    6.00       #m;one,both  EfR36_Nnoesy.list10
   82 GLN  HB2    83 TYR  HN      5.00       #both,  EfR36_CNOESY.list10
   82 GLN  HB3    83 TYR  HN      5.00       #both,  EfR36_CNOESY.list10
   82 GLN  QG     82 GLN  HE21    6.00       #m;dg,both  EfR36_Nnoesy.list10
   82 GLN  QG     82 GLN  HE22    6.00       #m;dg,both  EfR36_Nnoesy.list10
   82 GLN  QG     83 TYR  HN      6.00       #m;dg,  EfR36_Nnoesy.list10

#Y83
   83 TYR  HN     83 TYR  HA      3.50       #,  EfR36_Nnoesy.list10
   83 TYR  HN     83 TYR  HB2     5.00       #,both  EfR36_CNOESY.list10
   83 TYR  HN     83 TYR  HB3     5.00       #,both  EfR36_CNOESY.list10
   83 TYR  HN     83 TYR  QD      7.00       #,r;dd  EfR36_Nnoesy.list10
   83 TYR  HN     84 LEU  HN      3.50       #,  EfR36_Nnoesy.list10
   83 TYR  HN     84 LEU  QB      6.00       #,m;one  EfR36_Nnoesy.list10
   83 TYR  HN     85 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
#   83 TYR  HA     83 TYR  HB2     5.00       #,both  EfR36_CNOESY.list10
#   83 TYR  HA     83 TYR  HB3     5.00       #,both  EfR36_CNOESY.list10
   83 TYR  HA     83 TYR  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   83 TYR  HA     83 TYR  QE      6.00       #,m;de  EfR36_CNOESY.list10
   83 TYR  HA     84 LEU  HN      5.00       #,  EfR36_Nnoesy.list10
   83 TYR  HA     86 THR  HN      5.00       #,  EfR36_CNOESY.list10
   83 TYR  HA     86 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   83 TYR  HB2    83 TYR  QD      7.00       #both,r;dd  EfR36_CNOESY.list10
   83 TYR  HB3    83 TYR  QD      7.00       #both,r;dd  EfR36_CNOESY.list10
   83 TYR  QB     83 TYR  QE      8.00       #m;one,r;de  EfR36_CNOESY.list10
   83 TYR  HB2    84 LEU  HN      5.00       #both,  EfR36_CNOESY.list10
   83 TYR  HB3    84 LEU  HN      5.00       #both,  EfR36_CNOESY.list10
   83 TYR  QB     84 LEU  QD1     7.00       #m;one,m;Me  EfR36_CNOESY.list10
   83 TYR  QD     84 LEU  HN      7.00       #r;dd,  EfR36_Nnoesy.list10
   83 TYR  QD     84 LEU  QD1     8.00       #r;dd,m;bothMe  EfR36_CNOESY.list10
   83 TYR  QD     84 LEU  QD2     8.00       #r;dd,m;bothMe  EfR36_CNOESY.list10
   83 TYR  QE     84 LEU  QD1     6.00       #both,m;Me  EfR36_CNOESY.list10
   83 TYR  QE     84 LEU  QD2     6.00       #both,m;Me  EfR36_CNOESY.list10
   83 TYR  QE     87 PHE  HB2     7.00       #r;de,both  EfR36_CNOESY.list10
   83 TYR  QE     87 PHE  HB3     7.00       #r;de,both  EfR36_CNOESY.list10

#L84
   84 LEU  HN     84 LEU  HA      5.00       #,  EfR36_Nnoesy.list10
   84 LEU  HN     84 LEU  HB2     5.00       #,both  EfR36_Nnoesy.list10
   84 LEU  HN     84 LEU  HB3     5.00       #,both  EfR36_Nnoesy.list10
   84 LEU  HN     84 LEU  QD1     6.00       #,m;Me  EfR36_Nnoesy.list10
   84 LEU  HN     84 LEU  QD2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   84 LEU  HN     85 LYS  HN      3.50       #,  EfR36_Nnoesy.list10
#   84 LEU  HA     84 LEU  HB2     5.00       #,both  EfR36_CNOESY.list10
#   84 LEU  HA     84 LEU  HB3     5.00       #,both  EfR36_CNOESY.list10
   84 LEU  HA     84 LEU  QD2     6.00       #,m;Me  EfR36_CNOESY.list10
   84 LEU  HA     85 LYS  HN      5.00       #,  EfR36_Nnoesy.list10
   84 LEU  HA     87 PHE  HN      5.00       #,  EfR36_Nnoesy.list10
   84 LEU  HA     88 HIS  HN      5.00       #,  EfR36_Nnoesy.list10
   84 LEU  HB2    84 LEU  QD1     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   84 LEU  HB2    84 LEU  QD2     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   84 LEU  HB3    84 LEU  QD1     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   84 LEU  HB3    84 LEU  QD2     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   84 LEU  HB2    85 LYS  HN      5.00       #both,  EfR36_CNOESY.list10
   84 LEU  HB3    85 LYS  HN      5.00       #both,  EfR36_CNOESY.list10
   84 LEU  QB     87 PHE  HN      6.00       #m;one,  EfR36_Nnoesy.list10
   84 LEU  QD1    85 LYS  HN      6.00       #m;Me,  EfR36_Nnoesy.list10

#K85
   85 LYS  HN     85 LYS  HA      3.50       #,  EfR36_Nnoesy.list10
   85 LYS  HN     85 LYS  QB      4.50       #,m;db  EfR36_Nnoesy.list10
   85 LYS  HN     85 LYS  HG2     5.00       #,both  EfR36_CNOESY.list10
   85 LYS  HN     85 LYS  HG3     5.00       #,both  EfR36_CNOESY.list10
   85 LYS  HN     85 LYS  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   85 LYS  HN     86 THR  HN      2.90       #,  EfR36_Nnoesy.list10
   85 LYS  HN     86 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
#   85 LYS  HA     85 LYS  QB      4.50       #,m;db  EfR36_CNOESY.list10
   85 LYS  HA     85 LYS  HG2     5.00       #,both  EfR36_CNOESY.list10
   85 LYS  HA     85 LYS  HG3     5.00       #,both  EfR36_CNOESY.list10
   85 LYS  HA     85 LYS  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   85 LYS  HA     87 PHE  HN      5.00       #,  EfR36_Nnoesy.list10
   85 LYS  HA     88 HIS  HN      5.00       #,  EfR36_Nnoesy.list10
   85 LYS  HA     89 LEU  QD2     6.00       #,m;Me  EfR36_CNOESY.list10
#   85 LYS  QB     85 LYS  HG2     6.00       #m;db,both  EfR36_CNOESY.list10
#   85 LYS  QB     85 LYS  HG3     6.00       #m;db,both  EfR36_CNOESY.list10
   85 LYS  QB     85 LYS  QD      7.00       #m;db,m;dd  EfR36_CNOESY.list10
   85 LYS  QB     85 LYS  QE      7.00       #m;db,m;de  EfR36_CNOESY.list10
   85 LYS  QB     86 THR  HN      6.00       #m;db,  EfR36_Nnoesy.list10
   85 LYS  QB     87 PHE  HN      6.00       #m;db,  EfR36_Nnoesy.list10
#   85 LYS  QG     85 LYS  QD      7.00       #m;one,m;dd  EfR36_CNOESY.list10
   85 LYS  HG2    85 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
   85 LYS  HG3    85 LYS  QE      6.00       #both,m;de  EfR36_CNOESY.list10
   85 LYS  QG     86 THR  HN      6.00       #m;one,  EfR36_CNOESY.list10
   85 LYS  QG     89 LEU  QD1     7.00       #m;one,m;bothMe  EfR36_CNOESY.list10
   85 LYS  QG     89 LEU  QD2     7.00       #m;one,m;bothMe  EfR36_CNOESY.list10
#   85 LYS  QD     85 LYS  QE      7.00       #m;dd,m;de  EfR36_CNOESY.list10
   85 LYS  QD     86 THR  HN      6.00       #m;dd,  EfR36_Nnoesy.list10
   85 LYS  QE     89 LEU  QD1     7.00       #m;de,m;bothMe  EfR36_CNOESY.list10
   85 LYS  QE     89 LEU  QD2     7.00       #m;de,m;bothMe  EfR36_CNOESY.list10

#T86
   86 THR  HN     86 THR  HB      5.00       #,  EfR36_CNOESY.list10
   86 THR  HN     86 THR  HA      3.50       #,  EfR36_CNOESY.list10
   86 THR  HN     86 THR  QG2     6.00       #,m;Me  EfR36_Nnoesy.list10
   86 THR  HN     87 PHE  HN      3.50       #,  EfR36_Nnoesy.list10
#   86 THR  HB     86 THR  QG2     6.00       #,m;Me  EfR36_CNOESY.list10
   86 THR  HB     87 PHE  HN      5.00       #,  EfR36_CNOESY.list10
   86 THR  HA     86 THR  QG2     5.60       #,i;Me  EfR36_CNOESY.list10
   86 THR  HA     87 PHE  HN      5.00       #,  EfR36_CNOESY.list10
   86 THR  HA     89 LEU  QD1     6.00       #,m;bothMe  EfR36_CNOESY.list10
   86 THR  HA     89 LEU  QD2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   86 THR  QG2    87 PHE  HN      6.00       #m;Me,  EfR36_Nnoesy.list10

#F87
   87 PHE  HN     87 PHE  HA      5.00       #,  EfR36_CNOESY.list10
   87 PHE  HN     87 PHE  HB2     5.00       #,both  EfR36_CNOESY.list10
   87 PHE  HN     87 PHE  HB3     5.00       #,both  EfR36_CNOESY.list10
   87 PHE  HN     87 PHE  QD      7.00       #,r;dd  EfR36_Nnoesy.list10
   87 PHE  HN     88 HIS  HN      5.00       #,  EfR36_Nnoesy.list10
   87 PHE  HN     88 HIS  HA      5.00       #,  EfR36_Nnoesy.list10
   87 PHE  HN     88 HIS  QB      6.00       #,m;one  EfR36_Nnoesy.list10
   87 PHE  HN     89 LEU  QB      6.00       #,m;one  EfR36_Nnoesy.list10
#   87 PHE  HA     87 PHE  HB2     5.00       #,both  EfR36_CNOESY.list10
#   87 PHE  HA     87 PHE  HB3     5.00       #,both  EfR36_CNOESY.list10
   87 PHE  HA     87 PHE  QD      6.00       #,m;dd  EfR36_CNOESY.list10
   87 PHE  HA     88 HIS  HN      5.00       #,  EfR36_Nnoesy.list10
   87 PHE  HA     90 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
   87 PHE  HB2    87 PHE  QD      7.00       #both,r;dd  EfR36_CNOESY.list10
   87 PHE  HB3    87 PHE  QD      7.00       #both,r;dd  EfR36_CNOESY.list10
   87 PHE  HB2    88 HIS  HN      5.00       #both,  EfR36_Nnoesy.list10
   87 PHE  HB3    88 HIS  HN      5.00       #both,  EfR36_Nnoesy.list10
   87 PHE  QD     88 HIS  HN      7.00       #r;dd,  EfR36_Nnoesy.list10

#H88
   88 HIS  HN     88 HIS  HA      5.00       #,  EfR36_Nnoesy.list10
   88 HIS  HN     88 HIS  HB2     5.00       #,both  EfR36_Nnoesy.list10
   88 HIS  HN     88 HIS  HB3     5.00       #,both  EfR36_Nnoesy.list10
   88 HIS  HN     89 LEU  HN      3.50       #,  EfR36_Nnoesy.list10
#   88 HIS  HA     88 HIS  HB2     5.00       #,both  EfR36_CNOESY.list10
#   88 HIS  HA     88 HIS  HB3     5.00       #,both  EfR36_CNOESY.list10
   88 HIS  HA     89 LEU  HN      5.00       #,  EfR36_CNOESY.list10
   88 HIS  HA     90 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
   88 HIS  HB2    89 LEU  HN      5.00       #both,  EfR36_CNOESY.list10
   88 HIS  HB3    89 LEU  HN      5.00       #both,  EfR36_CNOESY.list10
   88 HIS  QB     90 GLU  HN      6.00       #m;one,  EfR36_Nnoesy.list10

#L89
   89 LEU  HN     89 LEU  HA      3.50       #,  EfR36_CNOESY.list10
   89 LEU  HN     89 LEU  HB2     5.00       #,both  EfR36_CNOESY.list10
   89 LEU  HN     89 LEU  HB3     5.00       #,both  EfR36_CNOESY.list10
   89 LEU  HN     89 LEU  QD1     6.00       #,m;bothMe  EfR36_CNOESY.list10
   89 LEU  HN     89 LEU  QD2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   89 LEU  HN     90 GLU  HN      3.50       #,  EfR36_Nnoesy.list10
#   89 LEU  HA     89 LEU  HB2     5.00       #,both  EfR36_CNOESY.list10
#   89 LEU  HA     89 LEU  HB3     5.00       #,both  EfR36_CNOESY.list10
   89 LEU  HA     89 LEU  QD1     6.00       #,m;bothMe  EfR36_CNOESY.list10
   89 LEU  HA     89 LEU  QD2     6.00       #,m;bothMe  EfR36_CNOESY.list10
   89 LEU  HA     90 GLU  HN      5.00       #,  EfR36_Nnoesy.list10
   89 LEU  HB2    89 LEU  QD1     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   89 LEU  HB2    89 LEU  QD2     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   89 LEU  HB3    89 LEU  QD1     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   89 LEU  HB3    89 LEU  QD2     6.00       #both,m;bothMe  EfR36_CNOESY.list10
   89 LEU  HB2    90 GLU  HN      3.50       #both,  EfR36_Nnoesy.list10
   89 LEU  HB3    90 GLU  HN      3.50       #both,  EfR36_Nnoesy.list10
   89 LEU  QB     90 GLU  QB      7.00       #m;one,m;one  EfR36_CNOESY.list10
#   89 LEU  QD1    89 LEU  QD2     7.00       #m;Me,m;Me  EfR36_CNOESY.list10
   89 LEU  QD1    90 GLU  HN      6.00       #m;bothMe,  EfR36_Nnoesy.list10
   89 LEU  QD2    90 GLU  HN      6.00       #m;Me,  EfR36_CNOESY.list10

#E90
   90 GLU  HN     90 GLU  HA      5.00       #,  EfR36_CNOESY.list10
   90 GLU  HN     90 GLU  QB      4.50       #,m;one  EfR36_CNOESY.list10
#   90 GLU  HA     90 GLU  HB2     3.50       #,both  EfR36_CNOESY.list10
#   90 GLU  HA     90 GLU  HB3     3.50       #,both  EfR36_CNOESY.list10

#Y23
   23 TYR  QD     24 THR  HN      7.00       #r;dd,  EfR36_Nnoesy.list10
   23 TYR  QD     65 ALA  QB      8.00       #r;dd,m;Me  EfR36_CNOESY.list10
#   23 TYR  QD     23 TYR  QE      9.00       #r;dd,r;de  EfR36_CNOESY.list10

#Y8
    8 TYR  QE     58 LYS  HD2     7.00       #r;de,both  EfR36_CNOESY.list10
    8 TYR  QE     58 LYS  HD3     7.00       #r;de,both  EfR36_CNOESY.list10
    8 TYR  QD     25 THR  HA      7.00       #r;dd,  EfR36_CNOESY.list10

#Y10
   10 TYR  QE     12 LEU  QQD     9.40       #r;de,q;dMe  EfR36_CNOESY.list10
   10 TYR  QD     12 LEU  QD1     8.00       #r;dd,m;bothMe  EfR36_CNOESY.list10
   10 TYR  QD     12 LEU  QD2     8.00       #r;dd,m;bothMe  EfR36_CNOESY.list10
   10 TYR  QD     24 THR  QG2     8.00       #r;dd,m;Me  EfR36_CNOESY.list10
   10 TYR  QD     53 MET  QE      8.00       #r;dd,m;Me  EfR36_CNOESY.list10
#   10 TYR  QD     10 TYR  QE      9.00       #r;dd,r;de  EfR36_CNOESY.list10

#F9
    9 PHE  QD     10 TYR  HN      7.00       #r;dd,  EfR36_Nnoesy.list10
    9 PHE  QD     57 GLU  HN      7.00       #r;dd,  EfR36_Nnoesy.list10
    9 PHE  QD     68 ALA  QB      8.00       #r;dd,m;Me  EfR36_CNOESY.list10
    9 PHE  QE     11 VAL  QG2     8.00       #r;de,m;Me  EfR36_CNOESY.list10
    9 PHE  HZ     11 VAL  QG2     6.00       #,m;Me  EfR36_CNOESY.list10

#F72
   72 PHE  QD     75 LEU  QD1     8.00       #r;dd,m;Me  EfR36_CNOESY.list10
   72 PHE  QE     80 LYS  HE2     7.00       #r;de,both  EfR36_CNOESY.list10
   72 PHE  QE     80 LYS  HE3     7.00       #r;de,both  EfR36_CNOESY.list10

#F19
   19 PHE  QE     54 ILE  QD1     8.00       #r;de,m;Me  EfR36_CNOESY.list10
   19 PHE  QE     81 GLU  HA      7.00       #r;de,  EfR36_CNOESY.list10
   19 PHE  HZ     54 ILE  QD1     6.00       #,m;Me  EfR36_CNOESY.list10

#F59
   59 PHE  QD     64 GLU  QB      8.00       #r;dd,m;one  EfR36_CNOESY.list10
   59 PHE  QD     65 ALA  HA      7.00       #r;dd,  EfR36_CNOESY.list10
   59 PHE  QD     65 ALA  QB      8.00       #r;dd,m;Me  EfR36_CNOESY.list10
   59 PHE  QD     68 ALA  QB      8.00       #r;dd,m;Me  EfR36_CNOESY.list10
   59 PHE  QE     68 ALA  QB      8.00       #r;de,m;Me  EfR36_CNOESY.list10


#  -- Angle constraint file built by HYPER -- DIANA | DYANA format 
#  -- from data in file  EfR36.hyp
#  -- Version: 3.2 2002/04/18[Linux] (Compiled on: troberto.quifis.uv.es) 
   7 HIS   PHI    -180.0   -70.0
   7 HIS   PSI      60.0   180.0
   8 TYR   PHI    -180.0   -70.0
   8 TYR   PSI      60.0   180.0
   9 PHE   PHI    -180.0   -70.0
   9 PHE   PSI      60.0   180.0
  10 TYR   PHI    -180.0   -70.0
  10 TYR   PSI      60.0   180.0
  11 VAL   PHI    -180.0   -70.0
  11 VAL   PSI      60.0   180.0
  12 LEU   PHI    -180.0   -70.0
  12 LEU   PSI      60.0   180.0
  13 LEU   PHI    -180.0   -70.0
  13 LEU   PSI      60.0   180.0
  18 SER   PHI    -180.0   -70.0
  18 SER   PSI      60.0   180.0
  19 PHE   PHI    -180.0   -70.0
  19 PHE   PSI      60.0   180.0
  20 TYR   PHI    -180.0   -70.0
  20 TYR   PSI      60.0   180.0
  21 GLY   PHI    -180.0   -70.0
  21 GLY   PSI      60.0   180.0
  22 GLY   PHI    -180.0   -70.0
  22 GLY   PSI      60.0   180.0
  23 TYR   PHI    -180.0   -70.0
  23 TYR   PSI      60.0   180.0
  24 THR   PHI    -180.0   -70.0
  24 THR   PSI      60.0   180.0
  25 THR   PHI    -180.0   -70.0
  25 THR   PSI      60.0   180.0
  28 GLU   PHI    -100.0   -30.0
  28 GLU   PSI     -75.0     5.0
  29 ARG   PHI    -100.0   -30.0
  29 ARG   PSI     -75.0     5.0
  30 ARG   PHI    -100.0   -30.0
  30 ARG   PSI     -75.0     5.0
  31 LEU   PHI    -100.0   -30.0
  31 LEU   PSI     -75.0     5.0
  32 THR   PHI    -100.0   -30.0
  32 THR   PSI     -75.0     5.0
  33 GLU   PHI    -100.0   -30.0
  33 GLU   PSI     -75.0     5.0
  51 VAL   PHI    -180.0   -70.0
  51 VAL   PSI      60.0   180.0
  52 ILE   PHI    -180.0   -70.0
  52 ILE   PSI      60.0   180.0
  53 MET   PHI    -180.0   -70.0
  53 MET   PSI      60.0   180.0
  56 THR   PHI    -180.0   -70.0
  56 THR   PSI      60.0   180.0
  57 GLU   PHI    -180.0   -70.0
  57 GLU   PSI      60.0   180.0
  58 LYS   PHI    -180.0   -70.0
  58 LYS   PSI      60.0   180.0
  59 PHE   PHI    -180.0   -70.0
  59 PHE   PSI      60.0   180.0
  63 SER   PHI    -100.0   -30.0
  63 SER   PSI     -75.0     5.0
  64 GLU   PHI    -100.0   -30.0
  64 GLU   PSI     -75.0     5.0
  65 ALA   PHI    -100.0   -30.0
  65 ALA   PSI     -75.0     5.0
  66 THR   PHI    -100.0   -30.0
  66 THR   PSI     -75.0     5.0
  67 LYS   PHI    -100.0   -30.0
  67 LYS   PSI     -75.0     5.0
  68 ALA   PHI    -100.0   -30.0
  68 ALA   PSI     -75.0     5.0
  69 GLU   PHI    -100.0   -30.0
  69 GLU   PSI     -75.0     5.0
  70 ALA   PHI    -100.0   -30.0
  70 ALA   PSI     -75.0     5.0
  71 ALA   PHI    -100.0   -30.0
  71 ALA   PSI     -75.0     5.0
  72 PHE   PHI    -100.0   -30.0
  72 PHE   PSI     -75.0     5.0
  73 LYS   PHI    -100.0   -30.0
  73 LYS   PSI     -75.0     5.0
  78 LYS   PHI    -100.0   -30.0
  78 LYS   PSI     -75.0     5.0
  79 GLN   PHI    -100.0   -30.0
  79 GLN   PSI     -75.0     5.0
  80 LYS   PHI    -100.0   -30.0
  80 LYS   PSI     -75.0     5.0
  81 GLU   PHI    -100.0   -30.0
  81 GLU   PSI     -75.0     5.0
  82 GLN   PHI    -100.0   -30.0
  82 GLN   PSI     -75.0     5.0
  83 TYR   PHI    -100.0   -30.0
  83 TYR   PSI     -75.0     5.0
  84 LEU   PHI    -100.0   -30.0
  84 LEU   PSI     -75.0     5.0
  85 LYS   PHI    -100.0   -30.0
  85 LYS   PSI     -75.0     5.0
  86 THR   PHI    -100.0   -30.0
  86 THR   PSI     -75.0     5.0
  87 PHE   PHI    -100.0   -30.0
  87 PHE   PSI     -75.0     5.0
  88 HIS   PHI    -100.0   -30.0
  88 HIS   PSI     -75.0     5.0
#Manual Input
#Talos contraints =10 only
7 HIS PHI -162.87  -82.87
7 HIS PSI 98.67  198.67
8 TYR PHI -142.75  -62.75
8 TYR PSI 78.03  178.03
9 PHE PHI -162.55  -82.55
9 PHE PSI 91.57  191.57
10 TYR PHI -169.96  -89.96
10 TYR PSI 100.66  200.66
11 VAL PHI -163.93  -83.93
11 VAL PSI 91.19  191.19
12 LEU PHI -157.26  -77.26
12 LEU PSI 91.95  191.95
13 LEU PHI -163.13  -83.13
13 LEU PSI 75.2  175.2
15 GLN PHI -104.14  -24.14
15 GLN PSI -81.88  18.12
16 ASP PHI -128.55  -48.55
16 ASP PSI -47.71  52.29
18 SER PHI -119.86  -39.86
18 SER PSI 100.2  200.2
19 PHE PHI -164.42  -84.42
19 PHE PSI 99.65  199.65
20 TYR PHI -168.5  -88.5
20 TYR PSI 85.55  185.55
23 TYR PHI -169.97  -89.97
23 TYR PSI 94.72  194.72
24 THR PHI -167.29  -87.29
24 THR PSI 96.29  196.29
25 THR PHI -150.96  -70.96
25 THR PSI 87.9  187.9
28 GLU PHI -102.51  -22.51
28 GLU PSI -93.34  6.66
29 ARG PHI -101.86  -21.86
29 ARG PSI -92.72  7.28
30 ARG PHI -104.02  -24.02
30 ARG PSI -93.42  6.58
31 LEU PHI -102.51  -22.51
31 LEU PSI -89.68  10.32
32 THR PHI -106.15  -26.15
32 THR PSI -89.49  10.51
33 GLU PHI -104.55  -24.55
33 GLU PSI -91.88  8.12
34 HIS PHI -105.26  -25.26
34 HIS PSI -94.42  5.58
35 ASN PHI -104.94  -24.94
35 ASN PSI -81.81  18.19
36 SER PHI -125.11  -45.11
36 SER PSI -57.37  42.63
44 ARG PHI -100.87  -20.87
44 ARG PSI -79.83  20.17
45 LEU PHI -116.31  -36.31
45 LEU PSI -67.48  32.52
47 LYS PHI -111.99  -31.99
47 LYS PSI -76.45  23.55
52 ILE PHI -176.49  -96.49
52 ILE PSI 100.99  200.99
55 HIS PHI -188  -108
55 HIS PSI 96.3  196.3
56 THR PHI -160.59  -80.59
56 THR PSI 99.07  199.07
57 GLU PHI -183.13  -103.13
57 GLU PSI 98.36  198.36
58 LYS PHI -139.79  -59.79
58 LYS PSI 83.12  183.12
61 THR PHI -166.55  -86.55
61 THR PSI 106.14  206.14
62 ARG PHI -104.02  -24.02
62 ARG PSI -87.53  12.47
63 SER PHI -107.52  -27.52
63 SER PSI -88.61  11.39
64 GLU PHI -103.38  -23.38
64 GLU PSI -94.55  5.45
65 ALA PHI -104.03  -24.03
65 ALA PSI -92.46  7.54
66 THR PHI -106.82  -26.82
66 THR PSI -86.84  13.16
67 LYS PHI -106.89  -26.89
67 LYS PSI -90.59  9.41
68 ALA PHI -104.43  -24.43
68 ALA PSI -90.5  9.5
69 GLU PHI -101.52  -21.52
69 GLU PSI -97.75  2.25
70 ALA PHI -101.56  -21.56
70 ALA PSI -88.93  11.07
71 ALA PHI -106.26  -26.26
71 ALA PSI -88.65  11.35
72 PHE PHI -100.37  -20.37
72 PHE PSI -96.55  3.45
73 LYS PHI -103.58  -23.58
73 LYS PSI -84.85  15.15
74 LYS PHI -120.83  -40.83
74 LYS PSI -75.46  24.54
77 ARG PHI -97.97  -17.97
77 ARG PSI -89.11  10.89
78 LYS PHI -100.11  -20.11
78 LYS PSI -94.91  5.09
79 GLN PHI -103.4  -23.4
79 GLN PSI -90.94  9.06
80 LYS PHI -104.13  -24.13
80 LYS PSI -92.61  7.39
81 GLU PHI -104.07  -24.07
81 GLU PSI -90.57  9.43
82 GLN PHI -105.17  -25.17
82 GLN PSI -90.87  9.13
83 TYR PHI -104.2  -24.2
83 TYR PSI -94.92  5.08
84 LEU PHI -101.98  -21.98
84 LEU PSI -91.81  8.19
85 LYS PHI -102.4  -22.4
85 LYS PSI -89.78  10.22
86 THR PHI -105.26  -25.26
86 THR PSI -84.34  15.66
87 PHE PHI -106.89  -26.89
87 PHE PSI -88.55  11.45
88 HIS PHI -110.01  -30.01
88 HIS PSI -91.33  8.67
#END Manual Input


# created by  NOESY_Assign Version 2.0.0 Copyright(C) 1995-2003

  7 HIS  O      59 PHE  N       3.30 # hbond
  7 HIS  O      59 PHE  HN      2.30 # hbond
  8 TYR  O      24 THR  N       3.30 # hbond
  8 TYR  O      24 THR  HN      2.30 # hbond
  9 PHE  O      57 GLU  N       3.30 # hbond
  9 PHE  O      57 GLU  HN      2.30 # hbond
 10 TYR  O      22 GLY  N       3.30 # hbond
 10 TYR  O      22 GLY  HN      2.30 # hbond
 12 LEU  O      20 TYR  N       3.30 # hbond
 12 LEU  O      20 TYR  HN      2.30 # hbond
 13 LEU  O      52 ILE  N       3.30 # hbond
 13 LEU  O      52 ILE  HN      2.30 # hbond
 20 TYR  O      12 LEU  N       3.30 # hbond
 20 TYR  O      12 LEU  HN      2.30 # hbond
 22 GLY  O      10 TYR  N       3.30 # hbond
 22 GLY  O      10 TYR  HN      2.30 # hbond
 24 THR  O       8 TYR  N       3.30 # hbond
 24 THR  O       8 TYR  HN      2.30 # hbond
 28 GLU  O      32 THR  N       3.30 # hbond
 28 GLU  O      32 THR  HN      2.30 # hbond
 29 ARG  O      33 GLU  N       3.30 # hbond
 29 ARG  O      33 GLU  HN      2.30 # hbond
 52 ILE  O      13 LEU  N       3.30 # hbond
 52 ILE  O      13 LEU  HN      2.30 # hbond
 57 GLU  O       9 PHE  N       3.30 # hbond
 57 GLU  O       9 PHE  HN      2.30 # hbond
 59 PHE  O       7 HIS  N       3.30 # hbond
 59 PHE  O       7 HIS  HN      2.30 # hbond
 63 SER  O      67 LYS  N       3.30 # hbond
 63 SER  O      67 LYS  HN      2.30 # hbond
 64 GLU  O      68 ALA  N       3.30 # hbond
 64 GLU  O      68 ALA  HN      2.30 # hbond
 65 ALA  O      69 GLU  N       3.30 # hbond
 65 ALA  O      69 GLU  HN      2.30 # hbond
 66 THR  O      70 ALA  N       3.30 # hbond
 66 THR  O      70 ALA  HN      2.30 # hbond
 67 LYS  O      71 ALA  N       3.30 # hbond
 67 LYS  O      71 ALA  HN      2.30 # hbond
 68 ALA  O      72 PHE  N       3.30 # hbond
 68 ALA  O      72 PHE  HN      2.30 # hbond
 69 GLU  O      73 LYS  N       3.30 # hbond
 69 GLU  O      73 LYS  HN      2.30 # hbond
 78 LYS  O      82 GLN  N       3.30 # hbond
 78 LYS  O      82 GLN  HN      2.30 # hbond
 79 GLN  O      83 TYR  N       3.30 # hbond
 79 GLN  O      83 TYR  HN      2.30 # hbond
 80 LYS  O      84 LEU  N       3.30 # hbond
 80 LYS  O      84 LEU  HN      2.30 # hbond
 81 GLU  O      85 LYS  N       3.30 # hbond
 81 GLU  O      85 LYS  HN      2.30 # hbond
 82 GLN  O      86 THR  N       3.30 # hbond
 82 GLN  O      86 THR  HN      2.30 # hbond
 84 LEU  O      88 HIS  N       3.30 # hbond
 84 LEU  O      88 HIS  HN      2.30 # hbond


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1H        MET   1  -0.932 -15.319   2.176
    2    HA   MET   1           HA       MET   1  -0.589 -16.369  -0.147
    3   1HB   MET   1          1HB       MET   1  -2.494 -14.248  -0.561
    4   2HB   MET   1          2HB       MET   1  -1.007 -13.725  -1.328
    5   1HG   MET   1          1HG       MET   1  -1.620 -15.022  -3.099
    6   2HG   MET   1          2HG       MET   1  -1.177 -16.403  -2.115
    7   1HE   MET   1          1HE       MET   1  -2.394 -18.147  -2.084
    8   2HE   MET   1          2HE       MET   1  -4.162 -18.358  -2.066
    9   3HE   MET   1          3HE       MET   1  -3.331 -17.936  -3.583
   10    H    GLU   2           H        GLU   2  -0.206 -13.271   1.596
   11    HA   GLU   2           HA       GLU   2   2.085 -12.379   0.412
   12   1HB   GLU   2          1HB       GLU   2   0.969 -12.124   3.217
   13   2HB   GLU   2          2HB       GLU   2   2.513 -11.398   2.817
   14   1HG   GLU   2          1HG       GLU   2   1.308  -9.611   2.080
   15   2HG   GLU   2          2HG       GLU   2   0.942 -10.589   0.672
   16    H    ASN   3           H        ASN   3   4.191 -12.172   2.166
   17    HA   ASN   3           HA       ASN   3   5.968 -13.182   2.884
   18   1HB   ASN   3          1HB       ASN   3   4.194 -15.573   3.601
   19   2HB   ASN   3          2HB       ASN   3   5.762 -15.204   4.293
   20   1HD2  ASN   3          1HD2      ASN   3   5.491 -14.629   6.308
   21   2HD2  ASN   3          2HD2      ASN   3   4.346 -13.487   6.928
   22    H    LYS   4           H        LYS   4   6.527 -13.348   0.493
   23    HA   LYS   4           HA       LYS   4   7.713 -15.617  -0.249
   24   1HB   LYS   4          1HB       LYS   4   5.959 -17.086  -0.308
   25   2HB   LYS   4          2HB       LYS   4   4.780 -15.858  -0.721
   26   1HG   LYS   4          1HG       LYS   4   5.281 -15.936  -3.010
   27   2HG   LYS   4          2HG       LYS   4   6.932 -16.461  -2.745
   28   1HD   LYS   4          1HD       LYS   4   6.333 -18.638  -2.957
   29   2HD   LYS   4          2HD       LYS   4   5.140 -18.479  -1.684
   30   1HE   LYS   4          1HE       LYS   4   3.884 -17.167  -3.786
   31   2HE   LYS   4          2HE       LYS   4   4.774 -18.415  -4.635
   32   1HZ   LYS   4          1HZ       LYS   4   3.603 -19.525  -2.365
   33   2HZ   LYS   4          2HZ       LYS   4   2.453 -18.702  -3.182
   34   3HZ   LYS   4          3HZ       LYS   4   3.307 -19.874  -3.933
   35    H    LYS   5           H        LYS   5   9.003 -13.803  -0.945
   36    HA   LYS   5           HA       LYS   5   9.661 -12.185  -2.324
   37   1HB   LYS   5          1HB       LYS   5   9.923 -12.883  -4.566
   38   2HB   LYS   5          2HB       LYS   5   9.949 -14.345  -3.601
   39   1HG   LYS   5          1HG       LYS   5   7.659 -14.889  -4.194
   40   2HG   LYS   5          2HG       LYS   5   7.393 -13.305  -4.896
   41   1HD   LYS   5          1HD       LYS   5   8.122 -14.053  -6.905
   42   2HD   LYS   5          2HD       LYS   5   9.687 -14.430  -6.212
   43   1HE   LYS   5          1HE       LYS   5   9.105 -16.681  -5.767
   44   2HE   LYS   5          2HE       LYS   5   7.386 -16.343  -5.749
   45   1HZ   LYS   5          1HZ       LYS   5   9.049 -16.150  -8.162
   46   2HZ   LYS   5          2HZ       LYS   5   8.169 -17.467  -7.764
   47   3HZ   LYS   5          3HZ       LYS   5   7.421 -16.051  -8.087
   48    H    SER   6           H        SER   6   8.710 -11.103  -4.732
   49    HA   SER   6           HA       SER   6   7.338  -9.611  -5.506
   50   1HB   SER   6          1HB       SER   6   5.044 -10.093  -5.630
   51   2HB   SER   6          2HB       SER   6   5.740 -11.672  -5.325
   52    HG   SER   6           HG       SER   6   5.357 -10.971  -2.919
   53    H    HIS   7           H        HIS   7   6.981  -7.466  -4.934
   54    HA   HIS   7           HA       HIS   7   7.166  -6.864  -2.132
   55   1HB   HIS   7          1HB       HIS   7   6.987  -5.029  -4.538
   56   2HB   HIS   7          2HB       HIS   7   7.364  -4.538  -2.898
   57    HD1  HIS   7           HD1      HIS   7   9.561  -3.660  -4.434
   58    HD2  HIS   7           HD2      HIS   7   9.280  -7.736  -3.483
   59    HE1  HIS   7           HE1      HIS   7  11.904  -4.626  -4.728
   60    H    TYR   8           H        TYR   8   5.277  -7.281  -1.028
   61    HA   TYR   8           HA       TYR   8   2.738  -6.708  -2.225
   62   1HB   TYR   8          1HB       TYR   8   3.733  -7.415   0.607
   63   2HB   TYR   8          2HB       TYR   8   2.040  -7.416   0.154
   64    HD1  TYR   8           HD1      TYR   8   5.105  -9.308   0.210
   65    HD2  TYR   8           HD2      TYR   8   1.254  -9.058  -1.638
   66    HE1  TYR   8           HE1      TYR   8   5.298 -11.731  -0.537
   67    HE2  TYR   8           HE2      TYR   8   1.460 -11.482  -2.379
   68    HH   TYR   8           HH       TYR   8   3.386 -13.599  -1.097
   69    H    PHE   9           H        PHE   9   1.733  -4.764  -2.258
   70    HA   PHE   9           HA       PHE   9   2.705  -2.745  -0.382
   71   1HB   PHE   9          1HB       PHE   9   2.692  -2.404  -2.928
   72   2HB   PHE   9          2HB       PHE   9   0.951  -2.602  -2.908
   73    HD1  PHE   9           HD1      PHE   9  -0.493  -0.838  -2.112
   74    HD2  PHE   9           HD2      PHE   9   3.725  -0.385  -1.993
   75    HE1  PHE   9           HE1      PHE   9  -0.769   1.623  -1.703
   76    HE2  PHE   9           HE2      PHE   9   3.449   2.076  -1.584
   77    HZ   PHE   9           HZ       PHE   9   1.205   3.050  -1.444
   78    H    TYR  10           H        TYR  10   1.517  -2.504   1.450
   79    HA   TYR  10           HA       TYR  10  -1.399  -2.804   1.177
   80   1HB   TYR  10          1HB       TYR  10  -1.221  -3.634   3.571
   81   2HB   TYR  10          2HB       TYR  10  -0.303  -4.647   2.475
   82    HD1  TYR  10           HD1      TYR  10  -0.169  -2.535   5.391
   83    HD2  TYR  10           HD2      TYR  10   2.222  -4.298   2.312
   84    HE1  TYR  10           HE1      TYR  10   1.919  -2.178   6.797
   85    HE2  TYR  10           HE2      TYR  10   4.301  -3.936   3.729
   86    HH   TYR  10           HH       TYR  10   4.239  -1.978   6.552
   87    H    VAL  11           H        VAL  11  -2.644  -1.120   1.899
   88    HA   VAL  11           HA       VAL  11  -1.191   1.026   3.287
   89    HB   VAL  11           HB       VAL  11  -3.598   1.235   1.469
   90   1HG1  VAL  11          1HG1      VAL  11  -3.777   3.364   2.117
   91   2HG1  VAL  11          2HG1      VAL  11  -2.587   3.018   3.396
   92   3HG1  VAL  11          3HG1      VAL  11  -2.045   3.655   1.824
   93   1HG2  VAL  11          1HG2      VAL  11  -1.479   0.498   0.318
   94   2HG2  VAL  11          2HG2      VAL  11  -2.149   2.044  -0.256
   95   3HG2  VAL  11          3HG2      VAL  11  -0.742   2.033   0.834
   96    H    LEU  12           H        LEU  12  -1.696   1.094   5.411
   97    HA   LEU  12           HA       LEU  12  -4.252  -0.010   6.240
   98   1HB   LEU  12          1HB       LEU  12  -1.810   0.879   7.779
   99   2HB   LEU  12          2HB       LEU  12  -3.278   0.274   8.520
  100    HG   LEU  12           HG       LEU  12  -1.855  -1.399   6.468
  101   1HD1  LEU  12          1HD1      LEU  12   0.010  -1.429   7.686
  102   2HD1  LEU  12          2HD1      LEU  12  -0.760  -0.575   9.044
  103   3HD1  LEU  12          3HD1      LEU  12  -0.921  -2.341   8.898
  104   1HD2  LEU  12          1HD2      LEU  12  -3.863  -1.814   8.636
  105   2HD2  LEU  12          2HD2      LEU  12  -3.791  -2.484   6.989
  106   3HD2  LEU  12          3HD2      LEU  12  -2.739  -3.142   8.264
  107    H    LEU  13           H        LEU  13  -5.687   1.192   7.695
  108    HA   LEU  13           HA       LEU  13  -5.292   4.075   7.667
  109   1HB   LEU  13          1HB       LEU  13  -6.564   4.171   5.817
  110   2HB   LEU  13          2HB       LEU  13  -7.299   2.603   6.089
  111    HG   LEU  13           HG       LEU  13  -8.750   3.643   7.847
  112   1HD1  LEU  13          1HD1      LEU  13  -8.941   6.031   8.036
  113   2HD1  LEU  13          2HD1      LEU  13  -7.249   5.567   8.332
  114   3HD1  LEU  13          3HD1      LEU  13  -7.716   6.278   6.769
  115   1HD2  LEU  13          1HD2      LEU  13  -9.661   5.287   5.715
  116   2HD2  LEU  13          2HD2      LEU  13  -8.926   3.830   5.002
  117   3HD2  LEU  13          3HD2      LEU  13 -10.233   3.673   6.201
  118    H    CYS  14           H        CYS  14  -5.767   4.924   9.631
  119    HA   CYS  14           HA       CYS  14  -7.275   3.179  11.432
  120   1HB   CYS  14          1HB       CYS  14  -6.136   4.439  13.269
  121   2HB   CYS  14          2HB       CYS  14  -5.052   3.498  12.263
  122    HG   CYS  14           HG       CYS  14  -5.752   6.478  11.194
  123    H    GLN  15           H        GLN  15  -8.183   4.869  13.345
  124    HA   GLN  15           HA       GLN  15 -10.183   6.291  11.977
  125   1HB   GLN  15          1HB       GLN  15  -9.657   5.373  14.663
  126   2HB   GLN  15          2HB       GLN  15 -10.085   7.071  14.742
  127   1HG   GLN  15          1HG       GLN  15 -12.254   6.407  14.588
  128   2HG   GLN  15          2HG       GLN  15 -11.932   6.065  12.900
  129   1HE2  GLN  15          1HE2      GLN  15 -12.288   4.101  12.204
  130   2HE2  GLN  15          2HE2      GLN  15 -12.388   2.655  13.152
  131    H    ASP  16           H        ASP  16  -6.949   7.038  12.637
  132    HA   ASP  16           HA       ASP  16  -7.513   9.858  12.984
  133   1HB   ASP  16          1HB       ASP  16  -4.887   8.296  13.039
  134   2HB   ASP  16          2HB       ASP  16  -5.017  10.020  13.326
  135    H    GLY  17           H        GLY  17  -7.809   8.057  10.446
  136   1HA   GLY  17          1HA       GLY  17  -7.306   8.094   8.248
  137   2HA   GLY  17          2HA       GLY  17  -7.223   9.831   8.470
  138    H    SER  18           H        SER  18  -5.200   6.879   9.140
  139    HA   SER  18           HA       SER  18  -2.931   8.466   8.219
  140   1HB   SER  18          1HB       SER  18  -2.990   7.760  10.700
  141   2HB   SER  18          2HB       SER  18  -2.776   6.113  10.143
  142    HG   SER  18           HG       SER  18  -0.941   8.269  10.168
  143    H    PHE  19           H        PHE  19  -2.638   7.818   6.095
  144    HA   PHE  19           HA       PHE  19  -3.136   5.072   5.380
  145   1HB   PHE  19          1HB       PHE  19  -2.377   7.711   4.055
  146   2HB   PHE  19          2HB       PHE  19  -2.134   6.233   3.145
  147    HD1  PHE  19           HD1      PHE  19  -4.790   7.951   5.130
  148    HD2  PHE  19           HD2      PHE  19  -3.860   5.467   1.817
  149    HE1  PHE  19           HE1      PHE  19  -7.199   7.988   4.426
  150    HE2  PHE  19           HE2      PHE  19  -6.269   5.504   1.113
  151    HZ   PHE  19           HZ       PHE  19  -7.910   6.764   2.426
  152    H    TYR  20           H        TYR  20  -1.575   3.655   6.114
  153    HA   TYR  20           HA       TYR  20   1.220   4.451   5.743
  154   1HB   TYR  20          1HB       TYR  20  -0.381   3.098   7.730
  155   2HB   TYR  20          2HB       TYR  20   0.630   1.855   7.021
  156    HD1  TYR  20           HD1      TYR  20   2.730   1.485   7.944
  157    HD2  TYR  20           HD2      TYR  20   0.928   5.339   8.391
  158    HE1  TYR  20           HE1      TYR  20   4.664   2.226   9.420
  159    HE2  TYR  20           HE2      TYR  20   2.868   6.067   9.865
  160    HH   TYR  20           HH       TYR  20   4.744   5.516  10.768
  161    H    GLY  21           H        GLY  21   1.564   4.062   3.525
  162   1HA   GLY  21          1HA       GLY  21   0.921   1.366   2.541
  163   2HA   GLY  21          2HA       GLY  21   1.297   2.777   1.572
  164    H    GLY  22           H        GLY  22   2.519  -0.140   2.735
  165   1HA   GLY  22          1HA       GLY  22   5.289   0.761   2.243
  166   2HA   GLY  22          2HA       GLY  22   4.891  -0.271   3.602
  167    H    TYR  23           H        TYR  23   6.626  -0.777   1.184
  168    HA   TYR  23           HA       TYR  23   5.155  -3.101   0.133
  169   1HB   TYR  23          1HB       TYR  23   6.616  -2.718  -1.886
  170   2HB   TYR  23          2HB       TYR  23   5.697  -1.270  -1.522
  171    HD1  TYR  23           HD1      TYR  23   6.841   0.637  -0.290
  172    HD2  TYR  23           HD2      TYR  23   8.994  -2.697  -1.890
  173    HE1  TYR  23           HE1      TYR  23   9.001   1.974  -0.189
  174    HE2  TYR  23           HE2      TYR  23  11.147  -1.348  -1.784
  175    HH   TYR  23           HH       TYR  23  11.224   1.901  -1.491
  176    H    THR  24           H        THR  24   5.909  -4.999   0.915
  177    HA   THR  24           HA       THR  24   8.672  -5.609   0.850
  178    HB   THR  24           HB       THR  24   8.071  -4.085   3.041
  179    HG1  THR  24           HG1      THR  24  10.113  -5.183   2.209
  180   1HG2  THR  24          1HG2      THR  24   8.064  -6.911   4.145
  181   2HG2  THR  24          2HG2      THR  24   7.609  -5.394   4.957
  182   3HG2  THR  24          3HG2      THR  24   6.514  -6.127   3.760
  183    H    THR  25           H        THR  25   8.960  -7.805   2.266
  184    HA   THR  25           HA       THR  25   6.626  -9.432   1.498
  185    HB   THR  25           HB       THR  25   8.334 -11.236   1.145
  186    HG1  THR  25           HG1      THR  25  10.214 -10.776   2.219
  187   1HG2  THR  25          1HG2      THR  25   7.906  -9.154  -0.587
  188   2HG2  THR  25          2HG2      THR  25   9.639  -8.923  -0.252
  189   3HG2  THR  25          3HG2      THR  25   9.060 -10.467  -0.923
  190    H    GLU  26           H        GLU  26   5.697 -10.811   2.948
  191    HA   GLU  26           HA       GLU  26   5.223 -11.736   4.856
  192   1HB   GLU  26          1HB       GLU  26   8.074 -11.254   5.810
  193   2HB   GLU  26          2HB       GLU  26   6.957 -12.478   6.380
  194   1HG   GLU  26          1HG       GLU  26   7.138 -13.765   4.392
  195   2HG   GLU  26          2HG       GLU  26   7.718 -12.408   3.447
  196    HA   PRO  27           HA       PRO  27   4.975  -7.568   6.714
  197   1HB   PRO  27          1HB       PRO  27   2.353  -7.029   6.163
  198   2HB   PRO  27          2HB       PRO  27   3.676  -6.474   5.158
  199   1HG   PRO  27          1HG       PRO  27   1.762  -8.669   4.654
  200   2HG   PRO  27          2HG       PRO  27   2.795  -7.830   3.514
  201   1HD   PRO  27          1HD       PRO  27   3.217 -10.447   4.608
  202   2HD   PRO  27          2HD       PRO  27   4.307  -9.562   3.560
  203    H    GLU  28           H        GLU  28   3.104 -10.440   6.903
  204    HA   GLU  28           HA       GLU  28   1.621  -9.812   9.130
  205   1HB   GLU  28          1HB       GLU  28   2.786 -12.525   8.363
  206   2HB   GLU  28          2HB       GLU  28   1.431 -12.267   9.443
  207   1HG   GLU  28          1HG       GLU  28   1.238 -10.998   6.728
  208   2HG   GLU  28          2HG       GLU  28   1.132 -12.746   6.781
  209    H    ARG  29           H        ARG  29   4.978 -11.085   8.807
  210    HA   ARG  29           HA       ARG  29   5.246 -11.349  11.615
  211   1HB   ARG  29          1HB       ARG  29   6.995 -11.734   9.196
  212   2HB   ARG  29          2HB       ARG  29   7.819 -11.458  10.717
  213   1HG   ARG  29          1HG       ARG  29   7.124 -13.472  11.630
  214   2HG   ARG  29          2HG       ARG  29   5.575 -13.437  10.811
  215   1HD   ARG  29          1HD       ARG  29   6.391 -14.882   9.262
  216   2HD   ARG  29          2HD       ARG  29   7.529 -13.655   8.742
  217    HE   ARG  29           HE       ARG  29   9.234 -14.702   9.996
  218   1HH1  ARG  29          1HH1      ARG  29   6.107 -16.111  10.781
  219   2HH1  ARG  29          2HH1      ARG  29   6.784 -17.440  11.662
  220   1HH2  ARG  29          1HH2      ARG  29  10.128 -16.456  11.157
  221   2HH2  ARG  29          2HH2      ARG  29   9.086 -17.638  11.876
  222    H    ARG  30           H        ARG  30   6.194  -9.003   9.055
  223    HA   ARG  30           HA       ARG  30   7.848  -7.476  10.685
  224   1HB   ARG  30          1HB       ARG  30   7.484  -7.503   8.057
  225   2HB   ARG  30          2HB       ARG  30   6.252  -6.301   8.382
  226   1HG   ARG  30          1HG       ARG  30   8.251  -5.220   9.860
  227   2HG   ARG  30          2HG       ARG  30   9.236  -6.103   8.711
  228   1HD   ARG  30          1HD       ARG  30   8.657  -4.732   6.950
  229   2HD   ARG  30          2HD       ARG  30   6.991  -4.585   7.473
  230    HE   ARG  30           HE       ARG  30   7.558  -2.672   8.716
  231   1HH1  ARG  30          1HH1      ARG  30  10.487  -4.359   7.740
  232   2HH1  ARG  30          2HH1      ARG  30  11.544  -3.084   8.250
  233   1HH2  ARG  30          1HH2      ARG  30   8.951  -0.991   9.390
  234   2HH2  ARG  30          2HH2      ARG  30  10.664  -1.156   9.195
  235    H    LEU  31           H        LEU  31   4.333  -7.606  10.160
  236    HA   LEU  31           HA       LEU  31   3.787  -5.059  11.294
  237   1HB   LEU  31          1HB       LEU  31   2.359  -6.297   9.661
  238   2HB   LEU  31          2HB       LEU  31   1.955  -7.433  10.933
  239    HG   LEU  31           HG       LEU  31   1.228  -5.215  12.213
  240   1HD1  LEU  31          1HD1      LEU  31   0.103  -4.149   9.800
  241   2HD1  LEU  31          2HD1      LEU  31   1.123  -3.350  11.020
  242   3HD1  LEU  31          3HD1      LEU  31   1.876  -4.203   9.650
  243   1HD2  LEU  31          1HD2      LEU  31  -0.275  -6.883  10.216
  244   2HD2  LEU  31          2HD2      LEU  31  -0.371  -6.872  11.994
  245   3HD2  LEU  31          3HD2      LEU  31  -1.080  -5.535  11.056
  246    H    THR  32           H        THR  32   2.875  -8.350  12.534
  247    HA   THR  32           HA       THR  32   2.286  -7.691  15.077
  248    HB   THR  32           HB       THR  32   2.429  -9.990  13.714
  249    HG1  THR  32           HG1      THR  32   3.047  -9.814  16.573
  250   1HG2  THR  32          1HG2      THR  32   4.946 -10.121  13.764
  251   2HG2  THR  32          2HG2      THR  32   4.888 -10.070  15.542
  252   3HG2  THR  32          3HG2      THR  32   4.192 -11.456  14.668
  253    H    GLU  33           H        GLU  33   5.591  -8.056  13.718
  254    HA   GLU  33           HA       GLU  33   6.975  -7.991  16.057
  255   1HB   GLU  33          1HB       GLU  33   8.002  -8.393  13.851
  256   2HB   GLU  33          2HB       GLU  33   7.699  -6.734  13.374
  257   1HG   GLU  33          1HG       GLU  33   9.206  -5.897  15.135
  258   2HG   GLU  33          2HG       GLU  33   9.419  -7.515  15.774
  259    H    HIS  34           H        HIS  34   6.109  -5.144  13.957
  260    HA   HIS  34           HA       HIS  34   7.117  -3.188  15.560
  261   1HB   HIS  34          1HB       HIS  34   6.428  -2.409  13.527
  262   2HB   HIS  34          2HB       HIS  34   4.957  -3.361  13.522
  263    HD1  HIS  34           HD1      HIS  34   2.814  -2.244  14.343
  264    HD2  HIS  34           HD2      HIS  34   6.253   0.040  15.085
  265    HE1  HIS  34           HE1      HIS  34   1.998   0.041  15.132
  266    H    ASN  35           H        ASN  35   3.703  -4.447  15.579
  267    HA   ASN  35           HA       ASN  35   2.768  -2.970  17.620
  268   1HB   ASN  35          1HB       ASN  35   2.132  -5.593  16.403
  269   2HB   ASN  35          2HB       ASN  35   1.652  -5.521  18.087
  270   1HD2  ASN  35          1HD2      ASN  35   0.547  -5.127  15.101
  271   2HD2  ASN  35          2HD2      ASN  35  -0.669  -3.912  15.308
  272    H    SER  36           H        SER  36   4.264  -6.294  17.825
  273    HA   SER  36           HA       SER  36   4.509  -5.963  20.674
  274   1HB   SER  36          1HB       SER  36   3.830  -8.132  19.273
  275   2HB   SER  36          2HB       SER  36   5.565  -8.360  19.173
  276    HG   SER  36           HG       SER  36   3.911  -8.919  21.252
  277    H    GLY  37           H        GLY  37   6.056  -4.087  19.244
  278   1HA   GLY  37          1HA       GLY  37   8.798  -5.133  19.632
  279   2HA   GLY  37          2HA       GLY  37   8.359  -4.027  18.345
  280    H    THR  38           H        THR  38   7.021  -1.977  19.247
  281    HA   THR  38           HA       THR  38   8.793  -0.472  20.741
  282    HB   THR  38           HB       THR  38   5.791  -0.207  20.202
  283    HG1  THR  38           HG1      THR  38   6.949   0.009  18.280
  284   1HG2  THR  38          1HG2      THR  38   7.800   1.639  21.518
  285   2HG2  THR  38          2HG2      THR  38   6.602   2.339  20.402
  286   3HG2  THR  38          3HG2      THR  38   6.061   1.457  21.851
  287    H    GLY  39           H        GLY  39   5.583  -1.703  21.914
  288   1HA   GLY  39          1HA       GLY  39   6.682  -2.619  24.373
  289   2HA   GLY  39          2HA       GLY  39   5.946  -1.041  24.573
  290    H    ALA  40           H        ALA  40   5.294  -4.184  25.070
  291    HA   ALA  40           HA       ALA  40   2.552  -3.847  25.303
  292   1HB   ALA  40          1HB       ALA  40   3.230  -4.164  22.629
  293   2HB   ALA  40          2HB       ALA  40   2.807  -5.818  23.134
  294   3HB   ALA  40          3HB       ALA  40   1.633  -4.497  23.343
  295    H    LYS  41           H        LYS  41   1.470  -6.037  25.809
  296    HA   LYS  41           HA       LYS  41   3.526  -7.873  26.830
  297   1HB   LYS  41          1HB       LYS  41   1.903  -6.293  28.381
  298   2HB   LYS  41          2HB       LYS  41   0.965  -7.770  28.290
  299   1HG   LYS  41          1HG       LYS  41   3.677  -8.581  28.691
  300   2HG   LYS  41          2HG       LYS  41   3.403  -7.246  29.793
  301   1HD   LYS  41          1HD       LYS  41   1.053  -8.816  29.982
  302   2HD   LYS  41          2HD       LYS  41   2.355  -9.985  29.903
  303   1HE   LYS  41          1HE       LYS  41   3.266  -7.930  31.663
  304   2HE   LYS  41          2HE       LYS  41   1.600  -8.236  32.111
  305   1HZ   LYS  41          1HZ       LYS  41   2.259 -10.654  32.033
  306   2HZ   LYS  41          2HZ       LYS  41   3.811 -10.147  32.019
  307   3HZ   LYS  41          3HZ       LYS  41   2.842  -9.776  33.280
  308    H    TYR  42           H        TYR  42  -0.090  -7.883  26.515
  309    HA   TYR  42           HA       TYR  42   0.122  -9.987  24.529
  310   1HB   TYR  42          1HB       TYR  42  -0.038 -10.564  27.266
  311   2HB   TYR  42          2HB       TYR  42  -1.739 -10.464  26.853
  312    HD1  TYR  42           HD1      TYR  42   1.436 -12.211  25.985
  313    HD2  TYR  42           HD2      TYR  42  -2.836 -12.254  25.751
  314    HE1  TYR  42           HE1      TYR  42   1.500 -14.598  25.110
  315    HE2  TYR  42           HE2      TYR  42  -2.757 -14.640  24.878
  316    HH   TYR  42           HH       TYR  42  -0.753 -16.625  25.243
  317    H    THR  43           H        THR  43  -0.937  -8.647  23.032
  318    HA   THR  43           HA       THR  43  -3.786  -8.444  23.440
  319    HB   THR  43           HB       THR  43  -2.038  -5.955  23.062
  320    HG1  THR  43           HG1      THR  43  -3.901  -6.809  25.156
  321   1HG2  THR  43          1HG2      THR  43  -4.796  -6.432  22.395
  322   2HG2  THR  43          2HG2      THR  43  -4.775  -5.484  23.901
  323   3HG2  THR  43          3HG2      THR  43  -3.950  -4.867  22.450
  324    H    ARG  44           H        ARG  44  -4.038  -9.871  21.730
  325    HA   ARG  44           HA       ARG  44  -2.667  -9.337  19.305
  326   1HB   ARG  44          1HB       ARG  44  -4.575 -11.410  20.342
  327   2HB   ARG  44          2HB       ARG  44  -4.580 -11.174  18.606
  328   1HG   ARG  44          1HG       ARG  44  -1.976 -11.547  20.136
  329   2HG   ARG  44          2HG       ARG  44  -2.918 -12.924  19.601
  330   1HD   ARG  44          1HD       ARG  44  -2.571 -12.453  17.310
  331   2HD   ARG  44          2HD       ARG  44  -2.264 -10.751  17.597
  332    HE   ARG  44           HE       ARG  44  -0.009 -11.246  17.979
  333   1HH1  ARG  44          1HH1      ARG  44  -1.896 -14.204  18.250
  334   2HH1  ARG  44          2HH1      ARG  44  -0.506 -15.230  18.383
  335   1HH2  ARG  44          1HH2      ARG  44   1.825 -12.599  18.154
  336   2HH2  ARG  44          2HH2      ARG  44   1.624 -14.311  18.328
  337    H    LEU  45           H        LEU  45  -6.168  -9.435  20.319
  338    HA   LEU  45           HA       LEU  45  -7.343  -8.560  18.055
  339   1HB   LEU  45          1HB       LEU  45  -8.939  -7.356  19.739
  340   2HB   LEU  45          2HB       LEU  45  -8.842  -9.104  19.656
  341    HG   LEU  45           HG       LEU  45  -6.917  -8.083  21.567
  342   1HD1  LEU  45          1HD1      LEU  45  -8.133  -6.246  22.170
  343   2HD1  LEU  45          2HD1      LEU  45  -9.686  -6.969  21.688
  344   3HD1  LEU  45          3HD1      LEU  45  -8.904  -7.471  23.206
  345   1HD2  LEU  45          1HD2      LEU  45  -9.036 -10.141  21.376
  346   2HD2  LEU  45          2HD2      LEU  45  -7.375 -10.246  22.006
  347   3HD2  LEU  45          3HD2      LEU  45  -8.667  -9.549  23.013
  348    H    ALA  46           H        ALA  46  -6.055  -6.410  20.689
  349    HA   ALA  46           HA       ALA  46  -5.304  -4.331  20.636
  350   1HB   ALA  46          1HB       ALA  46  -4.579  -3.567  18.160
  351   2HB   ALA  46          2HB       ALA  46  -3.608  -4.700  19.130
  352   3HB   ALA  46          3HB       ALA  46  -4.708  -5.320  17.876
  353    H    LYS  47           H        LYS  47  -7.063  -3.116  21.257
  354    HA   LYS  47           HA       LYS  47  -9.123  -2.572  19.295
  355   1HB   LYS  47          1HB       LYS  47  -8.839  -1.967  22.247
  356   2HB   LYS  47          2HB       LYS  47 -10.172  -1.374  21.276
  357   1HG   LYS  47          1HG       LYS  47 -10.541  -3.842  20.554
  358   2HG   LYS  47          2HG       LYS  47  -9.436  -4.276  21.843
  359   1HD   LYS  47          1HD       LYS  47 -11.596  -4.415  22.841
  360   2HD   LYS  47          2HD       LYS  47 -10.944  -2.897  23.424
  361   1HE   LYS  47          1HE       LYS  47 -13.060  -2.195  22.730
  362   2HE   LYS  47          2HE       LYS  47 -12.138  -1.879  21.274
  363   1HZ   LYS  47          1HZ       LYS  47 -12.964  -4.525  21.216
  364   2HZ   LYS  47          2HZ       LYS  47 -14.267  -3.616  21.592
  365   3HZ   LYS  47          3HZ       LYS  47 -13.421  -3.306  20.231
  366    H    ARG  48           H        ARG  48  -7.207  -0.510  21.599
  367    HA   ARG  48           HA       ARG  48  -7.698   1.849  20.471
  368   1HB   ARG  48          1HB       ARG  48  -5.056   0.833  21.627
  369   2HB   ARG  48          2HB       ARG  48  -5.365   2.527  21.301
  370   1HG   ARG  48          1HG       ARG  48  -6.970   2.714  23.007
  371   2HG   ARG  48          2HG       ARG  48  -7.390   1.014  22.950
  372   1HD   ARG  48          1HD       ARG  48  -4.745   0.844  23.707
  373   2HD   ARG  48          2HD       ARG  48  -5.184   2.374  24.440
  374    HE   ARG  48           HE       ARG  48  -7.249   0.465  24.999
  375   1HH1  ARG  48          1HH1      ARG  48  -3.911   1.173  25.858
  376   2HH1  ARG  48          2HH1      ARG  48  -4.021   0.430  27.419
  377   1HH2  ARG  48          1HH2      ARG  48  -7.395  -0.514  27.059
  378   2HH2  ARG  48          2HH2      ARG  48  -6.016  -0.536  28.106
  379    H    ARG  49           H        ARG  49  -6.872   3.128  18.735
  380    HA   ARG  49           HA       ARG  49  -6.117   3.493  16.742
  381   1HB   ARG  49          1HB       ARG  49  -3.904   2.899  18.260
  382   2HB   ARG  49          2HB       ARG  49  -3.719   1.708  16.988
  383   1HG   ARG  49          1HG       ARG  49  -4.424   4.096  15.633
  384   2HG   ARG  49          2HG       ARG  49  -3.306   4.609  16.881
  385   1HD   ARG  49          1HD       ARG  49  -1.516   3.500  15.931
  386   2HD   ARG  49          2HD       ARG  49  -2.489   2.128  15.439
  387    HE   ARG  49           HE       ARG  49  -3.270   4.393  13.872
  388   1HH1  ARG  49          1HH1      ARG  49  -0.543   2.206  14.276
  389   2HH1  ARG  49          2HH1      ARG  49   0.003   2.380  12.641
  390   1HH2  ARG  49          1HH2      ARG  49  -2.550   4.623  11.716
  391   2HH2  ARG  49          2HH2      ARG  49  -1.147   3.764  11.175
  392    HA   PRO  50           HA       PRO  50  -7.516  -0.432  15.007
  393   1HB   PRO  50          1HB       PRO  50  -9.509   0.589  13.441
  394   2HB   PRO  50          2HB       PRO  50  -9.773   0.022  15.078
  395   1HG   PRO  50          1HG       PRO  50  -9.630   2.801  14.081
  396   2HG   PRO  50          2HG       PRO  50 -10.300   2.208  15.588
  397   1HD   PRO  50          1HD       PRO  50  -7.779   3.529  15.233
  398   2HD   PRO  50          2HD       PRO  50  -8.398   2.834  16.717
  399    H    VAL  51           H        VAL  51  -7.042  -1.506  13.096
  400    HA   VAL  51           HA       VAL  51  -5.840   0.295  11.110
  401    HB   VAL  51           HB       VAL  51  -4.224  -1.545  10.673
  402   1HG1  VAL  51          1HG1      VAL  51  -4.164  -0.448  13.505
  403   2HG1  VAL  51          2HG1      VAL  51  -2.771  -1.042  12.570
  404   3HG1  VAL  51          3HG1      VAL  51  -3.636   0.423  12.046
  405   1HG2  VAL  51          1HG2      VAL  51  -5.933  -3.004  12.402
  406   2HG2  VAL  51          2HG2      VAL  51  -4.439  -3.557  11.608
  407   3HG2  VAL  51          3HG2      VAL  51  -4.369  -2.843  13.237
  408    H    ILE  52           H        ILE  52  -7.013   0.274   9.270
  409    HA   ILE  52           HA       ILE  52  -8.363  -2.251   8.605
  410    HB   ILE  52           HB       ILE  52 -10.164  -1.055   7.701
  411   1HG1  ILE  52          1HG1      ILE  52  -9.554   1.695   8.211
  412   2HG1  ILE  52          2HG1      ILE  52  -8.243   1.014   7.270
  413   1HG2  ILE  52          1HG2      ILE  52 -11.139  -0.264   9.607
  414   2HG2  ILE  52          2HG2      ILE  52  -9.735  -1.097  10.315
  415   3HG2  ILE  52          3HG2      ILE  52  -9.704   0.669  10.095
  416   1HD1  ILE  52          1HD1      ILE  52  -9.868   1.777   5.677
  417   2HD1  ILE  52          2HD1      ILE  52 -10.034   0.006   5.720
  418   3HD1  ILE  52          3HD1      ILE  52 -11.208   1.031   6.580
  419    H    MET  53           H        MET  53  -8.427  -2.841   6.342
  420    HA   MET  53           HA       MET  53  -6.292  -1.513   4.857
  421   1HB   MET  53          1HB       MET  53  -6.469  -4.188   5.699
  422   2HB   MET  53          2HB       MET  53  -7.051  -4.280   4.049
  423   1HG   MET  53          1HG       MET  53  -5.007  -3.471   3.140
  424   2HG   MET  53          2HG       MET  53  -4.510  -2.734   4.650
  425   1HE   MET  53          1HE       MET  53  -2.022  -5.018   5.772
  426   2HE   MET  53          2HE       MET  53  -2.698  -3.391   5.520
  427   3HE   MET  53          3HE       MET  53  -3.345  -4.434   6.809
  428    H    ILE  54           H        ILE  54  -6.974  -0.431   3.063
  429    HA   ILE  54           HA       ILE  54  -9.491  -1.348   1.856
  430    HB   ILE  54           HB       ILE  54 -10.052   0.846   1.353
  431   1HG1  ILE  54          1HG1      ILE  54  -7.848   1.508   0.434
  432   2HG1  ILE  54          2HG1      ILE  54  -8.595   2.754   1.414
  433   1HG2  ILE  54          1HG2      ILE  54 -10.516   0.532   3.628
  434   2HG2  ILE  54          2HG2      ILE  54  -8.803   0.666   4.092
  435   3HG2  ILE  54          3HG2      ILE  54  -9.693   2.109   3.551
  436   1HD1  ILE  54          1HD1      ILE  54  -6.438   2.789   2.289
  437   2HD1  ILE  54          2HD1      ILE  54  -7.190   1.600   3.379
  438   3HD1  ILE  54          3HD1      ILE  54  -6.187   1.048   2.016
  439    H    HIS  55           H        HIS  55  -6.094  -1.124   1.529
  440    HA   HIS  55           HA       HIS  55  -6.396  -1.490  -1.361
  441   1HB   HIS  55          1HB       HIS  55  -4.116  -0.066   0.041
  442   2HB   HIS  55          2HB       HIS  55  -4.235  -0.373  -1.680
  443    HD1  HIS  55           HD1      HIS  55  -6.549   0.757  -2.815
  444    HD2  HIS  55           HD2      HIS  55  -5.085   2.382   0.765
  445    HE1  HIS  55           HE1      HIS  55  -7.558   3.093  -2.625
  446    H    THR  56           H        THR  56  -5.308  -3.245  -2.250
  447    HA   THR  56           HA       THR  56  -3.299  -4.607  -0.687
  448    HB   THR  56           HB       THR  56  -4.760  -6.781  -0.924
  449    HG1  THR  56           HG1      THR  56  -6.403  -5.746  -2.241
  450   1HG2  THR  56          1HG2      THR  56  -5.862  -4.638   0.959
  451   2HG2  THR  56          2HG2      THR  56  -5.887  -6.402   1.196
  452   3HG2  THR  56          3HG2      THR  56  -4.347  -5.514   1.285
  453    H    GLU  57           H        GLU  57  -1.740  -4.606  -2.201
  454    HA   GLU  57           HA       GLU  57  -2.203  -6.205  -4.493
  455   1HB   GLU  57          1HB       GLU  57  -2.488  -3.318  -4.730
  456   2HB   GLU  57          2HB       GLU  57  -1.120  -3.857  -5.683
  457   1HG   GLU  57          1HG       GLU  57  -2.650  -5.676  -6.659
  458   2HG   GLU  57          2HG       GLU  57  -3.989  -4.880  -5.857
  459    H    LYS  58           H        LYS  58  -0.174  -6.768  -5.585
  460    HA   LYS  58           HA       LYS  58   2.186  -5.897  -4.069
  461   1HB   LYS  58          1HB       LYS  58   3.066  -8.130  -4.136
  462   2HB   LYS  58          2HB       LYS  58   1.467  -8.180  -3.420
  463   1HG   LYS  58          1HG       LYS  58   1.663  -8.562  -6.403
  464   2HG   LYS  58          2HG       LYS  58   2.215  -9.877  -5.384
  465   1HD   LYS  58          1HD       LYS  58   0.083 -10.490  -4.908
  466   2HD   LYS  58          2HD       LYS  58  -0.313  -8.876  -4.353
  467   1HE   LYS  58          1HE       LYS  58  -1.366  -8.336  -6.308
  468   2HE   LYS  58          2HE       LYS  58  -0.079  -9.004  -7.291
  469   1HZ   LYS  58          1HZ       LYS  58  -1.529 -10.604  -7.706
  470   2HZ   LYS  58          2HZ       LYS  58  -1.217 -11.182  -6.211
  471   3HZ   LYS  58          3HZ       LYS  58  -2.510 -10.215  -6.459
  472    H    PHE  59           H        PHE  59   4.265  -6.246  -5.361
  473    HA   PHE  59           HA       PHE  59   3.692  -5.779  -8.203
  474   1HB   PHE  59          1HB       PHE  59   6.044  -4.682  -6.572
  475   2HB   PHE  59          2HB       PHE  59   5.477  -4.102  -8.125
  476    HD1  PHE  59           HD1      PHE  59   5.845  -2.907  -5.100
  477    HD2  PHE  59           HD2      PHE  59   2.601  -3.782  -7.692
  478    HE1  PHE  59           HE1      PHE  59   4.451  -1.170  -3.942
  479    HE2  PHE  59           HE2      PHE  59   1.207  -2.045  -6.535
  480    HZ   PHE  59           HZ       PHE  59   2.149  -0.759  -4.673
  481    H    GLU  60           H        GLU  60   5.010  -6.826  -9.711
  482    HA   GLU  60           HA       GLU  60   6.599  -8.939  -8.578
  483   1HB   GLU  60          1HB       GLU  60   4.904  -9.279 -10.456
  484   2HB   GLU  60          2HB       GLU  60   5.985  -8.391 -11.513
  485   1HG   GLU  60          1HG       GLU  60   7.633 -10.070 -11.479
  486   2HG   GLU  60          2HG       GLU  60   7.121 -10.695  -9.924
  487    H    THR  61           H        THR  61   6.948  -6.160 -10.878
  488    HA   THR  61           HA       THR  61   9.855  -6.511 -10.763
  489    HB   THR  61           HB       THR  61   9.805  -5.014 -12.749
  490    HG1  THR  61           HG1      THR  61   7.443  -4.525 -13.393
  491   1HG2  THR  61          1HG2      THR  61   7.419  -6.717 -13.362
  492   2HG2  THR  61          2HG2      THR  61   8.961  -6.575 -14.240
  493   3HG2  THR  61          3HG2      THR  61   8.855  -7.595 -12.785
  494    H    ARG  62           H        ARG  62  11.128  -4.362 -10.753
  495    HA   ARG  62           HA       ARG  62  10.301  -3.067  -8.355
  496   1HB   ARG  62          1HB       ARG  62  12.776  -3.586  -9.697
  497   2HB   ARG  62          2HB       ARG  62  12.630  -1.841  -9.621
  498   1HG   ARG  62          1HG       ARG  62  11.950  -2.259  -7.097
  499   2HG   ARG  62          2HG       ARG  62  12.693  -3.829  -7.331
  500   1HD   ARG  62          1HD       ARG  62  14.338  -1.574  -8.353
  501   2HD   ARG  62          2HD       ARG  62  14.053  -1.508  -6.625
  502    HE   ARG  62           HE       ARG  62  14.761  -4.187  -7.243
  503   1HH1  ARG  62          1HH1      ARG  62  16.234  -0.992  -7.313
  504   2HH1  ARG  62          2HH1      ARG  62  17.842  -1.588  -7.069
  505   1HH2  ARG  62          1HH2      ARG  62  16.882  -4.974  -6.921
  506   2HH2  ARG  62          2HH2      ARG  62  18.213  -3.868  -6.844
  507    H    SER  63           H        SER  63  10.762  -2.287 -11.843
  508    HA   SER  63           HA       SER  63  10.618   0.372 -11.862
  509   1HB   SER  63          1HB       SER  63   9.606  -1.777 -13.682
  510   2HB   SER  63          2HB       SER  63   8.987  -0.165 -13.985
  511    HG   SER  63           HG       SER  63  11.203   0.603 -14.118
  512    H    GLU  64           H        GLU  64   7.661  -1.744 -12.163
  513    HA   GLU  64           HA       GLU  64   5.850   0.276 -11.873
  514   1HB   GLU  64          1HB       GLU  64   5.657  -2.666 -11.103
  515   2HB   GLU  64          2HB       GLU  64   4.275  -1.589 -11.123
  516   1HG   GLU  64          1HG       GLU  64   4.533  -1.171 -13.512
  517   2HG   GLU  64          2HG       GLU  64   6.083  -1.986 -13.548
  518    H    ALA  65           H        ALA  65   7.654  -1.582  -9.404
  519    HA   ALA  65           HA       ALA  65   6.126  -0.781  -7.192
  520   1HB   ALA  65          1HB       ALA  65   7.524  -2.255  -6.236
  521   2HB   ALA  65          2HB       ALA  65   8.433  -2.355  -7.764
  522   3HB   ALA  65          3HB       ALA  65   8.904  -1.168  -6.524
  523    H    THR  66           H        THR  66   9.463   0.351  -8.093
  524    HA   THR  66           HA       THR  66   9.506   2.553  -6.463
  525    HB   THR  66           HB       THR  66  11.250   1.362  -8.137
  526    HG1  THR  66           HG1      THR  66  12.312   2.912  -6.971
  527   1HG2  THR  66          1HG2      THR  66  10.223   2.237 -10.239
  528   2HG2  THR  66          2HG2      THR  66  10.342   3.895  -9.603
  529   3HG2  THR  66          3HG2      THR  66  11.820   2.973  -9.968
  530    H    LYS  67           H        LYS  67   7.628   2.053  -9.382
  531    HA   LYS  67           HA       LYS  67   7.184   4.886  -9.726
  532   1HB   LYS  67          1HB       LYS  67   7.395   3.437 -11.684
  533   2HB   LYS  67          2HB       LYS  67   6.041   2.463 -11.147
  534   1HG   LYS  67          1HG       LYS  67   4.506   4.368 -11.357
  535   2HG   LYS  67          2HG       LYS  67   5.834   5.460 -11.694
  536   1HD   LYS  67          1HD       LYS  67   5.784   4.939 -13.902
  537   2HD   LYS  67          2HD       LYS  67   5.960   3.231 -13.552
  538   1HE   LYS  67          1HE       LYS  67   3.831   2.976 -14.312
  539   2HE   LYS  67          2HE       LYS  67   3.304   3.735 -12.823
  540   1HZ   LYS  67          1HZ       LYS  67   2.966   5.691 -13.861
  541   2HZ   LYS  67          2HZ       LYS  67   4.150   5.484 -14.966
  542   3HZ   LYS  67          3HZ       LYS  67   2.719   4.720 -15.150
  543    H    ALA  68           H        ALA  68   5.565   1.996  -8.364
  544    HA   ALA  68           HA       ALA  68   3.054   3.190  -8.005
  545   1HB   ALA  68          1HB       ALA  68   2.646   1.292  -6.529
  546   2HB   ALA  68          2HB       ALA  68   3.564   0.742  -7.951
  547   3HB   ALA  68          3HB       ALA  68   4.393   0.980  -6.394
  548    H    GLU  69           H        GLU  69   6.111   3.268  -6.168
  549    HA   GLU  69           HA       GLU  69   4.847   4.454  -3.906
  550   1HB   GLU  69          1HB       GLU  69   7.129   4.587  -2.990
  551   2HB   GLU  69          2HB       GLU  69   6.829   2.993  -3.653
  552   1HG   GLU  69          1HG       GLU  69   7.991   3.665  -5.773
  553   2HG   GLU  69          2HG       GLU  69   8.305   5.249  -5.093
  554    H    ALA  70           H        ALA  70   6.761   5.498  -6.758
  555    HA   ALA  70           HA       ALA  70   7.318   8.088  -5.986
  556   1HB   ALA  70          1HB       ALA  70   8.180   6.848  -7.998
  557   2HB   ALA  70          2HB       ALA  70   6.599   7.103  -8.775
  558   3HB   ALA  70          3HB       ALA  70   7.621   8.499  -8.358
  559    H    ALA  71           H        ALA  71   4.539   6.966  -8.055
  560    HA   ALA  71           HA       ALA  71   3.212   9.397  -8.044
  561   1HB   ALA  71          1HB       ALA  71   2.898   6.953  -9.234
  562   2HB   ALA  71          2HB       ALA  71   1.547   6.941  -8.075
  563   3HB   ALA  71          3HB       ALA  71   1.680   8.250  -9.274
  564    H    PHE  72           H        PHE  72   3.050   6.591  -5.780
  565    HA   PHE  72           HA       PHE  72   0.931   7.605  -4.256
  566   1HB   PHE  72          1HB       PHE  72   1.519   5.278  -4.043
  567   2HB   PHE  72          2HB       PHE  72   3.233   5.631  -3.951
  568    HD1  PHE  72           HD1      PHE  72   0.212   5.083  -2.086
  569    HD2  PHE  72           HD2      PHE  72   4.152   6.639  -1.826
  570    HE1  PHE  72           HE1      PHE  72   0.109   4.927   0.417
  571    HE2  PHE  72           HE2      PHE  72   4.048   6.484   0.677
  572    HZ   PHE  72           HZ       PHE  72   2.028   5.630   1.769
  573    H    LYS  73           H        LYS  73   4.112   8.776  -4.655
  574    HA   LYS  73           HA       LYS  73   4.345   9.735  -1.929
  575   1HB   LYS  73          1HB       LYS  73   6.179   8.955  -3.847
  576   2HB   LYS  73          2HB       LYS  73   6.284  10.703  -3.910
  577   1HG   LYS  73          1HG       LYS  73   6.155  10.139  -1.151
  578   2HG   LYS  73          2HG       LYS  73   7.165   8.858  -1.791
  579   1HD   LYS  73          1HD       LYS  73   8.906  10.299  -1.934
  580   2HD   LYS  73          2HD       LYS  73   8.008  11.274  -3.081
  581   1HE   LYS  73          1HE       LYS  73   7.290  11.584  -0.175
  582   2HE   LYS  73          2HE       LYS  73   8.835  12.237  -0.684
  583   1HZ   LYS  73          1HZ       LYS  73   7.008  13.809  -0.900
  584   2HZ   LYS  73          2HZ       LYS  73   7.724  13.522  -2.339
  585   3HZ   LYS  73          3HZ       LYS  73   6.278  12.845  -1.998
  586    H    LYS  74           H        LYS  74   3.210  10.751  -5.105
  587    HA   LYS  74           HA       LYS  74   3.164  13.534  -4.241
  588   1HB   LYS  74          1HB       LYS  74   2.981  12.105  -6.861
  589   2HB   LYS  74          2HB       LYS  74   2.156  13.644  -6.712
  590   1HG   LYS  74          1HG       LYS  74   4.149  14.663  -7.077
  591   2HG   LYS  74          2HG       LYS  74   4.660  14.102  -5.498
  592   1HD   LYS  74          1HD       LYS  74   5.270  11.860  -6.709
  593   2HD   LYS  74          2HD       LYS  74   5.126  12.777  -8.195
  594   1HE   LYS  74          1HE       LYS  74   6.880  13.723  -5.889
  595   2HE   LYS  74          2HE       LYS  74   7.483  12.630  -7.119
  596   1HZ   LYS  74          1HZ       LYS  74   7.212  14.227  -8.743
  597   2HZ   LYS  74          2HZ       LYS  74   6.174  15.134  -7.868
  598   3HZ   LYS  74          3HZ       LYS  74   7.760  15.103  -7.478
  599    H    LEU  75           H        LEU  75   0.957  10.900  -5.395
  600    HA   LEU  75           HA       LEU  75  -1.402  12.307  -5.138
  601   1HB   LEU  75          1HB       LEU  75  -0.957   9.358  -4.659
  602   2HB   LEU  75          2HB       LEU  75  -2.475  10.135  -5.061
  603    HG   LEU  75           HG       LEU  75  -0.055  10.138  -6.881
  604   1HD1  LEU  75          1HD1      LEU  75  -1.793   8.498  -8.132
  605   2HD1  LEU  75          2HD1      LEU  75  -0.493   7.932  -7.056
  606   3HD1  LEU  75          3HD1      LEU  75  -2.153   8.095  -6.436
  607   1HD2  LEU  75          1HD2      LEU  75  -2.558  11.549  -6.930
  608   2HD2  LEU  75          2HD2      LEU  75  -1.185  11.639  -8.058
  609   3HD2  LEU  75          3HD2      LEU  75  -2.469  10.434  -8.314
  610    H    THR  76           H        THR  76  -3.157  11.876  -3.439
  611    HA   THR  76           HA       THR  76  -1.901  11.869  -0.773
  612    HB   THR  76           HB       THR  76  -2.668  14.136  -1.505
  613    HG1  THR  76           HG1      THR  76  -3.332  14.214   0.604
  614   1HG2  THR  76          1HG2      THR  76  -5.522  13.635  -1.231
  615   2HG2  THR  76          2HG2      THR  76  -4.667  14.445  -2.565
  616   3HG2  THR  76          3HG2      THR  76  -4.887  12.679  -2.591
  617    H    ARG  77           H        ARG  77  -4.107  11.752   0.832
  618    HA   ARG  77           HA       ARG  77  -4.650   9.066   0.768
  619   1HB   ARG  77          1HB       ARG  77  -6.335   9.577   2.537
  620   2HB   ARG  77          2HB       ARG  77  -4.844  10.456   2.810
  621   1HG   ARG  77          1HG       ARG  77  -6.162  12.285   1.263
  622   2HG   ARG  77          2HG       ARG  77  -7.539  11.488   1.999
  623   1HD   ARG  77          1HD       ARG  77  -6.928  12.135   4.185
  624   2HD   ARG  77          2HD       ARG  77  -5.232  12.306   3.777
  625    HE   ARG  77           HE       ARG  77  -5.641  14.510   3.109
  626   1HH1  ARG  77          1HH1      ARG  77  -8.694  12.764   3.230
  627   2HH1  ARG  77          2HH1      ARG  77  -9.658  14.175   2.946
  628   1HH2  ARG  77          1HH2      ARG  77  -6.913  16.371   2.734
  629   2HH2  ARG  77          2HH2      ARG  77  -8.638  16.240   2.662
  630    H    LYS  78           H        LYS  78  -5.913  11.592  -1.182
  631    HA   LYS  78           HA       LYS  78  -8.477  10.282  -1.584
  632   1HB   LYS  78          1HB       LYS  78  -7.695  12.934  -1.550
  633   2HB   LYS  78          2HB       LYS  78  -7.819  12.600  -3.266
  634   1HG   LYS  78          1HG       LYS  78 -10.036  13.134  -2.840
  635   2HG   LYS  78          2HG       LYS  78 -10.108  11.408  -2.540
  636   1HD   LYS  78          1HD       LYS  78  -9.244  12.656  -0.096
  637   2HD   LYS  78          2HD       LYS  78 -10.607  13.581  -0.692
  638   1HE   LYS  78          1HE       LYS  78 -10.699  10.540  -0.560
  639   2HE   LYS  78          2HE       LYS  78 -11.109  11.524   0.831
  640   1HZ   LYS  78          1HZ       LYS  78 -12.515  12.679  -1.122
  641   2HZ   LYS  78          2HZ       LYS  78 -12.577  11.112  -1.578
  642   3HZ   LYS  78          3HZ       LYS  78 -13.108  11.554  -0.098
  643    H    GLN  79           H        GLN  79  -6.075  11.706  -3.900
  644    HA   GLN  79           HA       GLN  79  -6.746  10.314  -6.052
  645   1HB   GLN  79          1HB       GLN  79  -4.087  11.308  -5.039
  646   2HB   GLN  79          2HB       GLN  79  -4.107  10.351  -6.507
  647   1HG   GLN  79          1HG       GLN  79  -5.047  12.035  -7.734
  648   2HG   GLN  79          2HG       GLN  79  -6.222  12.412  -6.490
  649   1HE2  GLN  79          1HE2      GLN  79  -5.961  14.604  -6.709
  650   2HE2  GLN  79          2HE2      GLN  79  -4.566  15.468  -6.153
  651    H    LYS  80           H        LYS  80  -4.804   9.112  -3.285
  652    HA   LYS  80           HA       LYS  80  -3.990   6.716  -4.491
  653   1HB   LYS  80          1HB       LYS  80  -4.191   7.739  -1.673
  654   2HB   LYS  80          2HB       LYS  80  -3.840   6.045  -1.954
  655   1HG   LYS  80          1HG       LYS  80  -1.704   6.498  -2.592
  656   2HG   LYS  80          2HG       LYS  80  -2.226   7.729  -3.724
  657   1HD   LYS  80          1HD       LYS  80  -1.875   9.448  -2.233
  658   2HD   LYS  80          2HD       LYS  80  -2.467   8.526  -0.866
  659   1HE   LYS  80          1HE       LYS  80   0.085   7.493  -1.992
  660   2HE   LYS  80          2HE       LYS  80   0.203   9.120  -1.352
  661   1HZ   LYS  80          1HZ       LYS  80  -0.802   8.299   0.692
  662   2HZ   LYS  80          2HZ       LYS  80  -0.830   6.780   0.093
  663   3HZ   LYS  80          3HZ       LYS  80   0.598   7.527   0.358
  664    H    GLU  81           H        GLU  81  -6.786   7.515  -2.323
  665    HA   GLU  81           HA       GLU  81  -7.841   5.047  -2.107
  666   1HB   GLU  81          1HB       GLU  81  -8.686   7.101  -0.973
  667   2HB   GLU  81          2HB       GLU  81  -9.374   7.658  -2.486
  668   1HG   GLU  81          1HG       GLU  81 -11.264   6.533  -1.917
  669   2HG   GLU  81          2HG       GLU  81 -10.388   5.054  -2.257
  670    H    GLN  82           H        GLN  82  -8.618   7.477  -4.703
  671    HA   GLN  82           HA       GLN  82 -10.222   5.665  -6.110
  672   1HB   GLN  82          1HB       GLN  82  -9.967   8.335  -6.180
  673   2HB   GLN  82          2HB       GLN  82  -8.875   7.972  -7.501
  674   1HG   GLN  82          1HG       GLN  82 -10.737   7.893  -8.811
  675   2HG   GLN  82          2HG       GLN  82 -11.030   6.322  -8.091
  676   1HE2  GLN  82          1HE2      GLN  82 -12.555   6.057  -6.502
  677   2HE2  GLN  82          2HE2      GLN  82 -13.750   7.246  -6.106
  678    H    TYR  83           H        TYR  83  -6.829   6.863  -6.589
  679    HA   TYR  83           HA       TYR  83  -6.085   5.729  -8.871
  680   1HB   TYR  83          1HB       TYR  83  -4.489   6.882  -7.442
  681   2HB   TYR  83          2HB       TYR  83  -4.857   5.855  -6.071
  682    HD1  TYR  83           HD1      TYR  83  -4.046   4.749  -9.543
  683    HD2  TYR  83           HD2      TYR  83  -2.719   5.043  -5.486
  684    HE1  TYR  83           HE1      TYR  83  -2.033   3.294 -10.088
  685    HE2  TYR  83           HE2      TYR  83  -0.711   3.587  -6.045
  686    HH   TYR  83           HH       TYR  83  -0.142   2.502  -9.372
  687    H    LEU  84           H        LEU  84  -6.642   3.956  -5.785
  688    HA   LEU  84           HA       LEU  84  -5.914   1.467  -7.088
  689   1HB   LEU  84          1HB       LEU  84  -6.667   2.189  -4.257
  690   2HB   LEU  84          2HB       LEU  84  -6.405   0.541  -4.793
  691    HG   LEU  84           HG       LEU  84  -4.098   1.730  -5.652
  692   1HD1  LEU  84          1HD1      LEU  84  -3.391   2.976  -3.451
  693   2HD1  LEU  84          2HD1      LEU  84  -4.229   3.842  -4.761
  694   3HD1  LEU  84          3HD1      LEU  84  -5.135   3.306  -3.326
  695   1HD2  LEU  84          1HD2      LEU  84  -4.934  -0.062  -3.536
  696   2HD2  LEU  84          2HD2      LEU  84  -3.461  -0.080  -4.534
  697   3HD2  LEU  84          3HD2      LEU  84  -3.516   0.896  -3.046
  698    H    LYS  85           H        LYS  85  -8.772   3.084  -5.570
  699    HA   LYS  85           HA       LYS  85 -10.594   1.074  -5.840
  700   1HB   LYS  85          1HB       LYS  85 -10.808   3.409  -4.785
  701   2HB   LYS  85          2HB       LYS  85 -11.246   3.974  -6.385
  702   1HG   LYS  85          1HG       LYS  85 -13.360   3.215  -6.098
  703   2HG   LYS  85          2HG       LYS  85 -12.764   1.580  -5.890
  704   1HD   LYS  85          1HD       LYS  85 -12.390   3.345  -3.515
  705   2HD   LYS  85          2HD       LYS  85 -14.063   3.034  -3.933
  706   1HE   LYS  85          1HE       LYS  85 -12.700   0.525  -4.162
  707   2HE   LYS  85          2HE       LYS  85 -12.144   1.252  -2.667
  708   1HZ   LYS  85          1HZ       LYS  85 -14.426   1.556  -2.018
  709   2HZ   LYS  85          2HZ       LYS  85 -14.965   0.925  -3.425
  710   3HZ   LYS  85          3HZ       LYS  85 -14.157  -0.017  -2.364
  711    H    THR  86           H        THR  86  -9.594   3.518  -8.317
  712    HA   THR  86           HA       THR  86 -11.330   2.784 -10.322
  713    HB   THR  86           HB       THR  86  -9.795   4.765 -10.313
  714    HG1  THR  86           HG1      THR  86 -10.658   3.756 -12.322
  715   1HG2  THR  86          1HG2      THR  86  -7.547   4.485 -10.025
  716   2HG2  THR  86          2HG2      THR  86  -7.767   2.720  -9.961
  717   3HG2  THR  86          3HG2      THR  86  -7.496   3.527 -11.524
  718    H    PHE  87           H        PHE  87  -8.462   1.084  -9.108
  719    HA   PHE  87           HA       PHE  87  -8.525  -0.722 -11.369
  720   1HB   PHE  87          1HB       PHE  87  -6.409   0.142 -10.226
  721   2HB   PHE  87          2HB       PHE  87  -6.923  -0.636  -8.742
  722    HD1  PHE  87           HD1      PHE  87  -5.287  -1.077 -11.917
  723    HD2  PHE  87           HD2      PHE  87  -7.065  -3.145  -8.665
  724    HE1  PHE  87           HE1      PHE  87  -4.113  -3.184 -12.614
  725    HE2  PHE  87           HE2      PHE  87  -5.892  -5.251  -9.363
  726    HZ   PHE  87           HZ       PHE  87  -4.430  -5.246 -11.329
  727    H    HIS  88           H        HIS  88  -9.319  -0.636  -7.862
  728    HA   HIS  88           HA       HIS  88  -9.746  -3.363  -7.557
  729   1HB   HIS  88          1HB       HIS  88  -9.507  -2.042  -5.621
  730   2HB   HIS  88          2HB       HIS  88 -10.750  -0.912  -6.119
  731    HD1  HIS  88           HD1      HIS  88 -13.210  -1.507  -5.596
  732    HD2  HIS  88           HD2      HIS  88 -10.478  -4.501  -4.517
  733    HE1  HIS  88           HE1      HIS  88 -14.504  -3.171  -4.158
  734    H    LEU  89           H        LEU  89 -11.999  -0.676  -8.461
  735    HA   LEU  89           HA       LEU  89 -14.352  -1.992  -8.516
  736   1HB   LEU  89          1HB       LEU  89 -13.316  -0.019 -10.557
  737   2HB   LEU  89          2HB       LEU  89 -14.999  -0.454 -10.330
  738    HG   LEU  89           HG       LEU  89 -13.452   0.622  -7.995
  739   1HD1  LEU  89          1HD1      LEU  89 -13.747   2.032 -10.472
  740   2HD1  LEU  89          2HD1      LEU  89 -14.763   2.807  -9.233
  741   3HD1  LEU  89          3HD1      LEU  89 -13.022   2.579  -8.941
  742   1HD2  LEU  89          1HD2      LEU  89 -15.890   1.740  -7.857
  743   2HD2  LEU  89          2HD2      LEU  89 -16.291   0.281  -8.794
  744   3HD2  LEU  89          3HD2      LEU  89 -15.512   0.129  -7.201
  745    H    GLU  90           H        GLU  90 -12.109  -1.776 -11.374
  746    HA   GLU  90           HA       GLU  90 -13.543  -3.894 -12.621
  747   1HB   GLU  90          1HB       GLU  90 -11.409  -1.969 -13.351
  748   2HB   GLU  90          2HB       GLU  90 -11.234  -3.536 -14.115
  749   1HG   GLU  90          1HG       GLU  90 -13.772  -3.324 -14.705
  750   2HG   GLU  90          2HG       GLU  90 -13.601  -1.633 -14.278
  751    H    HIS  91           H        HIS  91 -11.799  -5.589 -13.801
  752    HA   HIS  91           HA       HIS  91  -9.811  -6.465 -11.936
  753   1HB   HIS  91          1HB       HIS  91 -10.767  -8.664 -11.523
  754   2HB   HIS  91          2HB       HIS  91 -11.800  -7.399 -10.888
  755    HD1  HIS  91           HD1      HIS  91 -13.153 -10.029 -11.309
  756    HD2  HIS  91           HD2      HIS  91 -12.835  -7.182 -14.374
  757    HE1  HIS  91           HE1      HIS  91 -15.007 -10.565 -12.978
  758    H    HIS  92           H        HIS  92  -8.398  -6.106 -13.714
  759    HA   HIS  92           HA       HIS  92  -8.589  -8.223 -15.702
  760   1HB   HIS  92          1HB       HIS  92  -8.633  -5.284 -16.222
  761   2HB   HIS  92          2HB       HIS  92  -7.669  -6.278 -17.297
  762    HD1  HIS  92           HD1      HIS  92  -9.513  -8.782 -17.507
  763    HD2  HIS  92           HD2      HIS  92 -10.851  -4.815 -17.772
  764    HE1  HIS  92           HE1      HIS  92 -11.715  -8.855 -18.792
  765    H    HIS  93           H        HIS  93  -6.785  -9.410 -15.328
  766    HA   HIS  93           HA       HIS  93  -4.259  -8.328 -15.704
  767   1HB   HIS  93          1HB       HIS  93  -5.265  -7.964 -13.037
  768   2HB   HIS  93          2HB       HIS  93  -3.943  -9.114 -12.988
  769    HD1  HIS  93           HD1      HIS  93  -1.596  -8.256 -14.039
  770    HD2  HIS  93           HD2      HIS  93  -4.512  -5.320 -13.351
  771    HE1  HIS  93           HE1      HIS  93  -0.379  -6.013 -14.090
  772    H    HIS  94           H        HIS  94  -2.771  -9.994 -16.056
  773    HA   HIS  94           HA       HIS  94  -2.070 -12.039 -16.423
  774   1HB   HIS  94          1HB       HIS  94  -2.514 -12.031 -13.818
  775   2HB   HIS  94          2HB       HIS  94  -3.770 -13.182 -14.232
  776    HD1  HIS  94           HD1      HIS  94  -1.375 -14.096 -12.532
  777    HD2  HIS  94           HD2      HIS  94  -1.510 -14.397 -16.714
  778    HE1  HIS  94           HE1      HIS  94   0.277 -15.932 -13.170
  779    H    HIS  95           H        HIS  95  -2.597 -13.378 -18.089
  780    HA   HIS  95           HA       HIS  95  -3.805 -14.403 -19.607
  781   1HB   HIS  95          1HB       HIS  95  -5.026 -15.172 -17.045
  782   2HB   HIS  95          2HB       HIS  95  -6.101 -15.367 -18.415
  783    HD1  HIS  95           HD1      HIS  95  -5.960 -17.636 -19.427
  784    HD2  HIS  95           HD2      HIS  95  -2.294 -16.427 -17.785
  785    HE1  HIS  95           HE1      HIS  95  -4.341 -19.576 -19.786
  786    H    HIS  96           H        HIS  96  -6.209 -14.539 -20.615
  787    HA   HIS  96           HA       HIS  96  -7.911 -12.379 -20.069
  788   1HB   HIS  96          1HB       HIS  96  -5.734 -11.405 -21.269
  789   2HB   HIS  96          2HB       HIS  96  -6.576 -11.945 -22.708
  790    HD1  HIS  96           HD1      HIS  96  -6.332  -9.113 -20.460
  791    HD2  HIS  96           HD2      HIS  96  -9.356 -10.794 -22.832
  792    HE1  HIS  96           HE1      HIS  96  -8.105  -7.302 -20.746
  Start of MODEL    2
    1   1H    MET   1          1H        MET   1   0.856 -16.934  -2.087
    2    HA   MET   1           HA       MET   1  -1.881 -16.944  -1.920
    3   1HB   MET   1          1HB       MET   1  -0.494 -18.697   0.037
    4   2HB   MET   1          2HB       MET   1  -1.507 -17.501   0.822
    5   1HG   MET   1          1HG       MET   1  -3.450 -18.216  -0.581
    6   2HG   MET   1          2HG       MET   1  -2.440 -19.399  -1.387
    7   1HE   MET   1          1HE       MET   1  -4.909 -21.151   0.204
    8   2HE   MET   1          2HE       MET   1  -5.139 -20.199   1.689
    9   3HE   MET   1          3HE       MET   1  -5.071 -19.381   0.110
   10    H    GLU   2           H        GLU   2   1.057 -16.409   0.154
   11    HA   GLU   2           HA       GLU   2  -0.006 -13.781   0.767
   12   1HB   GLU   2          1HB       GLU   2   1.825 -15.697   2.116
   13   2HB   GLU   2          2HB       GLU   2   2.314 -14.020   2.244
   14   1HG   GLU   2          1HG       GLU   2  -0.575 -14.760   2.775
   15   2HG   GLU   2          2HG       GLU   2   0.626 -15.063   4.014
   16    H    ASN   3           H        ASN   3   2.327 -12.331   1.273
   17    HA   ASN   3           HA       ASN   3   3.370 -12.146  -1.429
   18   1HB   ASN   3          1HB       ASN   3   4.157  -9.977   0.395
   19   2HB   ASN   3          2HB       ASN   3   3.303  -9.872  -1.131
   20   1HD2  ASN   3          1HD2      ASN   3   1.007 -10.999  -0.931
   21   2HD2  ASN   3          2HD2      ASN   3   0.020 -10.399   0.361
   22    H    LYS   4           H        LYS   4   5.236 -13.460  -1.504
   23    HA   LYS   4           HA       LYS   4   7.143 -13.115   0.705
   24   1HB   LYS   4          1HB       LYS   4   6.237 -15.384   0.577
   25   2HB   LYS   4          2HB       LYS   4   6.694 -15.505  -1.109
   26   1HG   LYS   4          1HG       LYS   4   8.838 -16.043  -0.578
   27   2HG   LYS   4          2HG       LYS   4   8.990 -14.661   0.488
   28   1HD   LYS   4          1HD       LYS   4   8.708 -15.949   2.342
   29   2HD   LYS   4          2HD       LYS   4   7.251 -16.680   1.696
   30   1HE   LYS   4          1HE       LYS   4   8.623 -18.560   1.795
   31   2HE   LYS   4          2HE       LYS   4   8.968 -18.032   0.160
   32   1HZ   LYS   4          1HZ       LYS   4  10.697 -18.148   2.367
   33   2HZ   LYS   4          2HZ       LYS   4  11.056 -17.884   0.796
   34   3HZ   LYS   4          3HZ       LYS   4  10.674 -16.629   1.768
   35    H    LYS   5           H        LYS   5   9.219 -12.447   0.238
   36    HA   LYS   5           HA       LYS   5  10.825 -11.456  -0.908
   37   1HB   LYS   5          1HB       LYS   5  11.857 -12.883  -2.282
   38   2HB   LYS   5          2HB       LYS   5  10.504 -13.959  -1.995
   39   1HG   LYS   5          1HG       LYS   5   9.308 -12.931  -3.967
   40   2HG   LYS   5          2HG       LYS   5  10.716 -11.934  -4.273
   41   1HD   LYS   5          1HD       LYS   5  10.714 -14.989  -4.251
   42   2HD   LYS   5          2HD       LYS   5  10.672 -13.998  -5.697
   43   1HE   LYS   5          1HE       LYS   5  12.855 -12.928  -4.353
   44   2HE   LYS   5          2HE       LYS   5  12.956 -14.616  -3.896
   45   1HZ   LYS   5          1HZ       LYS   5  14.011 -13.830  -6.073
   46   2HZ   LYS   5          2HZ       LYS   5  13.208 -15.251  -6.062
   47   3HZ   LYS   5          3HZ       LYS   5  12.500 -13.918  -6.686
   48    H    SER   6           H        SER   6  11.363 -10.121  -2.968
   49    HA   SER   6           HA       SER   6  10.815  -8.671  -4.520
   50   1HB   SER   6          1HB       SER   6   7.841  -9.153  -4.216
   51   2HB   SER   6          2HB       SER   6   8.726  -8.642  -5.641
   52    HG   SER   6           HG       SER   6   9.590 -10.750  -5.875
   53    H    HIS   7           H        HIS   7   8.231  -7.038  -4.432
   54    HA   HIS   7           HA       HIS   7   8.438  -5.864  -1.783
   55   1HB   HIS   7          1HB       HIS   7   9.313  -4.598  -4.328
   56   2HB   HIS   7          2HB       HIS   7   8.375  -3.594  -3.242
   57    HD1  HIS   7           HD1      HIS   7  11.324  -2.909  -3.772
   58    HD2  HIS   7           HD2      HIS   7  10.030  -5.320  -0.594
   59    HE1  HIS   7           HE1      HIS   7  13.161  -2.806  -2.003
   60    H    TYR   8           H        TYR   8   6.412  -5.627  -0.989
   61    HA   TYR   8           HA       TYR   8   4.257  -5.263  -2.961
   62   1HB   TYR   8          1HB       TYR   8   4.811  -7.139  -0.732
   63   2HB   TYR   8          2HB       TYR   8   3.301  -6.294  -0.456
   64    HD1  TYR   8           HD1      TYR   8   1.349  -7.195  -1.338
   65    HD2  TYR   8           HD2      TYR   8   5.086  -8.140  -3.196
   66    HE1  TYR   8           HE1      TYR   8   0.167  -8.803  -2.914
   67    HE2  TYR   8           HE2      TYR   8   3.891  -9.745  -4.766
   68    HH   TYR   8           HH       TYR   8   1.864 -11.047  -4.803
   69    H    PHE   9           H        PHE   9   3.056  -3.434  -2.752
   70    HA   PHE   9           HA       PHE   9   3.663  -1.693  -0.542
   71   1HB   PHE   9          1HB       PHE   9   3.212  -1.271  -3.161
   72   2HB   PHE   9          2HB       PHE   9   1.524  -1.322  -2.690
   73    HD1  PHE   9           HD1      PHE   9   4.678   0.530  -2.326
   74    HD2  PHE   9           HD2      PHE   9   0.522   0.487  -1.469
   75    HE1  PHE   9           HE1      PHE   9   4.788   2.951  -1.675
   76    HE2  PHE   9           HE2      PHE   9   0.632   2.909  -0.818
   77    HZ   PHE   9           HZ       PHE   9   2.763   4.111  -0.928
   78    H    TYR  10           H        TYR  10   2.590  -1.803   1.369
   79    HA   TYR  10           HA       TYR  10  -0.231  -2.638   1.253
   80   1HB   TYR  10          1HB       TYR  10   0.245  -3.714   3.435
   81   2HB   TYR  10          2HB       TYR  10   1.481  -4.239   2.311
   82    HD1  TYR  10           HD1      TYR  10   3.783  -3.256   2.435
   83    HD2  TYR  10           HD2      TYR  10   0.791  -2.395   5.369
   84    HE1  TYR  10           HE1      TYR  10   5.578  -2.422   4.031
   85    HE2  TYR  10           HE2      TYR  10   2.596  -1.565   6.955
   86    HH   TYR  10           HH       TYR  10   6.010  -1.851   6.108
   87    H    VAL  11           H        VAL  11  -1.571  -0.966   1.697
   88    HA   VAL  11           HA       VAL  11  -0.508   1.253   3.253
   89    HB   VAL  11           HB       VAL  11  -2.768   0.819   1.346
   90   1HG1  VAL  11          1HG1      VAL  11  -3.636   3.113   1.998
   91   2HG1  VAL  11          2HG1      VAL  11  -3.992   1.794   3.140
   92   3HG1  VAL  11          3HG1      VAL  11  -2.688   2.954   3.495
   93   1HG2  VAL  11          1HG2      VAL  11  -1.879   2.805   0.288
   94   2HG2  VAL  11          2HG2      VAL  11  -0.778   3.091   1.657
   95   3HG2  VAL  11          3HG2      VAL  11  -0.544   1.672   0.608
   96    H    LEU  12           H        LEU  12  -1.773   2.159   5.056
   97    HA   LEU  12           HA       LEU  12  -3.771   0.411   6.199
   98   1HB   LEU  12          1HB       LEU  12  -2.414   0.542   8.418
   99   2HB   LEU  12          2HB       LEU  12  -2.121  -0.731   7.250
  100    HG   LEU  12           HG       LEU  12  -0.451   1.704   6.946
  101   1HD1  LEU  12          1HD1      LEU  12   0.580  -0.129   9.019
  102   2HD1  LEU  12          2HD1      LEU  12   0.703   1.640   8.876
  103   3HD1  LEU  12          3HD1      LEU  12  -0.783   0.898   9.519
  104   1HD2  LEU  12          1HD2      LEU  12   0.606  -1.087   7.099
  105   2HD2  LEU  12          2HD2      LEU  12  -0.410  -0.634   5.709
  106   3HD2  LEU  12          3HD2      LEU  12   1.086   0.270   6.051
  107    H    LEU  13           H        LEU  13  -5.389   1.699   6.886
  108    HA   LEU  13           HA       LEU  13  -4.758   4.512   7.299
  109   1HB   LEU  13          1HB       LEU  13  -6.501   4.300   5.803
  110   2HB   LEU  13          2HB       LEU  13  -7.218   2.942   6.649
  111    HG   LEU  13           HG       LEU  13  -7.168   5.666   7.932
  112   1HD1  LEU  13          1HD1      LEU  13  -9.599   5.770   6.925
  113   2HD1  LEU  13          2HD1      LEU  13  -8.196   6.368   6.008
  114   3HD1  LEU  13          3HD1      LEU  13  -8.877   4.763   5.647
  115   1HD2  LEU  13          1HD2      LEU  13  -8.711   3.116   8.276
  116   2HD2  LEU  13          2HD2      LEU  13  -7.890   4.127   9.489
  117   3HD2  LEU  13          3HD2      LEU  13  -9.430   4.667   8.776
  118    H    CYS  14           H        CYS  14  -5.230   5.630   9.233
  119    HA   CYS  14           HA       CYS  14  -5.529   3.827  11.513
  120   1HB   CYS  14          1HB       CYS  14  -3.518   5.573  11.086
  121   2HB   CYS  14          2HB       CYS  14  -4.633   6.642  11.914
  122    HG   CYS  14           HG       CYS  14  -4.121   5.915  14.099
  123    H    GLN  15           H        GLN  15  -6.674   5.069  13.462
  124    HA   GLN  15           HA       GLN  15  -9.265   5.485  12.755
  125   1HB   GLN  15          1HB       GLN  15  -7.598   6.088  15.173
  126   2HB   GLN  15          2HB       GLN  15  -9.169   6.860  15.092
  127   1HG   GLN  15          1HG       GLN  15  -9.062   3.929  14.422
  128   2HG   GLN  15          2HG       GLN  15  -8.816   4.366  16.102
  129   1HE2  GLN  15          1HE2      GLN  15 -10.980   2.884  15.168
  130   2HE2  GLN  15          2HE2      GLN  15 -12.449   3.770  15.404
  131    H    ASP  16           H        ASP  16  -6.689   7.953  13.408
  132    HA   ASP  16           HA       ASP  16  -8.200  10.180  13.174
  133   1HB   ASP  16          1HB       ASP  16  -5.817  10.203  13.792
  134   2HB   ASP  16          2HB       ASP  16  -5.359   9.654  12.192
  135    H    GLY  17           H        GLY  17  -7.169   7.853  10.722
  136   1HA   GLY  17          1HA       GLY  17  -8.248   7.664   8.654
  137   2HA   GLY  17          2HA       GLY  17  -8.614   9.377   8.670
  138    H    SER  18           H        SER  18  -5.411   7.991   9.510
  139    HA   SER  18           HA       SER  18  -4.243   9.655   7.513
  140   1HB   SER  18          1HB       SER  18  -3.241   7.901   9.747
  141   2HB   SER  18          2HB       SER  18  -2.119   8.310   8.464
  142    HG   SER  18           HG       SER  18  -1.913  10.266   9.298
  143    H    PHE  19           H        PHE  19  -2.216   8.454   6.296
  144    HA   PHE  19           HA       PHE  19  -3.092   5.844   5.349
  145   1HB   PHE  19          1HB       PHE  19  -2.701   8.447   3.782
  146   2HB   PHE  19          2HB       PHE  19  -2.506   6.902   2.977
  147    HD1  PHE  19           HD1      PHE  19  -4.959   8.827   5.012
  148    HD2  PHE  19           HD2      PHE  19  -4.360   5.836   2.062
  149    HE1  PHE  19           HE1      PHE  19  -7.436   8.717   4.619
  150    HE2  PHE  19           HE2      PHE  19  -6.835   5.727   1.668
  151    HZ   PHE  19           HZ       PHE  19  -8.344   7.170   2.951
  152    H    TYR  20           H        TYR  20  -1.317   4.634   5.879
  153    HA   TYR  20           HA       TYR  20   1.293   5.754   5.107
  154   1HB   TYR  20          1HB       TYR  20   0.335   5.084   7.624
  155   2HB   TYR  20          2HB       TYR  20   0.944   3.520   7.121
  156    HD1  TYR  20           HD1      TYR  20   3.421   3.808   5.889
  157    HD2  TYR  20           HD2      TYR  20   1.781   6.288   8.966
  158    HE1  TYR  20           HE1      TYR  20   5.765   4.502   6.588
  159    HE2  TYR  20           HE2      TYR  20   4.130   6.972   9.656
  160    HH   TYR  20           HH       TYR  20   6.245   6.730   9.318
  161    H    GLY  21           H        GLY  21   2.483   4.603   3.652
  162   1HA   GLY  21          1HA       GLY  21   1.581   1.838   3.087
  163   2HA   GLY  21          2HA       GLY  21   2.066   2.977   1.847
  164    H    GLY  22           H        GLY  22   3.141   0.275   3.221
  165   1HA   GLY  22          1HA       GLY  22   5.937   1.204   3.484
  166   2HA   GLY  22          2HA       GLY  22   5.254  -0.182   4.311
  167    H    TYR  23           H        TYR  23   7.595  -0.339   2.672
  168    HA   TYR  23           HA       TYR  23   6.577  -1.765   0.311
  169   1HB   TYR  23          1HB       TYR  23   9.068  -1.395  -0.361
  170   2HB   TYR  23          2HB       TYR  23   8.105   0.065  -0.247
  171    HD1  TYR  23           HD1      TYR  23  10.904  -1.808   1.147
  172    HD2  TYR  23           HD2      TYR  23   8.363   1.588   1.712
  173    HE1  TYR  23           HE1      TYR  23  12.564  -0.833   2.806
  174    HE2  TYR  23           HE2      TYR  23  10.033   2.551   3.368
  175    HH   TYR  23           HH       TYR  23  12.441   2.368   3.808
  176    H    THR  24           H        THR  24   6.192  -3.833   1.144
  177    HA   THR  24           HA       THR  24   8.484  -5.456   1.513
  178    HB   THR  24           HB       THR  24   7.645  -4.081   3.832
  179    HG1  THR  24           HG1      THR  24   9.234  -5.589   4.683
  180   1HG2  THR  24          1HG2      THR  24   6.693  -5.719   5.296
  181   2HG2  THR  24          2HG2      THR  24   5.698  -5.838   3.825
  182   3HG2  THR  24          3HG2      THR  24   6.974  -7.039   4.135
  183    H    THR  25           H        THR  25   7.748  -7.772   2.198
  184    HA   THR  25           HA       THR  25   5.079  -8.221   1.034
  185    HB   THR  25           HB       THR  25   6.055 -10.183  -0.112
  186    HG1  THR  25           HG1      THR  25   8.084 -10.836   0.567
  187   1HG2  THR  25          1HG2      THR  25   8.219  -8.819  -1.141
  188   2HG2  THR  25          2HG2      THR  25   6.546  -8.566  -1.695
  189   3HG2  THR  25          3HG2      THR  25   7.259  -7.471  -0.486
  190    H    GLU  26           H        GLU  26   3.691  -9.432   2.189
  191    HA   GLU  26           HA       GLU  26   2.927 -10.802   3.703
  192   1HB   GLU  26          1HB       GLU  26   5.619 -11.804   3.352
  193   2HB   GLU  26          2HB       GLU  26   5.200 -11.912   5.050
  194   1HG   GLU  26          1HG       GLU  26   2.863 -12.774   3.734
  195   2HG   GLU  26          2HG       GLU  26   4.157 -13.458   2.768
  196    HA   PRO  27           HA       PRO  27   4.024  -7.622   6.773
  197   1HB   PRO  27          1HB       PRO  27   1.654  -6.261   6.784
  198   2HB   PRO  27          2HB       PRO  27   3.031  -5.779   5.813
  199   1HG   PRO  27          1HG       PRO  27   0.531  -7.102   4.954
  200   2HG   PRO  27          2HG       PRO  27   1.709  -6.242   3.982
  201   1HD   PRO  27          1HD       PRO  27   1.391  -9.086   4.176
  202   2HD   PRO  27          2HD       PRO  27   2.641  -8.228   3.296
  203    H    GLU  28           H        GLU  28   1.740 -10.049   6.404
  204    HA   GLU  28           HA       GLU  28   0.315  -9.807   8.724
  205   1HB   GLU  28          1HB       GLU  28   0.923 -11.911   6.766
  206   2HB   GLU  28          2HB       GLU  28   0.697 -12.573   8.373
  207   1HG   GLU  28          1HG       GLU  28  -1.404 -10.844   8.337
  208   2HG   GLU  28          2HG       GLU  28  -1.268 -11.135   6.614
  209    H    ARG  29           H        ARG  29   3.322 -11.788   8.165
  210    HA   ARG  29           HA       ARG  29   3.577 -12.435  10.854
  211   1HB   ARG  29          1HB       ARG  29   5.752 -13.341  10.225
  212   2HB   ARG  29          2HB       ARG  29   4.648 -13.654   8.902
  213   1HG   ARG  29          1HG       ARG  29   5.513 -11.702   7.659
  214   2HG   ARG  29          2HG       ARG  29   6.537 -11.254   9.010
  215   1HD   ARG  29          1HD       ARG  29   6.936 -14.062   8.143
  216   2HD   ARG  29          2HD       ARG  29   7.286 -12.902   6.878
  217    HE   ARG  29           HE       ARG  29   8.516 -11.887   9.202
  218   1HH1  ARG  29          1HH1      ARG  29   8.764 -14.776   7.207
  219   2HH1  ARG  29          2HH1      ARG  29  10.439 -15.036   7.568
  220   1HH2  ARG  29          1HH2      ARG  29  10.726 -12.231   9.677
  221   2HH2  ARG  29          2HH2      ARG  29  11.562 -13.578   8.982
  222    H    ARG  30           H        ARG  30   4.719  -9.719   8.835
  223    HA   ARG  30           HA       ARG  30   6.659  -8.800  10.593
  224   1HB   ARG  30          1HB       ARG  30   6.273  -8.133   8.133
  225   2HB   ARG  30          2HB       ARG  30   4.978  -7.094   8.694
  226   1HG   ARG  30          1HG       ARG  30   6.633  -5.925  10.216
  227   2HG   ARG  30          2HG       ARG  30   7.910  -6.910   9.531
  228   1HD   ARG  30          1HD       ARG  30   7.657  -5.923   7.348
  229   2HD   ARG  30          2HD       ARG  30   6.099  -5.229   7.751
  230    HE   ARG  30           HE       ARG  30   7.862  -4.102   9.606
  231   1HH1  ARG  30          1HH1      ARG  30   7.656  -4.228   6.095
  232   2HH1  ARG  30          2HH1      ARG  30   8.449  -2.705   5.867
  233   1HH2  ARG  30          1HH2      ARG  30   8.910  -2.094   9.305
  234   2HH2  ARG  30          2HH2      ARG  30   9.168  -1.483   7.705
  235    H    LEU  31           H        LEU  31   3.152  -8.018  10.157
  236    HA   LEU  31           HA       LEU  31   2.970  -5.921  11.928
  237   1HB   LEU  31          1HB       LEU  31   1.278  -7.035  10.276
  238   2HB   LEU  31          2HB       LEU  31   0.795  -7.965  11.680
  239    HG   LEU  31           HG       LEU  31   0.509  -5.682  12.859
  240   1HD1  LEU  31          1HD1      LEU  31  -0.162  -3.875  11.189
  241   2HD1  LEU  31          2HD1      LEU  31   1.579  -4.177  11.403
  242   3HD1  LEU  31          3HD1      LEU  31   0.733  -4.819   9.975
  243   1HD2  LEU  31          1HD2      LEU  31  -1.656  -5.577  11.012
  244   2HD2  LEU  31          2HD2      LEU  31  -1.216  -7.285  11.252
  245   3HD2  LEU  31          3HD2      LEU  31  -1.618  -6.263  12.653
  246    H    THR  32           H        THR  32   2.152  -9.395  12.644
  247    HA   THR  32           HA       THR  32   1.890  -9.085  15.371
  248    HB   THR  32           HB       THR  32   1.180 -11.092  14.128
  249    HG1  THR  32           HG1      THR  32   1.842 -11.347  16.378
  250   1HG2  THR  32          1HG2      THR  32   2.851 -11.446  12.431
  251   2HG2  THR  32          2HG2      THR  32   4.177 -11.362  13.618
  252   3HG2  THR  32          3HG2      THR  32   3.094 -12.776  13.587
  253    H    GLU  33           H        GLU  33   4.853  -9.451  13.404
  254    HA   GLU  33           HA       GLU  33   6.598 -10.084  15.386
  255   1HB   GLU  33          1HB       GLU  33   6.714  -9.025  12.694
  256   2HB   GLU  33          2HB       GLU  33   7.897  -8.186  13.676
  257   1HG   GLU  33          1HG       GLU  33   9.153 -10.100  14.065
  258   2HG   GLU  33          2HG       GLU  33   7.755 -11.156  14.052
  259    H    HIS  34           H        HIS  34   6.268  -6.698  14.093
  260    HA   HIS  34           HA       HIS  34   7.575  -5.419  16.068
  261   1HB   HIS  34          1HB       HIS  34   7.026  -4.010  14.374
  262   2HB   HIS  34          2HB       HIS  34   5.431  -4.700  14.152
  263    HD1  HIS  34           HD1      HIS  34   3.646  -3.049  14.672
  264    HD2  HIS  34           HD2      HIS  34   7.004  -2.544  17.135
  265    HE1  HIS  34           HE1      HIS  34   3.112  -1.088  16.215
  266    H    ASN  35           H        ASN  35   4.103  -6.424  16.057
  267    HA   ASN  35           HA       ASN  35   3.246  -5.215  18.284
  268   1HB   ASN  35          1HB       ASN  35   2.588  -7.691  16.813
  269   2HB   ASN  35          2HB       ASN  35   2.196  -7.833  18.514
  270   1HD2  ASN  35          1HD2      ASN  35   1.320  -6.561  15.501
  271   2HD2  ASN  35          2HD2      ASN  35  -0.041  -5.598  15.972
  272    H    SER  36           H        SER  36   4.593  -8.611  18.151
  273    HA   SER  36           HA       SER  36   4.711  -9.094  20.793
  274   1HB   SER  36          1HB       SER  36   5.630 -10.329  18.471
  275   2HB   SER  36          2HB       SER  36   7.115 -10.050  19.358
  276    HG   SER  36           HG       SER  36   5.274 -10.973  21.127
  277    H    GLY  37           H        GLY  37   7.398  -7.709  18.756
  278   1HA   GLY  37          1HA       GLY  37   8.329  -5.641  19.924
  279   2HA   GLY  37          2HA       GLY  37   8.677  -6.751  21.235
  280    H    THR  38           H        THR  38  10.671  -5.243  19.776
  281    HA   THR  38           HA       THR  38  12.387  -7.424  19.043
  282    HB   THR  38           HB       THR  38  11.503  -5.363  16.952
  283    HG1  THR  38           HG1      THR  38  11.393  -8.290  17.132
  284   1HG2  THR  38          1HG2      THR  38  12.937  -7.627  15.891
  285   2HG2  THR  38          2HG2      THR  38  13.401  -5.910  15.807
  286   3HG2  THR  38          3HG2      THR  38  13.941  -6.912  17.177
  287    H    GLY  39           H        GLY  39  11.979  -3.831  18.713
  288   1HA   GLY  39          1HA       GLY  39  13.969  -3.273  20.638
  289   2HA   GLY  39          2HA       GLY  39  14.676  -3.202  19.036
  290    H    ALA  40           H        ALA  40  12.180  -1.831  21.200
  291    HA   ALA  40           HA       ALA  40  12.416   0.685  19.824
  292   1HB   ALA  40          1HB       ALA  40  10.301   0.838  18.929
  293   2HB   ALA  40          2HB       ALA  40  10.549  -0.916  18.752
  294   3HB   ALA  40          3HB       ALA  40   9.597  -0.286  20.117
  295    H    LYS  41           H        LYS  41  10.971   2.367  21.036
  296    HA   LYS  41           HA       LYS  41  10.869   1.578  23.866
  297   1HB   LYS  41          1HB       LYS  41  12.809   3.049  23.299
  298   2HB   LYS  41          2HB       LYS  41  11.685   4.283  22.764
  299   1HG   LYS  41          1HG       LYS  41  10.648   3.661  25.256
  300   2HG   LYS  41          2HG       LYS  41  12.360   3.405  25.529
  301   1HD   LYS  41          1HD       LYS  41  11.157   5.945  24.329
  302   2HD   LYS  41          2HD       LYS  41  11.629   5.765  26.007
  303   1HE   LYS  41          1HE       LYS  41  13.987   5.271  25.268
  304   2HE   LYS  41          2HE       LYS  41  13.500   5.517  23.602
  305   1HZ   LYS  41          1HZ       LYS  41  12.865   7.623  25.478
  306   2HZ   LYS  41          2HZ       LYS  41  14.436   7.444  25.069
  307   3HZ   LYS  41          3HZ       LYS  41  13.319   7.725  23.912
  308    H    TYR  42           H        TYR  42   9.066   2.238  25.056
  309    HA   TYR  42           HA       TYR  42   6.996   2.942  25.429
  310   1HB   TYR  42          1HB       TYR  42   8.277   4.906  23.768
  311   2HB   TYR  42          2HB       TYR  42   6.712   4.648  23.020
  312    HD1  TYR  42           HD1      TYR  42   8.052   7.064  24.683
  313    HD2  TYR  42           HD2      TYR  42   5.052   4.122  25.483
  314    HE1  TYR  42           HE1      TYR  42   6.979   8.614  26.388
  315    HE2  TYR  42           HE2      TYR  42   3.987   5.681  27.186
  316    HH   TYR  42           HH       TYR  42   4.169   8.593  27.320
  317    H    THR  43           H        THR  43   7.181   3.170  21.804
  318    HA   THR  43           HA       THR  43   4.684   1.780  21.567
  319    HB   THR  43           HB       THR  43   6.772   2.911  19.646
  320    HG1  THR  43           HG1      THR  43   5.419   4.583  20.174
  321   1HG2  THR  43          1HG2      THR  43   4.717   0.926  19.078
  322   2HG2  THR  43          2HG2      THR  43   4.249   2.486  18.359
  323   3HG2  THR  43          3HG2      THR  43   5.809   1.741  17.935
  324    H    ARG  44           H        ARG  44   5.582  -0.083  22.948
  325    HA   ARG  44           HA       ARG  44   7.134  -1.859  21.270
  326   1HB   ARG  44          1HB       ARG  44   6.679  -1.553  24.212
  327   2HB   ARG  44          2HB       ARG  44   6.814  -3.209  23.656
  328   1HG   ARG  44          1HG       ARG  44   8.930  -2.236  22.318
  329   2HG   ARG  44          2HG       ARG  44   8.871  -1.003  23.562
  330   1HD   ARG  44          1HD       ARG  44   8.591  -3.276  25.099
  331   2HD   ARG  44          2HD       ARG  44   9.580  -3.895  23.792
  332    HE   ARG  44           HE       ARG  44  11.366  -2.746  24.738
  333   1HH1  ARG  44          1HH1      ARG  44   8.407  -1.005  25.506
  334   2HH1  ARG  44          2HH1      ARG  44   9.216   0.222  26.424
  335   1HH2  ARG  44          1HH2      ARG  44  12.434  -1.129  25.948
  336   2HH2  ARG  44          2HH2      ARG  44  11.522   0.151  26.677
  337    H    LEU  45           H        LEU  45   4.235  -1.930  23.480
  338    HA   LEU  45           HA       LEU  45   3.181  -4.104  21.812
  339   1HB   LEU  45          1HB       LEU  45   3.357  -3.684  24.677
  340   2HB   LEU  45          2HB       LEU  45   1.702  -3.965  24.173
  341    HG   LEU  45           HG       LEU  45   2.777  -6.042  24.834
  342   1HD1  LEU  45          1HD1      LEU  45   1.832  -7.313  23.212
  343   2HD1  LEU  45          2HD1      LEU  45   1.193  -5.732  22.702
  344   3HD1  LEU  45          3HD1      LEU  45   2.620  -6.418  21.889
  345   1HD2  LEU  45          1HD2      LEU  45   4.860  -5.230  22.822
  346   2HD2  LEU  45          2HD2      LEU  45   5.060  -5.778  24.503
  347   3HD2  LEU  45          3HD2      LEU  45   4.604  -6.942  23.236
  348    H    ALA  46           H        ALA  46   3.124  -1.273  21.061
  349    HA   ALA  46           HA       ALA  46   0.864   0.090  21.718
  350   1HB   ALA  46          1HB       ALA  46   1.369   1.386  19.883
  351   2HB   ALA  46          2HB       ALA  46   2.893   0.473  20.003
  352   3HB   ALA  46          3HB       ALA  46   1.649  -0.021  18.830
  353    H    LYS  47           H        LYS  47  -1.214  -0.588  21.838
  354    HA   LYS  47           HA       LYS  47  -2.070  -2.602  19.891
  355   1HB   LYS  47          1HB       LYS  47  -2.780  -1.994  22.724
  356   2HB   LYS  47          2HB       LYS  47  -4.063  -2.587  21.687
  357   1HG   LYS  47          1HG       LYS  47  -2.601  -4.525  21.021
  358   2HG   LYS  47          2HG       LYS  47  -1.357  -3.942  22.108
  359   1HD   LYS  47          1HD       LYS  47  -2.453  -5.509  23.466
  360   2HD   LYS  47          2HD       LYS  47  -3.255  -4.026  23.941
  361   1HE   LYS  47          1HE       LYS  47  -4.907  -4.667  21.921
  362   2HE   LYS  47          2HE       LYS  47  -4.297  -6.281  22.225
  363   1HZ   LYS  47          1HZ       LYS  47  -6.291  -5.203  23.562
  364   2HZ   LYS  47          2HZ       LYS  47  -5.328  -6.364  24.190
  365   3HZ   LYS  47          3HZ       LYS  47  -5.065  -4.795  24.562
  366    H    ARG  48           H        ARG  48  -3.226   0.406  21.571
  367    HA   ARG  48           HA       ARG  48  -5.453   0.835  20.169
  368   1HB   ARG  48          1HB       ARG  48  -5.101   3.270  20.610
  369   2HB   ARG  48          2HB       ARG  48  -4.682   2.300  22.008
  370   1HG   ARG  48          1HG       ARG  48  -2.444   2.795  20.089
  371   2HG   ARG  48          2HG       ARG  48  -3.041   4.218  20.919
  372   1HD   ARG  48          1HD       ARG  48  -2.881   2.664  23.083
  373   2HD   ARG  48          2HD       ARG  48  -1.774   1.730  22.096
  374    HE   ARG  48           HE       ARG  48  -0.212   3.502  22.161
  375   1HH1  ARG  48          1HH1      ARG  48  -3.295   4.537  23.507
  376   2HH1  ARG  48          2HH1      ARG  48  -2.660   6.012  24.161
  377   1HH2  ARG  48          1HH2      ARG  48   0.626   5.445  23.024
  378   2HH2  ARG  48          2HH2      ARG  48  -0.414   6.531  23.884
  379    H    ARG  49           H        ARG  49  -5.786   2.723  18.444
  380    HA   ARG  49           HA       ARG  49  -5.490   3.505  16.449
  381   1HB   ARG  49          1HB       ARG  49  -2.703   3.210  17.381
  382   2HB   ARG  49          2HB       ARG  49  -2.822   3.071  15.638
  383   1HG   ARG  49          1HG       ARG  49  -2.688   5.372  15.758
  384   2HG   ARG  49          2HG       ARG  49  -4.423   5.226  15.952
  385   1HD   ARG  49          1HD       ARG  49  -3.160   4.887  18.548
  386   2HD   ARG  49          2HD       ARG  49  -2.537   6.346  17.802
  387    HE   ARG  49           HE       ARG  49  -5.439   6.123  17.554
  388   1HH1  ARG  49          1HH1      ARG  49  -2.823   7.140  19.677
  389   2HH1  ARG  49          2HH1      ARG  49  -3.805   8.257  20.564
  390   1HH2  ARG  49          1HH2      ARG  49  -6.735   7.597  18.725
  391   2HH2  ARG  49          2HH2      ARG  49  -6.046   8.518  20.019
  392    HA   PRO  50           HA       PRO  50  -5.762  -0.550  14.580
  393   1HB   PRO  50          1HB       PRO  50  -8.000  -0.061  13.089
  394   2HB   PRO  50          2HB       PRO  50  -8.056  -0.686  14.726
  395   1HG   PRO  50          1HG       PRO  50  -8.658   2.043  13.762
  396   2HG   PRO  50          2HG       PRO  50  -9.105   1.291  15.281
  397   1HD   PRO  50          1HD       PRO  50  -7.016   3.213  14.868
  398   2HD   PRO  50          2HD       PRO  50  -7.388   2.374  16.362
  399    H    VAL  51           H        VAL  51  -5.797  -1.413  12.298
  400    HA   VAL  51           HA       VAL  51  -4.884   0.642  10.448
  401    HB   VAL  51           HB       VAL  51  -2.990  -0.918   9.810
  402   1HG1  VAL  51          1HG1      VAL  51  -2.828   1.264  11.125
  403   2HG1  VAL  51          2HG1      VAL  51  -2.698   0.255  12.586
  404   3HG1  VAL  51          3HG1      VAL  51  -1.472   0.123  11.302
  405   1HG2  VAL  51          1HG2      VAL  51  -3.536  -2.949  10.893
  406   2HG2  VAL  51          2HG2      VAL  51  -2.141  -2.299  11.787
  407   3HG2  VAL  51          3HG2      VAL  51  -3.780  -2.144  12.462
  408    H    ILE  52           H        ILE  52  -6.315   0.446   8.802
  409    HA   ILE  52           HA       ILE  52  -7.140  -2.283   8.099
  410    HB   ILE  52           HB       ILE  52  -9.194  -1.467   7.427
  411   1HG1  ILE  52          1HG1      ILE  52  -8.128   1.371   7.487
  412   2HG1  ILE  52          2HG1      ILE  52  -8.277   0.395   6.039
  413   1HG2  ILE  52          1HG2      ILE  52  -8.920   0.549   9.582
  414   2HG2  ILE  52          2HG2      ILE  52 -10.074  -0.792   9.392
  415   3HG2  ILE  52          3HG2      ILE  52  -8.427  -1.113   9.985
  416   1HD1  ILE  52          1HD1      ILE  52 -10.738   0.518   7.718
  417   2HD1  ILE  52          2HD1      ILE  52 -10.247   2.055   6.965
  418   3HD1  ILE  52          3HD1      ILE  52 -10.559   0.627   5.950
  419    H    MET  53           H        MET  53  -6.693  -3.078   6.079
  420    HA   MET  53           HA       MET  53  -4.859  -1.550   4.538
  421   1HB   MET  53          1HB       MET  53  -5.902  -4.337   4.685
  422   2HB   MET  53          2HB       MET  53  -5.570  -3.822   3.044
  423   1HG   MET  53          1HG       MET  53  -3.431  -4.516   3.552
  424   2HG   MET  53          2HG       MET  53  -3.297  -2.908   4.237
  425   1HE   MET  53          1HE       MET  53  -1.648  -4.191   7.299
  426   2HE   MET  53          2HE       MET  53  -1.209  -4.474   5.598
  427   3HE   MET  53          3HE       MET  53  -1.870  -2.899   6.096
  428    H    ILE  54           H        ILE  54  -5.200  -0.474   2.595
  429    HA   ILE  54           HA       ILE  54  -7.649  -0.924   1.148
  430    HB   ILE  54           HB       ILE  54  -8.142   1.579   1.205
  431   1HG1  ILE  54          1HG1      ILE  54  -7.399   2.134   3.845
  432   2HG1  ILE  54          2HG1      ILE  54  -5.956   1.445   3.127
  433   1HG2  ILE  54          1HG2      ILE  54  -9.538  -0.223   2.207
  434   2HG2  ILE  54          2HG2      ILE  54  -8.663   0.007   3.741
  435   3HG2  ILE  54          3HG2      ILE  54  -9.640   1.333   3.067
  436   1HD1  ILE  54          1HD1      ILE  54  -5.745   3.149   1.547
  437   2HD1  ILE  54          2HD1      ILE  54  -7.492   3.488   1.526
  438   3HD1  ILE  54          3HD1      ILE  54  -6.494   4.048   2.889
  439    H    HIS  55           H        HIS  55  -4.984  -1.547   0.516
  440    HA   HIS  55           HA       HIS  55  -4.731  -0.467  -1.970
  441   1HB   HIS  55          1HB       HIS  55  -3.992   1.475  -0.091
  442   2HB   HIS  55          2HB       HIS  55  -2.469   0.837  -0.679
  443    HD1  HIS  55           HD1      HIS  55  -5.278   3.052  -1.616
  444    HD2  HIS  55           HD2      HIS  55  -2.117   1.101  -3.565
  445    HE1  HIS  55           HE1      HIS  55  -5.058   4.158  -3.905
  446    H    THR  56           H        THR  56  -4.070  -2.468  -2.657
  447    HA   THR  56           HA       THR  56  -1.581  -3.477  -1.443
  448    HB   THR  56           HB       THR  56  -2.606  -5.770  -2.100
  449    HG1  THR  56           HG1      THR  56  -4.320  -5.060  -3.436
  450   1HG2  THR  56          1HG2      THR  56  -3.924  -5.955  -0.096
  451   2HG2  THR  56          2HG2      THR  56  -2.703  -4.717   0.289
  452   3HG2  THR  56          3HG2      THR  56  -4.363  -4.231  -0.136
  453    H    GLU  57           H        GLU  57   0.114  -3.682  -2.770
  454    HA   GLU  57           HA       GLU  57  -0.477  -4.012  -5.590
  455   1HB   GLU  57          1HB       GLU  57   0.474  -1.576  -4.435
  456   2HB   GLU  57          2HB       GLU  57   1.833  -2.282  -5.287
  457   1HG   GLU  57          1HG       GLU  57   0.362  -2.566  -7.323
  458   2HG   GLU  57          2HG       GLU  57  -0.937  -1.762  -6.465
  459    H    LYS  58           H        LYS  58   1.471  -4.808  -6.838
  460    HA   LYS  58           HA       LYS  58   3.380  -6.146  -5.053
  461   1HB   LYS  58          1HB       LYS  58   3.222  -8.168  -6.317
  462   2HB   LYS  58          2HB       LYS  58   1.603  -7.713  -5.830
  463   1HG   LYS  58          1HG       LYS  58   2.395  -6.547  -8.436
  464   2HG   LYS  58          2HG       LYS  58   2.415  -8.298  -8.438
  465   1HD   LYS  58          1HD       LYS  58   0.156  -8.342  -8.578
  466   2HD   LYS  58          2HD       LYS  58   0.033  -7.493  -7.050
  467   1HE   LYS  58          1HE       LYS  58  -0.989  -5.888  -8.352
  468   2HE   LYS  58          2HE       LYS  58   0.663  -5.377  -8.636
  469   1HZ   LYS  58          1HZ       LYS  58   0.234  -5.752 -10.752
  470   2HZ   LYS  58          2HZ       LYS  58   0.234  -7.355 -10.443
  471   3HZ   LYS  58          3HZ       LYS  58  -1.170  -6.524 -10.446
  472    H    PHE  59           H        PHE  59   5.523  -6.289  -5.821
  473    HA   PHE  59           HA       PHE  59   6.009  -5.009  -8.402
  474   1HB   PHE  59          1HB       PHE  59   7.471  -4.480  -5.747
  475   2HB   PHE  59          2HB       PHE  59   7.821  -3.684  -7.268
  476    HD1  PHE  59           HD1      PHE  59   6.802  -2.735  -4.355
  477    HD2  PHE  59           HD2      PHE  59   5.067  -3.073  -8.213
  478    HE1  PHE  59           HE1      PHE  59   5.168  -0.919  -3.779
  479    HE2  PHE  59           HE2      PHE  59   3.433  -1.255  -7.637
  480    HZ   PHE  59           HZ       PHE  59   3.504  -0.200  -5.426
  481    H    GLU  60           H        GLU  60   6.747  -6.842  -9.464
  482    HA   GLU  60           HA       GLU  60   8.317  -8.762  -8.165
  483   1HB   GLU  60          1HB       GLU  60   8.421  -9.853 -10.290
  484   2HB   GLU  60          2HB       GLU  60   6.848  -9.083 -10.233
  485   1HG   GLU  60          1HG       GLU  60   8.316  -7.046 -11.330
  486   2HG   GLU  60          2HG       GLU  60   9.228  -8.421 -11.925
  487    H    THR  61           H        THR  61   9.006  -5.746  -9.889
  488    HA   THR  61           HA       THR  61  11.877  -6.263  -9.479
  489    HB   THR  61           HB       THR  61  12.108  -4.767 -11.588
  490    HG1  THR  61           HG1      THR  61   9.917  -4.003 -11.631
  491   1HG2  THR  61          1HG2      THR  61  11.191  -7.598 -11.449
  492   2HG2  THR  61          2HG2      THR  61  10.840  -6.798 -12.999
  493   3HG2  THR  61          3HG2      THR  61  12.516  -6.885 -12.403
  494    H    ARG  62           H        ARG  62  13.193  -4.297  -9.161
  495    HA   ARG  62           HA       ARG  62  11.937  -2.706  -7.236
  496   1HB   ARG  62          1HB       ARG  62  14.119  -1.587  -7.050
  497   2HB   ARG  62          2HB       ARG  62  14.378  -3.312  -7.223
  498   1HG   ARG  62          1HG       ARG  62  14.814  -3.016  -9.660
  499   2HG   ARG  62          2HG       ARG  62  14.512  -1.296  -9.518
  500   1HD   ARG  62          1HD       ARG  62  16.433  -1.056  -7.961
  501   2HD   ARG  62          2HD       ARG  62  16.710  -2.786  -8.002
  502    HE   ARG  62           HE       ARG  62  17.469  -0.858 -10.055
  503   1HH1  ARG  62          1HH1      ARG  62  16.633  -4.229  -9.487
  504   2HH1  ARG  62          2HH1      ARG  62  17.482  -4.808 -10.882
  505   1HH2  ARG  62          1HH2      ARG  62  18.588  -1.621 -11.896
  506   2HH2  ARG  62          2HH2      ARG  62  18.601  -3.314 -12.261
  507    H    SER  63           H        SER  63  12.470  -2.449 -10.716
  508    HA   SER  63           HA       SER  63  12.445   0.275 -11.017
  509   1HB   SER  63          1HB       SER  63  11.693  -2.076 -12.733
  510   2HB   SER  63          2HB       SER  63  11.200  -0.489 -13.289
  511    HG   SER  63           HG       SER  63  13.198  -0.216 -13.984
  512    H    GLU  64           H        GLU  64   9.660  -2.065 -11.227
  513    HA   GLU  64           HA       GLU  64   7.732  -0.112 -11.515
  514   1HB   GLU  64          1HB       GLU  64   7.808  -3.011 -10.839
  515   2HB   GLU  64          2HB       GLU  64   6.370  -2.171 -10.294
  516   1HG   GLU  64          1HG       GLU  64   6.247  -1.183 -12.705
  517   2HG   GLU  64          2HG       GLU  64   7.429  -2.400 -13.139
  518    H    ALA  65           H        ALA  65   9.035  -1.765  -8.574
  519    HA   ALA  65           HA       ALA  65   7.357  -0.887  -6.659
  520   1HB   ALA  65          1HB       ALA  65  10.333  -0.670  -6.223
  521   2HB   ALA  65          2HB       ALA  65   9.081  -1.364  -5.165
  522   3HB   ALA  65          3HB       ALA  65   9.613  -2.251  -6.614
  523    H    THR  66           H        THR  66  10.373   0.929  -7.592
  524    HA   THR  66           HA       THR  66   9.642   3.259  -6.233
  525    HB   THR  66           HB       THR  66  11.954   2.638  -6.958
  526    HG1  THR  66           HG1      THR  66  12.216   4.838  -7.061
  527   1HG2  THR  66          1HG2      THR  66  10.799   3.233  -9.731
  528   2HG2  THR  66          2HG2      THR  66  12.543   3.220  -9.374
  529   3HG2  THR  66          3HG2      THR  66  11.588   1.727  -9.206
  530    H    LYS  67           H        LYS  67   8.667   1.981  -9.378
  531    HA   LYS  67           HA       LYS  67   7.814   4.443 -10.450
  532   1HB   LYS  67          1HB       LYS  67   8.257   2.047 -11.513
  533   2HB   LYS  67          2HB       LYS  67   6.540   1.851 -11.232
  534   1HG   LYS  67          1HG       LYS  67   6.244   4.156 -12.392
  535   2HG   LYS  67          2HG       LYS  67   7.914   3.997 -12.901
  536   1HD   LYS  67          1HD       LYS  67   6.526   1.506 -13.453
  537   2HD   LYS  67          2HD       LYS  67   5.588   2.833 -14.109
  538   1HE   LYS  67          1HE       LYS  67   7.658   3.698 -15.260
  539   2HE   LYS  67          2HE       LYS  67   8.554   2.324 -14.646
  540   1HZ   LYS  67          1HZ       LYS  67   6.211   2.181 -16.412
  541   2HZ   LYS  67          2HZ       LYS  67   7.759   1.902 -16.846
  542   3HZ   LYS  67          3HZ       LYS  67   7.005   0.886 -15.813
  543    H    ALA  68           H        ALA  68   5.952   1.702  -8.952
  544    HA   ALA  68           HA       ALA  68   3.521   3.032  -8.905
  545   1HB   ALA  68          1HB       ALA  68   4.751   0.771  -7.315
  546   2HB   ALA  68          2HB       ALA  68   3.106   1.351  -6.962
  547   3HB   ALA  68          3HB       ALA  68   3.494   0.701  -8.573
  548    H    GLU  69           H        GLU  69   6.380   3.241  -6.803
  549    HA   GLU  69           HA       GLU  69   5.044   4.472  -4.668
  550   1HB   GLU  69          1HB       GLU  69   7.779   3.737  -5.395
  551   2HB   GLU  69          2HB       GLU  69   7.750   5.313  -4.630
  552   1HG   GLU  69          1HG       GLU  69   6.157   3.046  -3.404
  553   2HG   GLU  69          2HG       GLU  69   7.890   3.107  -3.152
  554    H    ALA  70           H        ALA  70   7.214   5.798  -7.276
  555    HA   ALA  70           HA       ALA  70   7.045   8.441  -6.650
  556   1HB   ALA  70          1HB       ALA  70   8.339   8.461  -8.485
  557   2HB   ALA  70          2HB       ALA  70   7.831   6.798  -8.869
  558   3HB   ALA  70          3HB       ALA  70   6.902   8.179  -9.499
  559    H    ALA  71           H        ALA  71   4.720   6.444  -8.570
  560    HA   ALA  71           HA       ALA  71   3.015   8.595  -9.187
  561   1HB   ALA  71          1HB       ALA  71   1.410   6.397  -9.296
  562   2HB   ALA  71          2HB       ALA  71   2.570   6.839 -10.573
  563   3HB   ALA  71          3HB       ALA  71   3.012   5.625  -9.349
  564    H    PHE  72           H        PHE  72   2.783   5.961  -6.688
  565    HA   PHE  72           HA       PHE  72   0.488   6.790  -5.480
  566   1HB   PHE  72          1HB       PHE  72   1.493   4.733  -4.767
  567   2HB   PHE  72          2HB       PHE  72   3.087   5.448  -4.650
  568    HD1  PHE  72           HD1      PHE  72   3.757   6.679  -2.654
  569    HD2  PHE  72           HD2      PHE  72  -0.084   4.898  -2.931
  570    HE1  PHE  72           HE1      PHE  72   3.460   6.933  -0.174
  571    HE2  PHE  72           HE2      PHE  72  -0.381   5.153  -0.451
  572    HZ   PHE  72           HZ       PHE  72   1.395   6.167   0.898
  573    H    LYS  73           H        LYS  73   3.885   7.799  -4.678
  574    HA   LYS  73           HA       LYS  73   3.200   9.484  -2.584
  575   1HB   LYS  73          1HB       LYS  73   5.547   8.903  -4.230
  576   2HB   LYS  73          2HB       LYS  73   5.481  10.583  -3.740
  577   1HG   LYS  73          1HG       LYS  73   4.893   8.460  -1.671
  578   2HG   LYS  73          2HG       LYS  73   6.558   8.716  -2.149
  579   1HD   LYS  73          1HD       LYS  73   6.644  10.869  -1.249
  580   2HD   LYS  73          2HD       LYS  73   4.937  11.169  -1.511
  581   1HE   LYS  73          1HE       LYS  73   4.371   9.591   0.348
  582   2HE   LYS  73          2HE       LYS  73   6.077   9.281   0.608
  583   1HZ   LYS  73          1HZ       LYS  73   5.587  10.935   2.096
  584   2HZ   LYS  73          2HZ       LYS  73   6.213  11.800   0.860
  585   3HZ   LYS  73          3HZ       LYS  73   4.596  11.748   1.084
  586    H    LYS  74           H        LYS  74   2.772   9.801  -6.047
  587    HA   LYS  74           HA       LYS  74   2.524  12.672  -5.915
  588   1HB   LYS  74          1HB       LYS  74   2.897  10.662  -7.962
  589   2HB   LYS  74          2HB       LYS  74   1.549  11.699  -8.379
  590   1HG   LYS  74          1HG       LYS  74   2.875  13.650  -8.414
  591   2HG   LYS  74          2HG       LYS  74   4.083  12.977  -7.338
  592   1HD   LYS  74          1HD       LYS  74   4.007  11.295  -9.667
  593   2HD   LYS  74          2HD       LYS  74   4.029  12.952 -10.235
  594   1HE   LYS  74          1HE       LYS  74   5.913  12.963  -8.149
  595   2HE   LYS  74          2HE       LYS  74   6.162  11.402  -8.907
  596   1HZ   LYS  74          1HZ       LYS  74   7.444  13.176  -9.933
  597   2HZ   LYS  74          2HZ       LYS  74   6.423  12.486 -11.003
  598   3HZ   LYS  74          3HZ       LYS  74   6.074  13.950 -10.369
  599    H    LEU  75           H        LEU  75   0.480   9.748  -5.899
  600    HA   LEU  75           HA       LEU  75  -1.942  11.141  -6.352
  601   1HB   LEU  75          1HB       LEU  75  -1.444   8.442  -5.088
  602   2HB   LEU  75          2HB       LEU  75  -2.989   9.046  -5.656
  603    HG   LEU  75           HG       LEU  75  -0.563   8.506  -7.391
  604   1HD1  LEU  75          1HD1      LEU  75  -1.319   6.392  -6.830
  605   2HD1  LEU  75          2HD1      LEU  75  -3.023   6.904  -6.748
  606   3HD1  LEU  75          3HD1      LEU  75  -2.220   6.732  -8.328
  607   1HD2  LEU  75          1HD2      LEU  75  -1.517   9.705  -8.992
  608   2HD2  LEU  75          2HD2      LEU  75  -2.993   8.718  -8.880
  609   3HD2  LEU  75          3HD2      LEU  75  -2.815  10.172  -7.868
  610    H    THR  76           H        THR  76  -3.669  11.535  -4.785
  611    HA   THR  76           HA       THR  76  -2.578  12.020  -2.090
  612    HB   THR  76           HB       THR  76  -2.972  14.094  -3.461
  613    HG1  THR  76           HG1      THR  76  -3.872  14.952  -1.595
  614   1HG2  THR  76          1HG2      THR  76  -5.888  14.017  -3.190
  615   2HG2  THR  76          2HG2      THR  76  -4.914  14.434  -4.620
  616   3HG2  THR  76          3HG2      THR  76  -5.329  12.735  -4.291
  617    H    ARG  77           H        ARG  77  -5.008  12.712  -0.850
  618    HA   ARG  77           HA       ARG  77  -5.891  10.174  -0.211
  619   1HB   ARG  77          1HB       ARG  77  -7.587  11.340   1.167
  620   2HB   ARG  77          2HB       ARG  77  -6.035  12.140   1.318
  621   1HG   ARG  77          1HG       ARG  77  -7.507  13.259  -0.942
  622   2HG   ARG  77          2HG       ARG  77  -8.507  13.299   0.497
  623   1HD   ARG  77          1HD       ARG  77  -6.151  14.176   1.574
  624   2HD   ARG  77          2HD       ARG  77  -5.937  14.740  -0.071
  625    HE   ARG  77           HE       ARG  77  -7.647  16.311   0.259
  626   1HH1  ARG  77          1HH1      ARG  77  -7.756  13.910   2.829
  627   2HH1  ARG  77          2HH1      ARG  77  -8.935  14.772   3.759
  628   1HH2  ARG  77          1HH2      ARG  77  -9.202  17.451   1.487
  629   2HH2  ARG  77          2HH2      ARG  77  -9.763  16.801   2.992
  630    H    LYS  78           H        LYS  78  -6.582  12.143  -2.923
  631    HA   LYS  78           HA       LYS  78  -9.286  11.133  -3.254
  632   1HB   LYS  78          1HB       LYS  78  -7.699  13.377  -4.295
  633   2HB   LYS  78          2HB       LYS  78  -8.641  12.566  -5.529
  634   1HG   LYS  78          1HG       LYS  78 -10.633  13.296  -4.667
  635   2HG   LYS  78          2HG       LYS  78 -10.153  12.961  -3.016
  636   1HD   LYS  78          1HD       LYS  78  -8.632  15.056  -3.192
  637   2HD   LYS  78          2HD       LYS  78  -9.489  15.428  -4.675
  638   1HE   LYS  78          1HE       LYS  78 -11.506  15.877  -3.572
  639   2HE   LYS  78          2HE       LYS  78 -11.147  14.798  -2.238
  640   1HZ   LYS  78          1HZ       LYS  78 -10.146  17.497  -2.698
  641   2HZ   LYS  78          2HZ       LYS  78 -10.843  16.875  -1.357
  642   3HZ   LYS  78          3HZ       LYS  78  -9.308  16.471  -1.742
  643    H    GLN  79           H        GLN  79  -6.481  11.406  -5.539
  644    HA   GLN  79           HA       GLN  79  -7.199   9.545  -7.275
  645   1HB   GLN  79          1HB       GLN  79  -4.491  10.333  -6.199
  646   2HB   GLN  79          2HB       GLN  79  -4.587   9.028  -7.364
  647   1HG   GLN  79          1HG       GLN  79  -4.440  10.763  -8.873
  648   2HG   GLN  79          2HG       GLN  79  -6.177  10.808  -8.646
  649   1HE2  GLN  79          1HE2      GLN  79  -4.015  12.846  -9.231
  650   2HE2  GLN  79          2HE2      GLN  79  -4.288  14.143  -8.117
  651    H    LYS  80           H        LYS  80  -5.409   8.887  -4.188
  652    HA   LYS  80           HA       LYS  80  -5.127   6.164  -4.509
  653   1HB   LYS  80          1HB       LYS  80  -5.253   8.016  -2.152
  654   2HB   LYS  80          2HB       LYS  80  -5.254   6.286  -1.874
  655   1HG   LYS  80          1HG       LYS  80  -3.041   6.116  -2.371
  656   2HG   LYS  80          2HG       LYS  80  -3.244   6.985  -3.880
  657   1HD   LYS  80          1HD       LYS  80  -2.821   9.082  -2.898
  658   2HD   LYS  80          2HD       LYS  80  -3.328   8.560  -1.304
  659   1HE   LYS  80          1HE       LYS  80  -1.073   6.932  -2.125
  660   2HE   LYS  80          2HE       LYS  80  -0.663   8.615  -2.384
  661   1HZ   LYS  80          1HZ       LYS  80  -0.140   8.296  -0.202
  662   2HZ   LYS  80          2HZ       LYS  80  -1.652   8.894  -0.048
  663   3HZ   LYS  80          3HZ       LYS  80  -1.389   7.289   0.101
  664    H    GLU  81           H        GLU  81  -7.805   7.985  -2.863
  665    HA   GLU  81           HA       GLU  81  -9.297   5.818  -2.182
  666   1HB   GLU  81          1HB       GLU  81  -9.702   8.221  -1.526
  667   2HB   GLU  81          2HB       GLU  81 -10.363   8.517  -3.121
  668   1HG   GLU  81          1HG       GLU  81 -12.318   7.352  -2.689
  669   2HG   GLU  81          2HG       GLU  81 -11.519   6.169  -1.674
  670    H    GLN  82           H        GLN  82  -8.729   7.231  -5.358
  671    HA   GLN  82           HA       GLN  82 -11.027   6.218  -6.589
  672   1HB   GLN  82          1HB       GLN  82  -8.870   7.861  -7.309
  673   2HB   GLN  82          2HB       GLN  82  -8.680   6.463  -8.347
  674   1HG   GLN  82          1HG       GLN  82 -10.183   7.604  -9.670
  675   2HG   GLN  82          2HG       GLN  82 -11.354   6.810  -8.637
  676   1HE2  GLN  82          1HE2      GLN  82 -12.229   7.931  -6.835
  677   2HE2  GLN  82          2HE2      GLN  82 -12.330   9.660  -6.808
  678    H    TYR  83           H        TYR  83  -7.643   4.994  -6.228
  679    HA   TYR  83           HA       TYR  83  -7.898   2.741  -7.826
  680   1HB   TYR  83          1HB       TYR  83  -5.755   3.565  -6.930
  681   2HB   TYR  83          2HB       TYR  83  -6.353   3.510  -5.284
  682    HD1  TYR  83           HD1      TYR  83  -4.853   1.597  -8.005
  683    HD2  TYR  83           HD2      TYR  83  -6.584   1.335  -4.101
  684    HE1  TYR  83           HE1      TYR  83  -3.855  -0.722  -7.710
  685    HE2  TYR  83           HE2      TYR  83  -5.578  -0.983  -3.819
  686    HH   TYR  83           HH       TYR  83  -3.730  -2.259  -4.694
  687    H    LEU  84           H        LEU  84  -8.765   3.305  -4.376
  688    HA   LEU  84           HA       LEU  84  -9.215   0.648  -3.698
  689   1HB   LEU  84          1HB       LEU  84 -10.072   3.310  -2.666
  690   2HB   LEU  84          2HB       LEU  84 -10.916   1.889  -2.079
  691    HG   LEU  84           HG       LEU  84  -9.205   2.373  -0.515
  692   1HD1  LEU  84          1HD1      LEU  84  -9.380  -0.071  -1.777
  693   2HD1  LEU  84          2HD1      LEU  84  -7.632   0.260  -1.794
  694   3HD1  LEU  84          3HD1      LEU  84  -8.524   0.263  -0.252
  695   1HD2  LEU  84          1HD2      LEU  84  -7.204   3.270  -0.958
  696   2HD2  LEU  84          2HD2      LEU  84  -6.856   2.103  -2.257
  697   3HD2  LEU  84          3HD2      LEU  84  -7.850   3.541  -2.594
  698    H    LYS  85           H        LYS  85 -11.470   3.167  -5.009
  699    HA   LYS  85           HA       LYS  85 -13.705   1.493  -5.055
  700   1HB   LYS  85          1HB       LYS  85 -13.210   4.151  -5.502
  701   2HB   LYS  85          2HB       LYS  85 -13.541   3.590  -7.130
  702   1HG   LYS  85          1HG       LYS  85 -15.618   2.384  -6.089
  703   2HG   LYS  85          2HG       LYS  85 -15.341   3.397  -4.686
  704   1HD   LYS  85          1HD       LYS  85 -15.196   5.265  -6.723
  705   2HD   LYS  85          2HD       LYS  85 -16.363   4.137  -7.383
  706   1HE   LYS  85          1HE       LYS  85 -17.963   4.644  -5.797
  707   2HE   LYS  85          2HE       LYS  85 -16.788   4.823  -4.510
  708   1HZ   LYS  85          1HZ       LYS  85 -17.360   6.778  -6.627
  709   2HZ   LYS  85          2HZ       LYS  85 -17.695   6.929  -5.036
  710   3HZ   LYS  85          3HZ       LYS  85 -16.145   6.938  -5.548
  711    H    THR  86           H        THR  86 -11.581   2.526  -7.825
  712    HA   THR  86           HA       THR  86 -12.567   0.985  -9.786
  713    HB   THR  86           HB       THR  86 -10.189   0.985 -10.652
  714    HG1  THR  86           HG1      THR  86  -8.620   1.212  -9.089
  715   1HG2  THR  86          1HG2      THR  86 -11.686   3.313  -9.770
  716   2HG2  THR  86          2HG2      THR  86  -9.952   3.598  -9.481
  717   3HG2  THR  86          3HG2      THR  86 -10.527   3.195 -11.117
  718    H    PHE  87           H        PHE  87 -10.731  -0.168  -6.961
  719    HA   PHE  87           HA       PHE  87 -10.505  -2.808  -8.079
  720   1HB   PHE  87          1HB       PHE  87  -9.081  -1.315  -6.277
  721   2HB   PHE  87          2HB       PHE  87 -10.165  -2.100  -5.145
  722    HD1  PHE  87           HD1      PHE  87  -9.353  -4.000  -4.143
  723    HD2  PHE  87           HD2      PHE  87  -8.075  -3.092  -8.087
  724    HE1  PHE  87           HE1      PHE  87  -7.872  -6.026  -4.129
  725    HE2  PHE  87           HE2      PHE  87  -6.593  -5.118  -8.072
  726    HZ   PHE  87           HZ       PHE  87  -6.510  -6.561  -6.095
  727    H    HIS  88           H        HIS  88 -12.412  -1.116  -5.514
  728    HA   HIS  88           HA       HIS  88 -13.673  -3.350  -4.500
  729   1HB   HIS  88          1HB       HIS  88 -13.618  -0.945  -3.630
  730   2HB   HIS  88          2HB       HIS  88 -14.932  -0.611  -4.742
  731    HD1  HIS  88           HD1      HIS  88 -14.609  -3.812  -2.694
  732    HD2  HIS  88           HD2      HIS  88 -16.964  -0.346  -2.881
  733    HE1  HIS  88           HE1      HIS  88 -16.539  -4.170  -1.064
  734    H    LEU  89           H        LEU  89 -14.473  -1.264  -7.325
  735    HA   LEU  89           HA       LEU  89 -16.970  -2.242  -7.894
  736   1HB   LEU  89          1HB       LEU  89 -14.752  -1.284  -9.699
  737   2HB   LEU  89          2HB       LEU  89 -16.367  -1.652 -10.274
  738    HG   LEU  89           HG       LEU  89 -15.762   0.405  -8.133
  739   1HD1  LEU  89          1HD1      LEU  89 -15.166   1.865  -9.690
  740   2HD1  LEU  89          2HD1      LEU  89 -15.229   0.569 -10.906
  741   3HD1  LEU  89          3HD1      LEU  89 -16.670   1.567 -10.595
  742   1HD2  LEU  89          1HD2      LEU  89 -18.215   0.826  -9.566
  743   2HD2  LEU  89          2HD2      LEU  89 -18.179  -0.831  -8.919
  744   3HD2  LEU  89          3HD2      LEU  89 -17.953   0.557  -7.827
  745    H    GLU  90           H        GLU  90 -13.890  -3.380  -9.460
  746    HA   GLU  90           HA       GLU  90 -15.254  -5.788 -10.195
  747   1HB   GLU  90          1HB       GLU  90 -13.378  -4.339 -11.478
  748   2HB   GLU  90          2HB       GLU  90 -12.302  -5.431 -10.631
  749   1HG   GLU  90          1HG       GLU  90 -14.201  -7.202 -11.573
  750   2HG   GLU  90          2HG       GLU  90 -14.215  -5.995 -12.844
  751    H    HIS  91           H        HIS  91 -15.626  -6.384  -7.843
  752    HA   HIS  91           HA       HIS  91 -13.379  -7.041  -6.257
  753   1HB   HIS  91          1HB       HIS  91 -15.659  -6.411  -5.422
  754   2HB   HIS  91          2HB       HIS  91 -16.248  -7.968  -5.969
  755    HD1  HIS  91           HD1      HIS  91 -13.196  -6.923  -3.870
  756    HD2  HIS  91           HD2      HIS  91 -16.401  -9.629  -3.822
  757    HE1  HIS  91           HE1      HIS  91 -12.939  -8.298  -1.735
  758    H    HIS  92           H        HIS  92 -15.914  -9.139  -7.817
  759    HA   HIS  92           HA       HIS  92 -15.856 -11.272  -8.382
  760   1HB   HIS  92          1HB       HIS  92 -14.175  -9.867  -9.997
  761   2HB   HIS  92          2HB       HIS  92 -13.092 -11.127  -9.439
  762    HD1  HIS  92           HD1      HIS  92 -16.420 -10.708 -11.248
  763    HD2  HIS  92           HD2      HIS  92 -13.452 -13.606 -10.620
  764    HE1  HIS  92           HE1      HIS  92 -16.983 -12.655 -12.798
  765    H    HIS  93           H        HIS  93 -15.652 -11.456  -5.833
  766    HA   HIS  93           HA       HIS  93 -13.262 -13.072  -5.325
  767   1HB   HIS  93          1HB       HIS  93 -13.878 -10.752  -4.055
  768   2HB   HIS  93          2HB       HIS  93 -14.715 -11.895  -3.021
  769    HD1  HIS  93           HD1      HIS  93 -13.213 -13.765  -1.838
  770    HD2  HIS  93           HD2      HIS  93 -11.102 -10.723  -3.808
  771    HE1  HIS  93           HE1      HIS  93 -10.811 -13.897  -0.988
  772    H    HIS  94           H        HIS  94 -13.561 -15.006  -4.035
  773    HA   HIS  94           HA       HIS  94 -16.210 -15.755  -3.296
  774   1HB   HIS  94          1HB       HIS  94 -15.140 -16.555  -5.909
  775   2HB   HIS  94          2HB       HIS  94 -15.621 -17.921  -4.923
  776    HD1  HIS  94           HD1      HIS  94 -16.977 -15.280  -7.086
  777    HD2  HIS  94           HD2      HIS  94 -18.435 -17.776  -4.047
  778    HE1  HIS  94           HE1      HIS  94 -19.520 -15.223  -7.275
  779    H    HIS  95           H        HIS  95 -16.206 -17.580  -1.879
  780    HA   HIS  95           HA       HIS  95 -13.497 -18.320  -1.064
  781   1HB   HIS  95          1HB       HIS  95 -15.371 -17.137   0.447
  782   2HB   HIS  95          2HB       HIS  95 -15.851 -18.804   0.701
  783    HD1  HIS  95           HD1      HIS  95 -12.533 -16.857   0.787
  784    HD2  HIS  95           HD2      HIS  95 -14.575 -19.887   2.847
  785    HE1  HIS  95           HE1      HIS  95 -11.042 -17.517   2.749
  786    H    HIS  96           H        HIS  96 -12.890 -20.485  -0.936
  787    HA   HIS  96           HA       HIS  96 -12.896 -22.550  -1.764
  788   1HB   HIS  96          1HB       HIS  96 -14.087 -22.502   0.562
  789   2HB   HIS  96          2HB       HIS  96 -15.525 -22.921  -0.348
  790    HD1  HIS  96           HD1      HIS  96 -12.793 -24.463   1.399
  791    HD2  HIS  96           HD2      HIS  96 -14.979 -25.386  -2.061
  792    HE1  HIS  96           HE1      HIS  96 -12.418 -26.948   0.959
  Start of MODEL    3
    1   1H    MET   1          1H        MET   1  -3.564 -13.247  -2.219
    2    HA   MET   1           HA       MET   1  -2.915 -11.361  -1.046
    3   1HB   MET   1          1HB       MET   1  -2.720 -13.934   0.596
    4   2HB   MET   1          2HB       MET   1  -2.663 -12.364   1.374
    5   1HG   MET   1          1HG       MET   1  -4.887 -11.799   0.666
    6   2HG   MET   1          2HG       MET   1  -4.917 -13.064  -0.547
    7   1HE   MET   1          1HE       MET   1  -7.031 -12.968   2.904
    8   2HE   MET   1          2HE       MET   1  -6.941 -12.300   1.256
    9   3HE   MET   1          3HE       MET   1  -7.640 -13.915   1.526
   10    H    GLU   2           H        GLU   2  -1.334 -10.908   1.139
   11    HA   GLU   2           HA       GLU   2   1.122 -10.421   0.001
   12   1HB   GLU   2          1HB       GLU   2   0.443 -10.602   2.969
   13   2HB   GLU   2          2HB       GLU   2   1.822  -9.764   2.286
   14   1HG   GLU   2          1HG       GLU   2   0.458  -7.930   2.279
   15   2HG   GLU   2          2HG       GLU   2  -0.232  -8.634   0.830
   16    H    ASN   3           H        ASN   3   3.112 -11.164   1.861
   17    HA   ASN   3           HA       ASN   3   4.453 -12.769   2.446
   18   1HB   ASN   3          1HB       ASN   3   2.149 -14.754   2.074
   19   2HB   ASN   3          2HB       ASN   3   3.613 -15.031   2.997
   20   1HD2  ASN   3          1HD2      ASN   3   2.284 -15.496   4.792
   21   2HD2  ASN   3          2HD2      ASN   3   1.582 -14.243   5.760
   22    H    LYS   4           H        LYS   4   5.810 -14.480   1.402
   23    HA   LYS   4           HA       LYS   4   6.495 -15.806  -0.269
   24   1HB   LYS   4          1HB       LYS   4   3.963 -16.216  -0.669
   25   2HB   LYS   4          2HB       LYS   4   4.129 -15.074  -1.987
   26   1HG   LYS   4          1HG       LYS   4   6.315 -17.040  -2.002
   27   2HG   LYS   4          2HG       LYS   4   4.750 -17.828  -2.056
   28   1HD   LYS   4          1HD       LYS   4   5.425 -15.491  -3.889
   29   2HD   LYS   4          2HD       LYS   4   5.822 -17.142  -4.321
   30   1HE   LYS   4          1HE       LYS   4   3.176 -17.416  -3.549
   31   2HE   LYS   4          2HE       LYS   4   3.165 -15.799  -4.226
   32   1HZ   LYS   4          1HZ       LYS   4   2.814 -17.172  -6.018
   33   2HZ   LYS   4          2HZ       LYS   4   4.413 -16.871  -6.142
   34   3HZ   LYS   4          3HZ       LYS   4   3.895 -18.298  -5.545
   35    H    LYS   5           H        LYS   5   7.055 -15.436  -2.824
   36    HA   LYS   5           HA       LYS   5   8.711 -13.247  -2.881
   37   1HB   LYS   5          1HB       LYS   5   7.585 -15.086  -4.971
   38   2HB   LYS   5          2HB       LYS   5   8.518 -13.689  -5.471
   39   1HG   LYS   5          1HG       LYS   5  10.265 -14.510  -3.668
   40   2HG   LYS   5          2HG       LYS   5   9.407 -16.035  -3.762
   41   1HD   LYS   5          1HD       LYS   5   9.789 -15.262  -6.462
   42   2HD   LYS   5          2HD       LYS   5  11.297 -14.852  -5.668
   43   1HE   LYS   5          1HE       LYS   5  11.740 -17.083  -5.038
   44   2HE   LYS   5          2HE       LYS   5  10.051 -17.547  -5.091
   45   1HZ   LYS   5          1HZ       LYS   5  10.093 -17.554  -7.412
   46   2HZ   LYS   5          2HZ       LYS   5  11.523 -16.770  -7.503
   47   3HZ   LYS   5          3HZ       LYS   5  11.471 -18.313  -6.972
   48    H    SER   6           H        SER   6   8.423 -11.667  -5.048
   49    HA   SER   6           HA       SER   6   7.430  -9.911  -5.852
   50   1HB   SER   6          1HB       SER   6   5.130  -9.932  -6.368
   51   2HB   SER   6          2HB       SER   6   5.526 -11.636  -6.253
   52    HG   SER   6           HG       SER   6   4.278 -11.851  -4.507
   53    H    HIS   7           H        HIS   7   7.079  -7.780  -5.101
   54    HA   HIS   7           HA       HIS   7   7.038  -7.537  -2.236
   55   1HB   HIS   7          1HB       HIS   7   7.298  -5.435  -4.403
   56   2HB   HIS   7          2HB       HIS   7   7.514  -5.161  -2.686
   57    HD1  HIS   7           HD1      HIS   7   9.456  -5.689  -5.615
   58    HD2  HIS   7           HD2      HIS   7   9.698  -7.107  -1.674
   59    HE1  HIS   7           HE1      HIS   7  11.859  -6.481  -5.286
   60    H    TYR   8           H        TYR   8   5.275  -7.060  -1.012
   61    HA   TYR   8           HA       TYR   8   2.849  -6.290  -2.482
   62   1HB   TYR   8          1HB       TYR   8   3.614  -7.936  -0.044
   63   2HB   TYR   8          2HB       TYR   8   2.067  -7.114   0.028
   64    HD1  TYR   8           HD1      TYR   8   3.987  -9.793  -1.591
   65    HD2  TYR   8           HD2      TYR   8   0.222  -7.766  -1.454
   66    HE1  TYR   8           HE1      TYR   8   2.912 -11.685  -2.908
   67    HE2  TYR   8           HE2      TYR   8  -0.840  -9.665  -2.770
   68    HH   TYR   8           HH       TYR   8   1.135 -12.352  -3.968
   69    H    PHE   9           H        PHE   9   1.902  -4.340  -2.083
   70    HA   PHE   9           HA       PHE   9   3.027  -2.809   0.151
   71   1HB   PHE   9          1HB       PHE   9   3.249  -2.110  -2.371
   72   2HB   PHE   9          2HB       PHE   9   1.516  -1.851  -2.346
   73    HD1  PHE   9           HD1      PHE   9   4.551  -0.239  -2.095
   74    HD2  PHE   9           HD2      PHE   9   0.751  -0.349  -0.211
   75    HE1  PHE   9           HE1      PHE   9   4.912   2.091  -1.231
   76    HE2  PHE   9           HE2      PHE   9   1.110   1.979   0.652
   77    HZ   PHE   9           HZ       PHE   9   3.187   3.172   0.132
   78    H    TYR  10           H        TYR  10   1.696  -2.530   1.873
   79    HA   TYR  10           HA       TYR  10  -1.196  -2.633   1.339
   80   1HB   TYR  10          1HB       TYR  10  -1.258  -3.475   3.718
   81   2HB   TYR  10          2HB       TYR  10  -0.212  -4.486   2.740
   82    HD1  TYR  10           HD1      TYR  10  -0.326  -1.972   5.426
   83    HD2  TYR  10           HD2      TYR  10   2.207  -4.499   3.078
   84    HE1  TYR  10           HE1      TYR  10   1.582  -1.590   7.061
   85    HE2  TYR  10           HE2      TYR  10   4.107  -4.108   4.722
   86    HH   TYR  10           HH       TYR  10   4.590  -3.379   6.769
   87    H    VAL  11           H        VAL  11  -2.354  -0.812   1.743
   88    HA   VAL  11           HA       VAL  11  -0.984   1.285   3.271
   89    HB   VAL  11           HB       VAL  11  -3.293   1.555   1.343
   90   1HG1  VAL  11          1HG1      VAL  11  -1.487   3.830   1.716
   91   2HG1  VAL  11          2HG1      VAL  11  -3.264   3.753   1.787
   92   3HG1  VAL  11          3HG1      VAL  11  -2.296   3.333   3.221
   93   1HG2  VAL  11          1HG2      VAL  11  -1.914   1.437  -0.409
   94   2HG2  VAL  11          2HG2      VAL  11  -0.773   2.579   0.343
   95   3HG2  VAL  11          3HG2      VAL  11  -0.652   0.837   0.696
   96    H    LEU  12           H        LEU  12  -1.544   0.643   5.383
   97    HA   LEU  12           HA       LEU  12  -4.381   0.258   5.915
   98   1HB   LEU  12          1HB       LEU  12  -3.772  -0.792   7.865
   99   2HB   LEU  12          2HB       LEU  12  -2.510  -1.270   6.747
  100    HG   LEU  12           HG       LEU  12  -1.527  -0.788   8.880
  101   1HD1  LEU  12          1HD1      LEU  12  -0.317  -0.113   6.789
  102   2HD1  LEU  12          2HD1      LEU  12  -0.875   1.552   7.075
  103   3HD1  LEU  12          3HD1      LEU  12   0.185   0.753   8.261
  104   1HD2  LEU  12          1HD2      LEU  12  -3.528   1.069   9.197
  105   2HD2  LEU  12          2HD2      LEU  12  -2.126   0.854  10.271
  106   3HD2  LEU  12          3HD2      LEU  12  -2.083   2.087   8.989
  107    H    LEU  13           H        LEU  13  -5.592   1.605   7.292
  108    HA   LEU  13           HA       LEU  13  -4.314   4.207   7.760
  109   1HB   LEU  13          1HB       LEU  13  -6.004   4.718   6.341
  110   2HB   LEU  13          2HB       LEU  13  -7.003   3.368   6.839
  111    HG   LEU  13           HG       LEU  13  -6.585   5.597   8.788
  112   1HD1  LEU  13          1HD1      LEU  13  -8.912   6.246   7.324
  113   2HD1  LEU  13          2HD1      LEU  13  -7.407   7.186   7.479
  114   3HD1  LEU  13          3HD1      LEU  13  -7.601   6.032   6.137
  115   1HD2  LEU  13          1HD2      LEU  13  -8.818   5.020   9.500
  116   2HD2  LEU  13          2HD2      LEU  13  -9.014   3.915   8.118
  117   3HD2  LEU  13          3HD2      LEU  13  -7.829   3.543   9.394
  118    H    CYS  14           H        CYS  14  -4.414   5.158   9.807
  119    HA   CYS  14           HA       CYS  14  -5.061   3.272  11.909
  120   1HB   CYS  14          1HB       CYS  14  -3.386   5.757  11.732
  121   2HB   CYS  14          2HB       CYS  14  -4.021   5.279  13.295
  122    HG   CYS  14           HG       CYS  14  -3.275   2.633  12.778
  123    H    GLN  15           H        GLN  15  -6.283   4.170  13.868
  124    HA   GLN  15           HA       GLN  15  -8.754   4.939  13.244
  125   1HB   GLN  15          1HB       GLN  15  -7.289   4.552  15.600
  126   2HB   GLN  15          2HB       GLN  15  -7.881   6.193  15.765
  127   1HG   GLN  15          1HG       GLN  15  -9.673   3.842  15.002
  128   2HG   GLN  15          2HG       GLN  15  -9.440   4.370  16.657
  129   1HE2  GLN  15          1HE2      GLN  15 -11.581   4.453  14.336
  130   2HE2  GLN  15          2HE2      GLN  15 -12.307   6.015  14.519
  131    H    ASP  16           H        ASP  16  -6.131   7.215  14.342
  132    HA   ASP  16           HA       ASP  16  -7.525   9.514  14.153
  133   1HB   ASP  16          1HB       ASP  16  -4.826   8.745  14.441
  134   2HB   ASP  16          2HB       ASP  16  -4.812   9.783  13.030
  135    H    GLY  17           H        GLY  17  -5.803   7.642  11.582
  136   1HA   GLY  17          1HA       GLY  17  -6.928   7.644   9.403
  137   2HA   GLY  17          2HA       GLY  17  -7.070   9.384   9.551
  138    H    SER  18           H        SER  18  -4.272   7.252  10.416
  139    HA   SER  18           HA       SER  18  -2.632   8.968   8.775
  140   1HB   SER  18          1HB       SER  18  -1.464   6.686  10.339
  141   2HB   SER  18          2HB       SER  18  -0.835   8.303  10.092
  142    HG   SER  18           HG       SER  18  -1.729   8.899  11.935
  143    H    PHE  19           H        PHE  19  -2.193   8.384   6.684
  144    HA   PHE  19           HA       PHE  19  -2.732   5.671   5.871
  145   1HB   PHE  19          1HB       PHE  19  -2.127   8.388   4.667
  146   2HB   PHE  19          2HB       PHE  19  -1.755   6.997   3.671
  147    HD1  PHE  19           HD1      PHE  19  -4.438   8.930   5.237
  148    HD2  PHE  19           HD2      PHE  19  -3.522   5.598   2.775
  149    HE1  PHE  19           HE1      PHE  19  -6.838   8.805   4.512
  150    HE2  PHE  19           HE2      PHE  19  -5.922   5.473   2.050
  151    HZ   PHE  19           HZ       PHE  19  -7.551   7.078   2.927
  152    H    TYR  20           H        TYR  20  -1.143   4.217   6.448
  153    HA   TYR  20           HA       TYR  20   1.618   5.002   5.798
  154   1HB   TYR  20          1HB       TYR  20   0.652   4.357   8.225
  155   2HB   TYR  20          2HB       TYR  20   0.662   2.719   7.604
  156    HD1  TYR  20           HD1      TYR  20   2.685   5.451   8.894
  157    HD2  TYR  20           HD2      TYR  20   2.828   1.637   6.962
  158    HE1  TYR  20           HE1      TYR  20   5.136   5.219   9.522
  159    HE2  TYR  20           HE2      TYR  20   5.281   1.416   7.598
  160    HH   TYR  20           HH       TYR  20   6.724   2.449   9.584
  161    H    GLY  21           H        GLY  21   2.669   3.875   4.227
  162   1HA   GLY  21          1HA       GLY  21   1.381   1.380   3.292
  163   2HA   GLY  21          2HA       GLY  21   2.183   2.540   2.252
  164    H    GLY  22           H        GLY  22   2.644  -0.453   3.131
  165   1HA   GLY  22          1HA       GLY  22   5.547  -0.123   3.564
  166   2HA   GLY  22          2HA       GLY  22   4.610  -1.279   4.489
  167    H    TYR  23           H        TYR  23   6.685  -1.075   1.940
  168    HA   TYR  23           HA       TYR  23   5.293  -3.129   0.369
  169   1HB   TYR  23          1HB       TYR  23   6.967  -2.400  -1.364
  170   2HB   TYR  23          2HB       TYR  23   6.094  -1.008  -0.757
  171    HD1  TYR  23           HD1      TYR  23   7.199   0.529   0.902
  172    HD2  TYR  23           HD2      TYR  23   9.335  -2.607  -1.072
  173    HE1  TYR  23           HE1      TYR  23   9.404   1.644   1.503
  174    HE2  TYR  23           HE2      TYR  23  11.533  -1.484  -0.465
  175    HH   TYR  23           HH       TYR  23  11.974   1.386   0.161
  176    H    THR  24           H        THR  24   5.778  -5.119   1.221
  177    HA   THR  24           HA       THR  24   8.436  -6.063   0.980
  178    HB   THR  24           HB       THR  24   8.247  -4.623   3.241
  179    HG1  THR  24           HG1      THR  24   9.763  -6.366   4.063
  180   1HG2  THR  24          1HG2      THR  24   7.252  -7.414   4.028
  181   2HG2  THR  24          2HG2      THR  24   7.769  -6.141   5.159
  182   3HG2  THR  24          3HG2      THR  24   6.304  -5.915   4.174
  183    H    THR  25           H        THR  25   8.499  -8.368   2.244
  184    HA   THR  25           HA       THR  25   6.005  -9.660   1.374
  185    HB   THR  25           HB       THR  25   7.568 -11.687   1.235
  186    HG1  THR  25           HG1      THR  25   9.873 -10.977   1.358
  187   1HG2  THR  25          1HG2      THR  25   7.184 -10.309  -0.825
  188   2HG2  THR  25          2HG2      THR  25   8.479  -9.202  -0.311
  189   3HG2  THR  25          3HG2      THR  25   8.866 -10.886  -0.739
  190    H    GLU  26           H        GLU  26   4.773 -10.871   2.730
  191    HA   GLU  26           HA       GLU  26   3.966 -11.606   4.607
  192   1HB   GLU  26          1HB       GLU  26   6.865 -12.045   5.448
  193   2HB   GLU  26          2HB       GLU  26   5.465 -12.800   6.182
  194   1HG   GLU  26          1HG       GLU  26   4.903 -13.907   4.025
  195   2HG   GLU  26          2HG       GLU  26   6.260 -13.115   3.248
  196    HA   PRO  27           HA       PRO  27   4.881  -7.659   6.719
  197   1HB   PRO  27          1HB       PRO  27   2.533  -6.361   6.196
  198   2HB   PRO  27          2HB       PRO  27   3.981  -6.150   5.231
  199   1HG   PRO  27          1HG       PRO  27   1.530  -7.671   4.587
  200   2HG   PRO  27          2HG       PRO  27   2.782  -7.099   3.504
  201   1HD   PRO  27          1HD       PRO  27   2.417  -9.786   4.435
  202   2HD   PRO  27          2HD       PRO  27   3.735  -9.190   3.447
  203    H    GLU  28           H        GLU  28   2.123  -9.752   6.678
  204    HA   GLU  28           HA       GLU  28   0.809  -8.939   8.872
  205   1HB   GLU  28          1HB       GLU  28   1.431 -11.808   8.041
  206   2HB   GLU  28          2HB       GLU  28   0.179 -11.362   9.184
  207   1HG   GLU  28          1HG       GLU  28   0.148  -9.943   6.536
  208   2HG   GLU  28          2HG       GLU  28  -0.285 -11.641   6.519
  209    H    ARG  29           H        ARG  29   3.718 -11.106   8.783
  210    HA   ARG  29           HA       ARG  29   3.789 -11.297  11.589
  211   1HB   ARG  29          1HB       ARG  29   5.707 -12.026   9.341
  212   2HB   ARG  29          2HB       ARG  29   6.214 -12.175  11.011
  213   1HG   ARG  29          1HG       ARG  29   4.645 -13.871  11.489
  214   2HG   ARG  29          2HG       ARG  29   3.563 -13.382  10.200
  215   1HD   ARG  29          1HD       ARG  29   4.819 -14.470   8.534
  216   2HD   ARG  29          2HD       ARG  29   6.317 -14.362   9.437
  217    HE   ARG  29           HE       ARG  29   4.398 -16.014  10.842
  218   1HH1  ARG  29          1HH1      ARG  29   6.646 -16.038   8.136
  219   2HH1  ARG  29          2HH1      ARG  29   6.885 -17.753   8.184
  220   1HH2  ARG  29          1HH2      ARG  29   4.713 -18.277  10.906
  221   2HH2  ARG  29          2HH2      ARG  29   5.777 -19.034   9.770
  222    H    ARG  30           H        ARG  30   5.764  -9.544   9.088
  223    HA   ARG  30           HA       ARG  30   7.580  -8.393  10.692
  224   1HB   ARG  30          1HB       ARG  30   7.492  -8.182   8.196
  225   2HB   ARG  30          2HB       ARG  30   6.135  -7.081   8.334
  226   1HG   ARG  30          1HG       ARG  30   7.766  -5.698   9.910
  227   2HG   ARG  30          2HG       ARG  30   9.025  -6.626   9.119
  228   1HD   ARG  30          1HD       ARG  30   8.547  -5.709   6.980
  229   2HD   ARG  30          2HD       ARG  30   6.920  -5.242   7.431
  230    HE   ARG  30           HE       ARG  30   7.764  -3.232   8.281
  231   1HH1  ARG  30          1HH1      ARG  30  10.398  -5.549   7.999
  232   2HH1  ARG  30          2HH1      ARG  30  11.625  -4.399   8.410
  233   1HH2  ARG  30          1HH2      ARG  30   9.382  -1.712   8.823
  234   2HH2  ARG  30          2HH2      ARG  30  11.042  -2.201   8.882
  235    H    LEU  31           H        LEU  31   4.230  -7.230   9.950
  236    HA   LEU  31           HA       LEU  31   4.395  -4.831  11.351
  237   1HB   LEU  31          1HB       LEU  31   2.629  -5.863   9.691
  238   2HB   LEU  31          2HB       LEU  31   1.845  -6.379  11.171
  239    HG   LEU  31           HG       LEU  31   2.649  -3.525  11.077
  240   1HD1  LEU  31          1HD1      LEU  31   1.677  -4.338   8.739
  241   2HD1  LEU  31          2HD1      LEU  31   0.134  -4.156   9.607
  242   3HD1  LEU  31          3HD1      LEU  31   1.240  -2.769   9.459
  243   1HD2  LEU  31          1HD2      LEU  31  -0.122  -4.236  11.710
  244   2HD2  LEU  31          2HD2      LEU  31   1.079  -5.090  12.707
  245   3HD2  LEU  31          3HD2      LEU  31   1.075  -3.310  12.648
  246    H    THR  32           H        THR  32   2.928  -7.991  12.402
  247    HA   THR  32           HA       THR  32   2.331  -7.340  14.970
  248    HB   THR  32           HB       THR  32   3.356  -9.893  13.652
  249    HG1  THR  32           HG1      THR  32   0.989 -10.278  14.030
  250   1HG2  THR  32          1HG2      THR  32   2.462 -11.111  15.626
  251   2HG2  THR  32          2HG2      THR  32   3.807 -10.056  16.123
  252   3HG2  THR  32          3HG2      THR  32   2.125  -9.564  16.439
  253    H    GLU  33           H        GLU  33   5.532  -8.633  13.850
  254    HA   GLU  33           HA       GLU  33   6.812  -8.714  16.177
  255   1HB   GLU  33          1HB       GLU  33   7.724  -7.869  13.419
  256   2HB   GLU  33          2HB       GLU  33   8.865  -7.833  14.748
  257   1HG   GLU  33          1HG       GLU  33   7.327 -10.336  14.747
  258   2HG   GLU  33          2HG       GLU  33   8.131 -10.089  13.208
  259    H    HIS  34           H        HIS  34   6.647  -5.741  14.079
  260    HA   HIS  34           HA       HIS  34   7.976  -4.031  15.708
  261   1HB   HIS  34          1HB       HIS  34   7.479  -3.047  13.729
  262   2HB   HIS  34          2HB       HIS  34   5.898  -3.796  13.615
  263    HD1  HIS  34           HD1      HIS  34   4.089  -2.090  13.653
  264    HD2  HIS  34           HD2      HIS  34   7.328  -0.983  16.079
  265    HE1  HIS  34           HE1      HIS  34   3.479   0.167  14.675
  266    H    ASN  35           H        ASN  35   4.373  -4.546  15.693
  267    HA   ASN  35           HA       ASN  35   3.648  -2.956  17.667
  268   1HB   ASN  35          1HB       ASN  35   2.661  -5.436  16.516
  269   2HB   ASN  35          2HB       ASN  35   2.369  -5.479  18.242
  270   1HD2  ASN  35          1HD2      ASN  35   0.724  -5.032  15.699
  271   2HD2  ASN  35          2HD2      ASN  35  -0.271  -3.658  16.048
  272    H    SER  36           H        SER  36   4.639  -6.439  18.161
  273    HA   SER  36           HA       SER  36   4.595  -6.540  20.830
  274   1HB   SER  36          1HB       SER  36   5.113  -8.551  19.725
  275   2HB   SER  36          2HB       SER  36   6.390  -7.823  18.769
  276    HG   SER  36           HG       SER  36   6.447  -8.726  21.482
  277    H    GLY  37           H        GLY  37   7.492  -5.601  18.829
  278   1HA   GLY  37          1HA       GLY  37   9.147  -4.906  20.979
  279   2HA   GLY  37          2HA       GLY  37   9.305  -4.368  19.318
  280    H    THR  38           H        THR  38   9.721  -2.177  19.563
  281    HA   THR  38           HA       THR  38   9.358  -0.030  20.011
  282    HB   THR  38           HB       THR  38   6.511  -1.128  19.959
  283    HG1  THR  38           HG1      THR  38   7.909  -0.992  18.013
  284   1HG2  THR  38          1HG2      THR  38   5.645   1.109  19.923
  285   2HG2  THR  38          2HG2      THR  38   6.756   1.100  21.313
  286   3HG2  THR  38          3HG2      THR  38   7.271   1.820  19.769
  287    H    GLY  39           H        GLY  39  10.489   0.349  21.861
  288   1HA   GLY  39          1HA       GLY  39   9.245  -0.337  24.418
  289   2HA   GLY  39          2HA       GLY  39  10.890   0.203  24.141
  290    H    ALA  40           H        ALA  40   7.452   1.263  24.215
  291    HA   ALA  40           HA       ALA  40   8.426   3.926  24.966
  292   1HB   ALA  40          1HB       ALA  40   5.918   3.689  23.344
  293   2HB   ALA  40          2HB       ALA  40   7.123   4.997  23.399
  294   3HB   ALA  40          3HB       ALA  40   7.470   3.504  22.495
  295    H    LYS  41           H        LYS  41   5.421   1.892  24.655
  296    HA   LYS  41           HA       LYS  41   4.854   2.606  27.445
  297   1HB   LYS  41          1HB       LYS  41   3.245   3.099  25.038
  298   2HB   LYS  41          2HB       LYS  41   2.368   2.240  26.289
  299   1HG   LYS  41          1HG       LYS  41   2.866   3.970  27.938
  300   2HG   LYS  41          2HG       LYS  41   3.997   4.758  26.854
  301   1HD   LYS  41          1HD       LYS  41   1.697   4.705  25.302
  302   2HD   LYS  41          2HD       LYS  41   1.025   4.890  26.911
  303   1HE   LYS  41          1HE       LYS  41   2.647   6.825  27.287
  304   2HE   LYS  41          2HE       LYS  41   3.125   6.687  25.607
  305   1HZ   LYS  41          1HZ       LYS  41   0.626   7.616  26.716
  306   2HZ   LYS  41          2HZ       LYS  41   1.454   8.159  25.418
  307   3HZ   LYS  41          3HZ       LYS  41   0.542   6.811  25.298
  308    H    TYR  42           H        TYR  42   4.394   0.901  28.772
  309    HA   TYR  42           HA       TYR  42   4.954  -1.685  27.909
  310   1HB   TYR  42          1HB       TYR  42   3.902  -0.169  30.262
  311   2HB   TYR  42          2HB       TYR  42   3.289  -1.809  30.204
  312    HD1  TYR  42           HD1      TYR  42   5.836   0.184  31.487
  313    HD2  TYR  42           HD2      TYR  42   5.231  -3.633  29.650
  314    HE1  TYR  42           HE1      TYR  42   7.994  -0.668  32.526
  315    HE2  TYR  42           HE2      TYR  42   7.392  -4.470  30.695
  316    HH   TYR  42           HH       TYR  42   9.688  -2.461  31.939
  317    H    THR  43           H        THR  43   3.774  -2.636  26.280
  318    HA   THR  43           HA       THR  43   1.169  -3.541  26.884
  319    HB   THR  43           HB       THR  43   0.693  -1.111  26.314
  320    HG1  THR  43           HG1      THR  43  -1.112  -2.046  25.427
  321   1HG2  THR  43          1HG2      THR  43   2.572  -1.249  24.379
  322   2HG2  THR  43          2HG2      THR  43   1.189  -1.830  23.423
  323   3HG2  THR  43          3HG2      THR  43   1.129  -0.224  24.189
  324    H    ARG  44           H        ARG  44   1.159  -5.536  26.082
  325    HA   ARG  44           HA       ARG  44   2.909  -6.020  23.836
  326   1HB   ARG  44          1HB       ARG  44   1.742  -7.676  26.055
  327   2HB   ARG  44          2HB       ARG  44   1.998  -8.507  24.533
  328   1HG   ARG  44          1HG       ARG  44   4.182  -8.735  25.095
  329   2HG   ARG  44          2HG       ARG  44   4.361  -7.001  24.910
  330   1HD   ARG  44          1HD       ARG  44   4.097  -6.586  27.228
  331   2HD   ARG  44          2HD       ARG  44   3.241  -8.090  27.507
  332    HE   ARG  44           HE       ARG  44   5.850  -8.756  26.582
  333   1HH1  ARG  44          1HH1      ARG  44   4.331  -7.255  29.377
  334   2HH1  ARG  44          2HH1      ARG  44   5.580  -7.735  30.475
  335   1HH2  ARG  44          1HH2      ARG  44   7.499  -9.390  28.030
  336   2HH2  ARG  44          2HH2      ARG  44   7.396  -8.959  29.703
  337    H    LEU  45           H        LEU  45  -0.457  -6.806  24.984
  338    HA   LEU  45           HA       LEU  45  -1.319  -7.894  22.563
  339   1HB   LEU  45          1HB       LEU  45  -2.491  -7.016  25.110
  340   2HB   LEU  45          2HB       LEU  45  -3.581  -6.896  23.744
  341    HG   LEU  45           HG       LEU  45  -2.536  -9.412  23.387
  342   1HD1  LEU  45          1HD1      LEU  45  -1.324  -9.622  25.371
  343   2HD1  LEU  45          2HD1      LEU  45  -2.574  -8.804  26.339
  344   3HD1  LEU  45          3HD1      LEU  45  -2.863 -10.447  25.720
  345   1HD2  LEU  45          1HD2      LEU  45  -4.823  -9.767  24.981
  346   2HD2  LEU  45          2HD2      LEU  45  -5.039  -8.203  24.159
  347   3HD2  LEU  45          3HD2      LEU  45  -4.731  -9.673  23.206
  348    H    ALA  46           H        ALA  46  -2.078  -4.622  23.967
  349    HA   ALA  46           HA       ALA  46  -2.596  -2.705  22.991
  350   1HB   ALA  46          1HB       ALA  46  -1.237  -2.025  21.074
  351   2HB   ALA  46          2HB       ALA  46  -0.234  -2.938  22.228
  352   3HB   ALA  46          3HB       ALA  46  -0.816  -3.722  20.738
  353    H    LYS  47           H        LYS  47  -4.847  -3.245  22.804
  354    HA   LYS  47           HA       LYS  47  -5.640  -4.220  20.161
  355   1HB   LYS  47          1HB       LYS  47  -7.801  -4.705  21.202
  356   2HB   LYS  47          2HB       LYS  47  -6.490  -5.509  22.040
  357   1HG   LYS  47          1HG       LYS  47  -6.938  -2.845  23.167
  358   2HG   LYS  47          2HG       LYS  47  -8.430  -3.763  23.165
  359   1HD   LYS  47          1HD       LYS  47  -6.594  -5.665  24.036
  360   2HD   LYS  47          2HD       LYS  47  -5.950  -4.196  24.741
  361   1HE   LYS  47          1HE       LYS  47  -8.857  -4.270  25.059
  362   2HE   LYS  47          2HE       LYS  47  -8.143  -5.742  25.690
  363   1HZ   LYS  47          1HZ       LYS  47  -7.790  -4.453  27.457
  364   2HZ   LYS  47          2HZ       LYS  47  -6.481  -3.916  26.641
  365   3HZ   LYS  47          3HZ       LYS  47  -7.865  -3.047  26.628
  366    H    ARG  48           H        ARG  48  -4.614  -1.432  20.986
  367    HA   ARG  48           HA       ARG  48  -7.027   0.025  20.286
  368   1HB   ARG  48          1HB       ARG  48  -5.825   2.041  21.152
  369   2HB   ARG  48          2HB       ARG  48  -5.939   0.787  22.372
  370   1HG   ARG  48          1HG       ARG  48  -3.631   0.081  21.968
  371   2HG   ARG  48          2HG       ARG  48  -3.500   1.129  20.568
  372   1HD   ARG  48          1HD       ARG  48  -2.618   2.667  22.011
  373   2HD   ARG  48          2HD       ARG  48  -4.268   2.934  22.537
  374    HE   ARG  48           HE       ARG  48  -3.098   0.665  23.916
  375   1HH1  ARG  48          1HH1      ARG  48  -3.167   4.182  23.867
  376   2HH1  ARG  48          2HH1      ARG  48  -2.753   4.342  25.541
  377   1HH2  ARG  48          1HH2      ARG  48  -2.551   0.874  26.125
  378   2HH2  ARG  48          2HH2      ARG  48  -2.400   2.447  26.834
  379    H    ARG  49           H        ARG  49  -6.832   1.771  18.636
  380    HA   ARG  49           HA       ARG  49  -6.128   2.672  16.795
  381   1HB   ARG  49          1HB       ARG  49  -3.654   2.041  18.098
  382   2HB   ARG  49          2HB       ARG  49  -3.453   1.568  16.422
  383   1HG   ARG  49          1HG       ARG  49  -3.822   3.760  15.612
  384   2HG   ARG  49          2HG       ARG  49  -4.697   4.256  17.046
  385   1HD   ARG  49          1HD       ARG  49  -2.128   3.524  17.998
  386   2HD   ARG  49          2HD       ARG  49  -1.817   4.384  16.503
  387    HE   ARG  49           HE       ARG  49  -2.825   5.531  18.973
  388   1HH1  ARG  49          1HH1      ARG  49  -2.926   5.869  15.471
  389   2HH1  ARG  49          2HH1      ARG  49  -3.296   7.560  15.517
  390   1HH2  ARG  49          1HH2      ARG  49  -3.312   7.763  19.034
  391   2HH2  ARG  49          2HH2      ARG  49  -3.516   8.645  17.557
  392    HA   PRO  50           HA       PRO  50  -6.859  -1.217  14.632
  393   1HB   PRO  50          1HB       PRO  50  -9.085  -0.420  13.263
  394   2HB   PRO  50          2HB       PRO  50  -9.153  -1.208  14.828
  395   1HG   PRO  50          1HG       PRO  50  -9.574   1.644  14.169
  396   2HG   PRO  50          2HG       PRO  50 -10.045   0.770  15.614
  397   1HD   PRO  50          1HD       PRO  50  -7.831   2.573  15.342
  398   2HD   PRO  50          2HD       PRO  50  -8.232   1.610  16.751
  399    H    VAL  51           H        VAL  51  -6.784  -1.904  12.367
  400    HA   VAL  51           HA       VAL  51  -5.725   0.290  10.729
  401    HB   VAL  51           HB       VAL  51  -4.040  -1.251   9.857
  402   1HG1  VAL  51          1HG1      VAL  51  -3.646   0.264  11.868
  403   2HG1  VAL  51          2HG1      VAL  51  -3.818  -1.193  12.877
  404   3HG1  VAL  51          3HG1      VAL  51  -2.516  -1.097  11.668
  405   1HG2  VAL  51          1HG2      VAL  51  -3.958  -3.262  11.863
  406   2HG2  VAL  51          2HG2      VAL  51  -5.619  -3.222  11.226
  407   3HG2  VAL  51          3HG2      VAL  51  -4.245  -3.454  10.117
  408    H    ILE  52           H        ILE  52  -6.828   0.514   8.854
  409    HA   ILE  52           HA       ILE  52  -8.355  -1.830   7.955
  410    HB   ILE  52           HB       ILE  52 -10.085  -0.459   7.272
  411   1HG1  ILE  52          1HG1      ILE  52  -8.306   1.976   7.590
  412   2HG1  ILE  52          2HG1      ILE  52  -8.666   1.187   6.068
  413   1HG2  ILE  52          1HG2      ILE  52 -10.588   1.029   9.234
  414   2HG2  ILE  52          2HG2      ILE  52 -10.151  -0.646   9.646
  415   3HG2  ILE  52          3HG2      ILE  52  -8.958   0.660   9.847
  416   1HD1  ILE  52          1HD1      ILE  52 -10.600   2.624   7.926
  417   2HD1  ILE  52          2HD1      ILE  52 -10.225   2.995   6.226
  418   3HD1  ILE  52          3HD1      ILE  52 -11.164   1.539   6.633
  419    H    MET  53           H        MET  53  -8.017  -2.580   5.898
  420    HA   MET  53           HA       MET  53  -5.956  -1.157   4.428
  421   1HB   MET  53          1HB       MET  53  -6.761  -3.987   4.841
  422   2HB   MET  53          2HB       MET  53  -6.471  -3.624   3.152
  423   1HG   MET  53          1HG       MET  53  -4.201  -3.073   3.513
  424   2HG   MET  53          2HG       MET  53  -4.457  -2.669   5.199
  425   1HE   MET  53          1HE       MET  53  -3.214  -5.624   6.929
  426   2HE   MET  53          2HE       MET  53  -2.454  -4.202   6.176
  427   3HE   MET  53          3HE       MET  53  -4.008  -4.034   7.028
  428    H    ILE  54           H        ILE  54  -6.563   0.106   2.728
  429    HA   ILE  54           HA       ILE  54  -9.065  -0.629   1.372
  430    HB   ILE  54           HB       ILE  54  -9.601   1.603   1.095
  431   1HG1  ILE  54          1HG1      ILE  54  -7.410   2.357   0.260
  432   2HG1  ILE  54          2HG1      ILE  54  -8.117   3.487   1.397
  433   1HG2  ILE  54          1HG2      ILE  54 -10.082   1.051   3.332
  434   2HG2  ILE  54          2HG2      ILE  54  -8.375   1.184   3.823
  435   3HG2  ILE  54          3HG2      ILE  54  -9.294   2.648   3.398
  436   1HD1  ILE  54          1HD1      ILE  54  -5.932   3.364   2.211
  437   2HD1  ILE  54          2HD1      ILE  54  -6.714   2.102   3.192
  438   3HD1  ILE  54          3HD1      ILE  54  -5.752   1.651   1.763
  439    H    HIS  55           H        HIS  55  -5.877  -1.083   1.112
  440    HA   HIS  55           HA       HIS  55  -6.012  -0.898  -1.779
  441   1HB   HIS  55          1HB       HIS  55  -3.772   0.320  -0.141
  442   2HB   HIS  55          2HB       HIS  55  -3.718   0.068  -1.875
  443    HD1  HIS  55           HD1      HIS  55  -6.417   1.111  -2.813
  444    HD2  HIS  55           HD2      HIS  55  -4.144   3.006   0.158
  445    HE1  HIS  55           HE1      HIS  55  -7.192   3.542  -2.761
  446    H    THR  56           H        THR  56  -4.565  -2.404  -2.851
  447    HA   THR  56           HA       THR  56  -2.919  -4.123  -1.251
  448    HB   THR  56           HB       THR  56  -4.341  -6.177  -1.977
  449    HG1  THR  56           HG1      THR  56  -6.046  -3.827  -2.375
  450   1HG2  THR  56          1HG2      THR  56  -4.389  -4.981   0.388
  451   2HG2  THR  56          2HG2      THR  56  -5.951  -4.337  -0.173
  452   3HG2  THR  56          3HG2      THR  56  -5.711  -6.095  -0.038
  453    H    GLU  57           H        GLU  57  -1.185  -3.724  -2.550
  454    HA   GLU  57           HA       GLU  57  -1.606  -4.393  -5.359
  455   1HB   GLU  57          1HB       GLU  57  -0.358  -2.106  -4.104
  456   2HB   GLU  57          2HB       GLU  57   0.864  -2.976  -5.010
  457   1HG   GLU  57          1HG       GLU  57  -0.439  -2.850  -7.060
  458   2HG   GLU  57          2HG       GLU  57  -1.853  -2.272  -6.202
  459    H    LYS  58           H        LYS  58  -0.154  -5.853  -6.370
  460    HA   LYS  58           HA       LYS  58   1.971  -6.931  -4.691
  461   1HB   LYS  58          1HB       LYS  58   1.267  -9.156  -4.834
  462   2HB   LYS  58          2HB       LYS  58  -0.190  -8.272  -4.422
  463   1HG   LYS  58          1HG       LYS  58  -0.457  -8.141  -7.095
  464   2HG   LYS  58          2HG       LYS  58   0.577  -9.555  -7.045
  465   1HD   LYS  58          1HD       LYS  58  -1.054 -10.555  -5.328
  466   2HD   LYS  58          2HD       LYS  58  -2.128  -9.214  -5.675
  467   1HE   LYS  58          1HE       LYS  58  -1.246 -10.362  -8.188
  468   2HE   LYS  58          2HE       LYS  58  -1.819 -11.657  -7.154
  469   1HZ   LYS  58          1HZ       LYS  58  -3.377  -9.204  -7.447
  470   2HZ   LYS  58          2HZ       LYS  58  -3.495 -10.400  -8.553
  471   3HZ   LYS  58          3HZ       LYS  58  -3.887 -10.688  -6.993
  472    H    PHE  59           H        PHE  59   3.756  -6.486  -5.870
  473    HA   PHE  59           HA       PHE  59   3.655  -7.243  -8.696
  474   1HB   PHE  59          1HB       PHE  59   5.344  -5.131  -8.770
  475   2HB   PHE  59          2HB       PHE  59   3.615  -4.884  -8.898
  476    HD1  PHE  59           HD1      PHE  59   6.222  -5.193  -6.236
  477    HD2  PHE  59           HD2      PHE  59   2.670  -3.276  -7.547
  478    HE1  PHE  59           HE1      PHE  59   6.285  -3.698  -4.222
  479    HE2  PHE  59           HE2      PHE  59   2.734  -1.781  -5.533
  480    HZ   PHE  59           HZ       PHE  59   4.540  -2.010  -3.894
  481    H    GLU  60           H        GLU  60   5.699  -7.929  -9.595
  482    HA   GLU  60           HA       GLU  60   7.529  -8.749  -7.488
  483   1HB   GLU  60          1HB       GLU  60   8.249 -10.523  -9.003
  484   2HB   GLU  60          2HB       GLU  60   6.501 -10.547  -8.883
  485   1HG   GLU  60          1HG       GLU  60   6.858  -8.814 -11.009
  486   2HG   GLU  60          2HG       GLU  60   8.231  -9.883 -11.217
  487    H    THR  61           H        THR  61   7.113  -6.455  -9.985
  488    HA   THR  61           HA       THR  61   9.998  -6.238 -10.465
  489    HB   THR  61           HB       THR  61   9.174  -4.678 -12.308
  490    HG1  THR  61           HG1      THR  61   6.859  -4.596 -12.507
  491   1HG2  THR  61          1HG2      THR  61   9.162  -6.591 -13.562
  492   2HG2  THR  61          2HG2      THR  61   8.745  -7.567 -12.134
  493   3HG2  THR  61          3HG2      THR  61   7.457  -6.811 -13.102
  494    H    ARG  62           H        ARG  62  11.218  -4.507  -9.835
  495    HA   ARG  62           HA       ARG  62  10.126  -3.021  -7.704
  496   1HB   ARG  62          1HB       ARG  62  12.492  -3.710  -7.686
  497   2HB   ARG  62          2HB       ARG  62  12.801  -2.845  -9.179
  498   1HG   ARG  62          1HG       ARG  62  11.644  -1.244  -6.914
  499   2HG   ARG  62          2HG       ARG  62  13.302  -1.781  -6.726
  500   1HD   ARG  62          1HD       ARG  62  12.468  -0.488  -9.335
  501   2HD   ARG  62          2HD       ARG  62  12.766   0.530  -7.940
  502    HE   ARG  62           HE       ARG  62  14.987  -1.127  -7.998
  503   1HH1  ARG  62          1HH1      ARG  62  13.452   0.985 -10.358
  504   2HH1  ARG  62          2HH1      ARG  62  14.929   1.335 -11.194
  505   1HH2  ARG  62          1HH2      ARG  62  16.934  -0.666  -9.101
  506   2HH2  ARG  62          2HH2      ARG  62  16.923   0.390 -10.474
  507    H    SER  63           H        SER  63  11.244  -2.292 -11.075
  508    HA   SER  63           HA       SER  63  11.107   0.357 -11.146
  509   1HB   SER  63          1HB       SER  63  10.405  -1.792 -13.120
  510   2HB   SER  63          2HB       SER  63   9.939  -0.155 -13.541
  511    HG   SER  63           HG       SER  63  12.379  -1.288 -13.743
  512    H    GLU  64           H        GLU  64   8.318  -1.931 -11.210
  513    HA   GLU  64           HA       GLU  64   6.428   0.131 -11.586
  514   1HB   GLU  64          1HB       GLU  64   6.456  -2.770 -11.416
  515   2HB   GLU  64          2HB       GLU  64   5.167  -2.144 -10.408
  516   1HG   GLU  64          1HG       GLU  64   5.433  -0.863 -13.101
  517   2HG   GLU  64          2HG       GLU  64   4.933  -2.542 -13.111
  518    H    ALA  65           H        ALA  65   7.369  -1.938  -8.747
  519    HA   ALA  65           HA       ALA  65   5.720  -0.991  -6.849
  520   1HB   ALA  65          1HB       ALA  65   8.622  -1.204  -6.134
  521   2HB   ALA  65          2HB       ALA  65   7.199  -1.940  -5.360
  522   3HB   ALA  65          3HB       ALA  65   7.844  -2.626  -6.869
  523    H    THR  66           H        THR  66   8.916   0.509  -7.728
  524    HA   THR  66           HA       THR  66   8.626   2.727  -6.058
  525    HB   THR  66           HB       THR  66  10.760   1.930  -7.089
  526    HG1  THR  66           HG1      THR  66  11.392   4.097  -7.284
  527   1HG2  THR  66          1HG2      THR  66  10.015   1.350  -9.373
  528   2HG2  THR  66          2HG2      THR  66   9.474   3.025  -9.646
  529   3HG2  THR  66          3HG2      THR  66  11.210   2.667  -9.472
  530    H    LYS  67           H        LYS  67   7.537   2.144  -9.431
  531    HA   LYS  67           HA       LYS  67   6.797   4.764  -9.985
  532   1HB   LYS  67          1HB       LYS  67   6.837   2.386 -11.342
  533   2HB   LYS  67          2HB       LYS  67   5.113   2.628 -11.139
  534   1HG   LYS  67          1HG       LYS  67   5.149   4.734 -12.276
  535   2HG   LYS  67          2HG       LYS  67   6.885   4.904 -12.098
  536   1HD   LYS  67          1HD       LYS  67   6.496   2.452 -13.499
  537   2HD   LYS  67          2HD       LYS  67   5.379   3.590 -14.225
  538   1HE   LYS  67          1HE       LYS  67   7.813   5.034 -13.848
  539   2HE   LYS  67          2HE       LYS  67   8.285   3.465 -14.469
  540   1HZ   LYS  67          1HZ       LYS  67   7.218   3.835 -16.401
  541   2HZ   LYS  67          2HZ       LYS  67   6.035   4.753 -15.747
  542   3HZ   LYS  67          3HZ       LYS  67   7.509   5.398 -16.025
  543    H    ALA  68           H        ALA  68   4.957   2.044  -8.467
  544    HA   ALA  68           HA       ALA  68   2.525   3.321  -8.248
  545   1HB   ALA  68          1HB       ALA  68   3.795   1.401  -6.257
  546   2HB   ALA  68          2HB       ALA  68   2.057   1.671  -6.528
  547   3HB   ALA  68          3HB       ALA  68   3.046   0.907  -7.794
  548    H    GLU  69           H        GLU  69   5.495   3.578  -6.254
  549    HA   GLU  69           HA       GLU  69   4.247   5.050  -4.217
  550   1HB   GLU  69          1HB       GLU  69   6.542   3.738  -4.280
  551   2HB   GLU  69          2HB       GLU  69   7.200   5.258  -4.851
  552   1HG   GLU  69          1HG       GLU  69   5.428   5.251  -2.396
  553   2HG   GLU  69          2HG       GLU  69   7.095   4.733  -2.244
  554    H    ALA  70           H        ALA  70   6.359   5.980  -7.023
  555    HA   ALA  70           HA       ALA  70   6.598   8.625  -6.676
  556   1HB   ALA  70          1HB       ALA  70   7.243   8.616  -8.860
  557   2HB   ALA  70          2HB       ALA  70   7.038   6.854  -8.711
  558   3HB   ALA  70          3HB       ALA  70   5.734   7.844  -9.408
  559    H    ALA  71           H        ALA  71   3.836   7.193  -8.567
  560    HA   ALA  71           HA       ALA  71   2.351   9.484  -8.751
  561   1HB   ALA  71          1HB       ALA  71   2.099   6.948  -9.626
  562   2HB   ALA  71          2HB       ALA  71   0.911   6.902  -8.301
  563   3HB   ALA  71          3HB       ALA  71   0.737   8.094  -9.611
  564    H    PHE  72           H        PHE  72   2.213   6.929  -6.173
  565    HA   PHE  72           HA       PHE  72   0.211   7.911  -4.654
  566   1HB   PHE  72          1HB       PHE  72   2.641   6.273  -4.400
  567   2HB   PHE  72          2HB       PHE  72   2.402   7.179  -2.918
  568    HD1  PHE  72           HD1      PHE  72   0.315   5.201  -5.313
  569    HD2  PHE  72           HD2      PHE  72   1.209   6.117  -1.267
  570    HE1  PHE  72           HE1      PHE  72  -1.383   3.516  -4.557
  571    HE2  PHE  72           HE2      PHE  72  -0.490   4.430  -0.511
  572    HZ   PHE  72           HZ       PHE  72  -1.766   3.150  -2.165
  573    H    LYS  73           H        LYS  73   3.706   8.883  -4.442
  574    HA   LYS  73           HA       LYS  73   3.526  10.641  -2.374
  575   1HB   LYS  73          1HB       LYS  73   5.340  10.122  -4.591
  576   2HB   LYS  73          2HB       LYS  73   5.304  11.825  -4.185
  577   1HG   LYS  73          1HG       LYS  73   5.430   9.881  -1.892
  578   2HG   LYS  73          2HG       LYS  73   6.873  10.046  -2.872
  579   1HD   LYS  73          1HD       LYS  73   7.380  12.019  -1.879
  580   2HD   LYS  73          2HD       LYS  73   5.833  12.694  -2.348
  581   1HE   LYS  73          1HE       LYS  73   5.041  11.071  -0.273
  582   2HE   LYS  73          2HE       LYS  73   6.661  11.479   0.256
  583   1HZ   LYS  73          1HZ       LYS  73   4.467  13.041   0.490
  584   2HZ   LYS  73          2HZ       LYS  73   6.012  13.525   0.705
  585   3HZ   LYS  73          3HZ       LYS  73   5.284  13.739  -0.741
  586    H    LYS  74           H        LYS  74   2.283  10.958  -5.675
  587    HA   LYS  74           HA       LYS  74   1.722  13.776  -5.241
  588   1HB   LYS  74          1HB       LYS  74   1.862  11.947  -7.578
  589   2HB   LYS  74          2HB       LYS  74   0.663  13.221  -7.669
  590   1HG   LYS  74          1HG       LYS  74   2.267  14.937  -7.584
  591   2HG   LYS  74          2HG       LYS  74   3.434  13.955  -6.722
  592   1HD   LYS  74          1HD       LYS  74   3.165  12.544  -9.100
  593   2HD   LYS  74          2HD       LYS  74   2.956  14.196  -9.648
  594   1HE   LYS  74          1HE       LYS  74   5.227  13.630  -7.743
  595   2HE   LYS  74          2HE       LYS  74   5.397  13.079  -9.397
  596   1HZ   LYS  74          1HZ       LYS  74   4.510  15.807  -8.900
  597   2HZ   LYS  74          2HZ       LYS  74   6.097  15.447  -8.756
  598   3HZ   LYS  74          3HZ       LYS  74   5.331  15.207 -10.179
  599    H    LEU  75           H        LEU  75   0.066  10.602  -5.658
  600    HA   LEU  75           HA       LEU  75  -2.530  11.588  -5.650
  601   1HB   LEU  75          1HB       LEU  75  -1.498   8.939  -4.628
  602   2HB   LEU  75          2HB       LEU  75  -3.164   9.310  -5.030
  603    HG   LEU  75           HG       LEU  75  -0.865   9.346  -7.004
  604   1HD1  LEU  75          1HD1      LEU  75  -1.330   7.084  -6.119
  605   2HD1  LEU  75          2HD1      LEU  75  -3.021   7.246  -6.651
  606   3HD1  LEU  75          3HD1      LEU  75  -1.707   7.245  -7.850
  607   1HD2  LEU  75          1HD2      LEU  75  -2.813  10.863  -7.490
  608   2HD2  LEU  75          2HD2      LEU  75  -2.487   9.622  -8.723
  609   3HD2  LEU  75          3HD2      LEU  75  -3.834   9.408  -7.580
  610    H    THR  76           H        THR  76  -4.169  11.271  -3.841
  611    HA   THR  76           HA       THR  76  -2.953  11.751  -1.214
  612    HB   THR  76           HB       THR  76  -3.474  13.963  -2.173
  613    HG1  THR  76           HG1      THR  76  -4.923  14.501  -0.430
  614   1HG2  THR  76          1HG2      THR  76  -5.426  14.477  -3.296
  615   2HG2  THR  76          2HG2      THR  76  -5.516  12.721  -3.573
  616   3HG2  THR  76          3HG2      THR  76  -6.415  13.457  -2.224
  617    H    ARG  77           H        ARG  77  -5.084  11.957   0.391
  618    HA   ARG  77           HA       ARG  77  -5.867   9.406   0.724
  619   1HB   ARG  77          1HB       ARG  77  -6.134  11.147   2.454
  620   2HB   ARG  77          2HB       ARG  77  -7.345  11.971   1.492
  621   1HG   ARG  77          1HG       ARG  77  -8.822   9.943   1.644
  622   2HG   ARG  77          2HG       ARG  77  -7.618   9.153   2.643
  623   1HD   ARG  77          1HD       ARG  77  -9.043  11.766   3.343
  624   2HD   ARG  77          2HD       ARG  77  -9.423  10.195   4.022
  625    HE   ARG  77           HE       ARG  77  -6.613  10.785   4.371
  626   1HH1  ARG  77          1HH1      ARG  77  -9.797  11.585   5.638
  627   2HH1  ARG  77          2HH1      ARG  77  -9.207  12.002   7.211
  628   1HH2  ARG  77          1HH2      ARG  77  -5.834  11.336   6.446
  629   2HH2  ARG  77          2HH2      ARG  77  -6.937  11.859   7.675
  630    H    LYS  78           H        LYS  78  -6.979  11.692  -1.652
  631    HA   LYS  78           HA       LYS  78  -9.442  10.184  -2.100
  632   1HB   LYS  78          1HB       LYS  78  -8.905  12.905  -2.109
  633   2HB   LYS  78          2HB       LYS  78  -8.933  12.506  -3.815
  634   1HG   LYS  78          1HG       LYS  78 -11.112  11.508  -1.940
  635   2HG   LYS  78          2HG       LYS  78 -11.195  13.110  -2.644
  636   1HD   LYS  78          1HD       LYS  78 -11.738  12.309  -4.719
  637   2HD   LYS  78          2HD       LYS  78 -10.548  11.027  -4.641
  638   1HE   LYS  78          1HE       LYS  78 -12.550   9.799  -4.617
  639   2HE   LYS  78          2HE       LYS  78 -12.200   9.917  -2.904
  640   1HZ   LYS  78          1HZ       LYS  78 -14.223  10.780  -2.798
  641   2HZ   LYS  78          2HZ       LYS  78 -13.578  12.161  -3.381
  642   3HZ   LYS  78          3HZ       LYS  78 -14.313  11.111  -4.394
  643    H    GLN  79           H        GLN  79  -7.032  11.776  -4.297
  644    HA   GLN  79           HA       GLN  79  -7.397  10.415  -6.489
  645   1HB   GLN  79          1HB       GLN  79  -5.235  11.865  -5.355
  646   2HB   GLN  79          2HB       GLN  79  -4.524  10.391  -5.983
  647   1HG   GLN  79          1HG       GLN  79  -5.099  10.877  -8.194
  648   2HG   GLN  79          2HG       GLN  79  -6.519  11.796  -7.741
  649   1HE2  GLN  79          1HE2      GLN  79  -3.746  12.125  -9.227
  650   2HE2  GLN  79          2HE2      GLN  79  -3.253  13.728  -8.795
  651    H    LYS  80           H        LYS  80  -5.385   9.161  -3.738
  652    HA   LYS  80           HA       LYS  80  -4.645   6.771  -4.876
  653   1HB   LYS  80          1HB       LYS  80  -5.034   7.746  -2.067
  654   2HB   LYS  80          2HB       LYS  80  -4.737   6.041  -2.333
  655   1HG   LYS  80          1HG       LYS  80  -2.538   6.405  -2.781
  656   2HG   LYS  80          2HG       LYS  80  -2.917   7.638  -3.967
  657   1HD   LYS  80          1HD       LYS  80  -3.108   9.352  -2.222
  658   2HD   LYS  80          2HD       LYS  80  -2.962   8.149  -0.958
  659   1HE   LYS  80          1HE       LYS  80  -0.717   8.025  -2.871
  660   2HE   LYS  80          2HE       LYS  80  -0.852   9.599  -2.114
  661   1HZ   LYS  80          1HZ       LYS  80  -0.750   7.038  -0.677
  662   2HZ   LYS  80          2HZ       LYS  80   0.478   8.106  -0.806
  663   3HZ   LYS  80          3HZ       LYS  80  -0.871   8.506   0.025
  664    H    GLU  81           H        GLU  81  -7.479   7.332  -2.662
  665    HA   GLU  81           HA       GLU  81  -8.595   4.961  -2.645
  666   1HB   GLU  81          1HB       GLU  81  -9.533   7.081  -1.657
  667   2HB   GLU  81          2HB       GLU  81 -10.160   7.513  -3.236
  668   1HG   GLU  81          1HG       GLU  81 -11.990   6.222  -2.898
  669   2HG   GLU  81          2HG       GLU  81 -10.982   4.804  -2.694
  670    H    GLN  82           H        GLN  82  -9.035   7.325  -5.370
  671    HA   GLN  82           HA       GLN  82 -10.517   5.462  -6.880
  672   1HB   GLN  82          1HB       GLN  82 -10.101   8.203  -6.959
  673   2HB   GLN  82          2HB       GLN  82  -9.190   7.665  -8.355
  674   1HG   GLN  82          1HG       GLN  82 -11.084   7.230  -9.532
  675   2HG   GLN  82          2HG       GLN  82 -11.750   6.261  -8.231
  676   1HE2  GLN  82          1HE2      GLN  82 -12.563   7.502  -6.313
  677   2HE2  GLN  82          2HE2      GLN  82 -13.475   8.945  -6.608
  678    H    TYR  83           H        TYR  83  -7.219   6.931  -7.378
  679    HA   TYR  83           HA       TYR  83  -6.304   5.615  -9.479
  680   1HB   TYR  83          1HB       TYR  83  -4.874   7.096  -8.182
  681   2HB   TYR  83          2HB       TYR  83  -5.152   6.195  -6.705
  682    HD1  TYR  83           HD1      TYR  83  -3.782   4.313  -6.109
  683    HD2  TYR  83           HD2      TYR  83  -3.328   6.186  -9.930
  684    HE1  TYR  83           HE1      TYR  83  -1.614   3.039  -6.484
  685    HE2  TYR  83           HE2      TYR  83  -1.162   4.905 -10.291
  686    HH   TYR  83           HH       TYR  83   0.059   2.685  -7.794
  687    H    LEU  84           H        LEU  84  -6.592   4.178  -6.174
  688    HA   LEU  84           HA       LEU  84  -5.584   1.657  -7.142
  689   1HB   LEU  84          1HB       LEU  84  -6.523   2.702  -4.484
  690   2HB   LEU  84          2HB       LEU  84  -6.240   0.991  -4.741
  691    HG   LEU  84           HG       LEU  84  -3.937   2.339  -5.707
  692   1HD1  LEU  84          1HD1      LEU  84  -5.072   4.131  -4.067
  693   2HD1  LEU  84          2HD1      LEU  84  -4.194   3.158  -2.862
  694   3HD1  LEU  84          3HD1      LEU  84  -3.312   3.919  -4.210
  695   1HD2  LEU  84          1HD2      LEU  84  -4.658   0.380  -3.607
  696   2HD2  LEU  84          2HD2      LEU  84  -3.413   0.310  -4.878
  697   3HD2  LEU  84          3HD2      LEU  84  -3.112   1.234  -3.386
  698    H    LYS  85           H        LYS  85  -8.700   2.892  -5.736
  699    HA   LYS  85           HA       LYS  85 -10.212   0.673  -5.979
  700   1HB   LYS  85          1HB       LYS  85 -11.051   2.680  -4.962
  701   2HB   LYS  85          2HB       LYS  85 -10.946   3.569  -6.467
  702   1HG   LYS  85          1HG       LYS  85 -12.535   1.572  -7.341
  703   2HG   LYS  85          2HG       LYS  85 -12.938   1.466  -5.638
  704   1HD   LYS  85          1HD       LYS  85 -14.526   2.999  -6.579
  705   2HD   LYS  85          2HD       LYS  85 -13.390   3.991  -5.689
  706   1HE   LYS  85          1HE       LYS  85 -13.497   5.159  -7.715
  707   2HE   LYS  85          2HE       LYS  85 -12.101   4.140  -7.999
  708   1HZ   LYS  85          1HZ       LYS  85 -13.175   3.157  -9.632
  709   2HZ   LYS  85          2HZ       LYS  85 -14.446   2.769  -8.684
  710   3HZ   LYS  85          3HZ       LYS  85 -14.413   4.207  -9.455
  711    H    THR  86           H        THR  86  -9.504   3.074  -8.598
  712    HA   THR  86           HA       THR  86 -11.022   2.072 -10.607
  713    HB   THR  86           HB       THR  86  -9.163   2.981 -12.081
  714    HG1  THR  86           HG1      THR  86  -7.194   3.357 -11.032
  715   1HG2  THR  86          1HG2      THR  86  -8.911   5.076 -10.141
  716   2HG2  THR  86          2HG2      THR  86 -10.010   5.033 -11.541
  717   3HG2  THR  86          3HG2      THR  86 -10.555   4.415  -9.962
  718    H    PHE  87           H        PHE  87  -7.993   0.674  -9.305
  719    HA   PHE  87           HA       PHE  87  -8.153  -1.426 -11.309
  720   1HB   PHE  87          1HB       PHE  87  -5.952  -0.417 -10.811
  721   2HB   PHE  87          2HB       PHE  87  -6.210  -0.580  -9.086
  722    HD1  PHE  87           HD1      PHE  87  -5.555  -2.536  -7.948
  723    HD2  PHE  87           HD2      PHE  87  -5.642  -2.520 -12.190
  724    HE1  PHE  87           HE1      PHE  87  -4.367  -4.747  -7.980
  725    HE2  PHE  87           HE2      PHE  87  -4.454  -4.732 -12.223
  726    HZ   PHE  87           HZ       PHE  87  -3.831  -5.819 -10.117
  727    H    HIS  88           H        HIS  88  -8.245  -0.935  -7.726
  728    HA   HIS  88           HA       HIS  88  -8.349  -3.514  -6.908
  729   1HB   HIS  88          1HB       HIS  88  -8.369  -1.325  -5.570
  730   2HB   HIS  88          2HB       HIS  88 -10.113  -1.356  -5.741
  731    HD1  HIS  88           HD1      HIS  88 -10.650  -4.387  -5.277
  732    HD2  HIS  88           HD2      HIS  88  -8.069  -2.049  -2.939
  733    HE1  HIS  88           HE1      HIS  88 -10.466  -5.565  -3.021
  734    H    LEU  89           H        LEU  89 -11.010  -1.509  -8.280
  735    HA   LEU  89           HA       LEU  89 -13.042  -3.376  -7.829
  736   1HB   LEU  89          1HB       LEU  89 -12.654  -0.867  -9.251
  737   2HB   LEU  89          2HB       LEU  89 -13.731  -1.949 -10.113
  738    HG   LEU  89           HG       LEU  89 -15.211  -2.102  -8.197
  739   1HD1  LEU  89          1HD1      LEU  89 -14.854  -1.036  -6.111
  740   2HD1  LEU  89          2HD1      LEU  89 -13.359  -1.926  -6.487
  741   3HD1  LEU  89          3HD1      LEU  89 -13.425  -0.162  -6.717
  742   1HD2  LEU  89          1HD2      LEU  89 -16.135   0.079  -8.249
  743   2HD2  LEU  89          2HD2      LEU  89 -14.557   0.821  -8.607
  744   3HD2  LEU  89          3HD2      LEU  89 -15.367  -0.183  -9.833
  745    H    GLU  90           H        GLU  90 -11.214  -2.637 -10.888
  746    HA   GLU  90           HA       GLU  90 -12.228  -4.974 -12.102
  747   1HB   GLU  90          1HB       GLU  90 -10.920  -4.323 -14.011
  748   2HB   GLU  90          2HB       GLU  90 -11.529  -2.844 -13.295
  749   1HG   GLU  90          1HG       GLU  90  -9.411  -2.079 -13.050
  750   2HG   GLU  90          2HG       GLU  90  -9.039  -3.426 -11.992
  751    H    HIS  91           H        HIS  91 -10.245  -6.327 -13.357
  752    HA   HIS  91           HA       HIS  91  -8.106  -6.900 -11.545
  753   1HB   HIS  91          1HB       HIS  91 -10.547  -8.538 -11.582
  754   2HB   HIS  91          2HB       HIS  91  -9.082  -9.462 -11.851
  755    HD1  HIS  91           HD1      HIS  91 -10.968  -9.428  -9.206
  756    HD2  HIS  91           HD2      HIS  91  -7.216  -7.610  -9.675
  757    HE1  HIS  91           HE1      HIS  91 -10.004  -9.161  -6.858
  758    H    HIS  92           H        HIS  92  -6.343  -7.743 -12.649
  759    HA   HIS  92           HA       HIS  92  -6.869  -8.394 -15.457
  760   1HB   HIS  92          1HB       HIS  92  -4.894  -6.609 -14.168
  761   2HB   HIS  92          2HB       HIS  92  -4.244  -7.650 -15.419
  762    HD1  HIS  92           HD1      HIS  92  -4.401  -4.575 -15.817
  763    HD2  HIS  92           HD2      HIS  92  -7.329  -7.279 -17.122
  764    HE1  HIS  92           HE1      HIS  92  -5.653  -3.413 -17.710
  765    H    HIS  93           H        HIS  93  -4.930  -9.772 -16.389
  766    HA   HIS  93           HA       HIS  93  -4.822 -12.090 -14.724
  767   1HB   HIS  93          1HB       HIS  93  -4.915 -11.663 -17.421
  768   2HB   HIS  93          2HB       HIS  93  -3.210 -12.006 -17.203
  769    HD1  HIS  93           HD1      HIS  93  -4.655 -14.056 -18.795
  770    HD2  HIS  93           HD2      HIS  93  -4.549 -14.204 -14.604
  771    HE1  HIS  93           HE1      HIS  93  -5.135 -16.478 -18.153
  772    H    HIS  94           H        HIS  94  -3.037 -12.971 -13.659
  773    HA   HIS  94           HA       HIS  94  -0.505 -11.598 -13.951
  774   1HB   HIS  94          1HB       HIS  94  -0.241 -11.101 -11.633
  775   2HB   HIS  94          2HB       HIS  94  -1.739 -10.374 -12.177
  776    HD1  HIS  94           HD1      HIS  94  -3.937 -12.161 -11.721
  777    HD2  HIS  94           HD2      HIS  94  -0.555 -12.376  -9.250
  778    HE1  HIS  94           HE1      HIS  94  -4.688 -13.332  -9.582
  779    H    HIS  95           H        HIS  95   1.176 -12.816 -12.410
  780    HA   HIS  95           HA       HIS  95   0.623 -15.654 -12.835
  781   1HB   HIS  95          1HB       HIS  95   2.629 -14.301 -13.890
  782   2HB   HIS  95          2HB       HIS  95   3.366 -14.554 -12.321
  783    HD1  HIS  95           HD1      HIS  95   3.177 -16.074 -15.549
  784    HD2  HIS  95           HD2      HIS  95   3.216 -17.539 -11.619
  785    HE1  HIS  95           HE1      HIS  95   3.872 -18.526 -15.706
  786    H    HIS  96           H        HIS  96   0.072 -16.808 -11.062
  787    HA   HIS  96           HA       HIS  96  -0.014 -15.813  -8.535
  788   1HB   HIS  96          1HB       HIS  96  -0.332 -18.380  -9.835
  789   2HB   HIS  96          2HB       HIS  96   0.427 -18.587  -8.269
  790    HD1  HIS  96           HD1      HIS  96  -1.319 -19.156  -6.588
  791    HD2  HIS  96           HD2      HIS  96  -2.668 -16.286  -9.334
  792    HE1  HIS  96           HE1      HIS  96  -3.688 -18.535  -5.869
  Start of MODEL    4
    1   1H    MET   1          1H        MET   1  -4.454 -13.494   4.753
    2    HA   MET   1           HA       MET   1  -2.093 -11.850   4.808
    3   1HB   MET   1          1HB       MET   1  -3.368 -13.829   6.772
    4   2HB   MET   1          2HB       MET   1  -1.868 -12.993   7.123
    5   1HG   MET   1          1HG       MET   1  -3.154 -11.309   7.963
    6   2HG   MET   1          2HG       MET   1  -3.546 -10.909   6.302
    7   1HE   MET   1          1HE       MET   1  -6.532 -10.773   5.847
    8   2HE   MET   1          2HE       MET   1  -6.911 -10.420   7.549
    9   3HE   MET   1          3HE       MET   1  -5.390  -9.833   6.835
   10    H    GLU   2           H        GLU   2  -1.320 -13.129   2.785
   11    HA   GLU   2           HA       GLU   2   0.573 -15.019   3.734
   12   1HB   GLU   2          1HB       GLU   2  -0.136 -16.812   2.068
   13   2HB   GLU   2          2HB       GLU   2  -1.186 -16.628   3.459
   14   1HG   GLU   2          1HG       GLU   2  -2.135 -14.794   1.468
   15   2HG   GLU   2          2HG       GLU   2  -1.831 -16.311   0.646
   16    H    ASN   3           H        ASN   3   1.841 -13.140   2.944
   17    HA   ASN   3           HA       ASN   3   1.937 -13.098   0.031
   18   1HB   ASN   3          1HB       ASN   3   3.294 -10.946   1.636
   19   2HB   ASN   3          2HB       ASN   3   2.438 -10.813   0.112
   20   1HD2  ASN   3          1HD2      ASN   3   0.072 -12.162   0.829
   21   2HD2  ASN   3          2HD2      ASN   3  -0.828 -11.188   1.942
   22    H    LYS   4           H        LYS   4   3.831 -13.954  -0.856
   23    HA   LYS   4           HA       LYS   4   6.232 -13.915   0.817
   24   1HB   LYS   4          1HB       LYS   4   5.346 -16.120   1.139
   25   2HB   LYS   4          2HB       LYS   4   5.040 -16.324  -0.573
   26   1HG   LYS   4          1HG       LYS   4   7.723 -15.738  -0.636
   27   2HG   LYS   4          2HG       LYS   4   7.619 -16.513   0.932
   28   1HD   LYS   4          1HD       LYS   4   7.841 -18.449  -0.276
   29   2HD   LYS   4          2HD       LYS   4   6.119 -18.266  -0.542
   30   1HE   LYS   4          1HE       LYS   4   6.977 -16.701  -2.574
   31   2HE   LYS   4          2HE       LYS   4   8.402 -17.711  -2.427
   32   1HZ   LYS   4          1HZ       LYS   4   6.764 -18.624  -3.938
   33   2HZ   LYS   4          2HZ       LYS   4   7.022 -19.637  -2.683
   34   3HZ   LYS   4          3HZ       LYS   4   5.664 -18.732  -2.735
   35    H    LYS   5           H        LYS   5   7.830 -12.875  -0.234
   36    HA   LYS   5           HA       LYS   5   9.152 -12.192  -1.872
   37   1HB   LYS   5          1HB       LYS   5   8.012 -14.629  -2.989
   38   2HB   LYS   5          2HB       LYS   5   8.357 -13.452  -4.243
   39   1HG   LYS   5          1HG       LYS   5  10.665 -13.363  -3.721
   40   2HG   LYS   5          2HG       LYS   5  10.424 -13.951  -2.088
   41   1HD   LYS   5          1HD       LYS   5   9.598 -16.166  -3.215
   42   2HD   LYS   5          2HD       LYS   5  10.327 -15.539  -4.679
   43   1HE   LYS   5          1HE       LYS   5  12.408 -15.121  -2.986
   44   2HE   LYS   5          2HE       LYS   5  11.648 -16.451  -2.136
   45   1HZ   LYS   5          1HZ       LYS   5  12.383 -16.495  -4.983
   46   2HZ   LYS   5          2HZ       LYS   5  13.245 -17.188  -3.782
   47   3HZ   LYS   5          3HZ       LYS   5  11.752 -17.743  -4.137
   48    H    SER   6           H        SER   6   9.160 -10.596  -3.601
   49    HA   SER   6           HA       SER   6   8.252  -9.140  -4.992
   50   1HB   SER   6          1HB       SER   6   6.121  -9.341  -5.842
   51   2HB   SER   6          2HB       SER   6   6.245 -10.925  -5.103
   52    HG   SER   6           HG       SER   6   4.490 -10.354  -4.019
   53    H    HIS   7           H        HIS   7   6.130  -7.302  -4.594
   54    HA   HIS   7           HA       HIS   7   6.451  -6.467  -1.819
   55   1HB   HIS   7          1HB       HIS   7   7.051  -4.807  -4.275
   56   2HB   HIS   7          2HB       HIS   7   6.727  -4.094  -2.706
   57    HD1  HIS   7           HD1      HIS   7   8.835  -3.494  -1.531
   58    HD2  HIS   7           HD2      HIS   7   9.273  -6.963  -3.849
   59    HE1  HIS   7           HE1      HIS   7  11.250  -4.258  -1.225
   60    H    TYR   8           H        TYR   8   4.443  -6.312  -0.964
   61    HA   TYR   8           HA       TYR   8   2.249  -5.693  -2.808
   62   1HB   TYR   8          1HB       TYR   8   2.789  -7.368  -0.393
   63   2HB   TYR   8          2HB       TYR   8   1.311  -6.441  -0.229
   64    HD1  TYR   8           HD1      TYR   8   2.952  -9.210  -1.957
   65    HD2  TYR   8           HD2      TYR   8  -0.589  -6.815  -1.782
   66    HE1  TYR   8           HE1      TYR   8   1.706 -10.939  -3.342
   67    HE2  TYR   8           HE2      TYR   8  -1.823  -8.552  -3.168
   68    HH   TYR   8           HH       TYR   8  -1.009 -11.520  -3.475
   69    H    PHE   9           H        PHE   9   1.397  -3.678  -2.772
   70    HA   PHE   9           HA       PHE   9   2.178  -1.890  -0.663
   71   1HB   PHE   9          1HB       PHE   9   1.620  -1.713  -3.373
   72   2HB   PHE   9          2HB       PHE   9   0.064  -1.237  -2.720
   73    HD1  PHE   9           HD1      PHE   9   3.171  -0.056  -3.768
   74    HD2  PHE   9           HD2      PHE   9   0.226   0.592  -0.782
   75    HE1  PHE   9           HE1      PHE   9   4.027   2.280  -3.431
   76    HE2  PHE   9           HE2      PHE   9   1.083   2.926  -0.445
   77    HZ   PHE   9           HZ       PHE   9   2.974   3.743  -1.773
   78    H    TYR  10           H        TYR  10   1.145  -2.337   1.279
   79    HA   TYR  10           HA       TYR  10  -1.791  -2.485   1.153
   80   1HB   TYR  10          1HB       TYR  10   0.453  -3.762   2.707
   81   2HB   TYR  10          2HB       TYR  10  -0.924  -3.305   3.688
   82    HD1  TYR  10           HD1      TYR  10   0.424  -5.749   1.428
   83    HD2  TYR  10           HD2      TYR  10  -3.238  -4.208   3.018
   84    HE1  TYR  10           HE1      TYR  10  -0.779  -7.881   0.745
   85    HE2  TYR  10           HE2      TYR  10  -4.428  -6.345   2.328
   86    HH   TYR  10           HH       TYR  10  -4.197  -8.116   0.791
   87    H    VAL  11           H        VAL  11  -2.486  -0.378   1.391
   88    HA   VAL  11           HA       VAL  11  -1.136   1.308   3.322
   89    HB   VAL  11           HB       VAL  11  -3.024   1.629   1.064
   90   1HG1  VAL  11          1HG1      VAL  11  -4.489   2.668   2.539
   91   2HG1  VAL  11          2HG1      VAL  11  -3.180   3.282   3.576
   92   3HG1  VAL  11          3HG1      VAL  11  -3.483   4.029   1.991
   93   1HG2  VAL  11          1HG2      VAL  11  -0.812   3.416   2.132
   94   2HG2  VAL  11          2HG2      VAL  11  -0.579   2.112   0.942
   95   3HG2  VAL  11          3HG2      VAL  11  -1.601   3.513   0.538
   96    H    LEU  12           H        LEU  12  -1.596   0.574   5.389
   97    HA   LEU  12           HA       LEU  12  -4.259  -0.239   6.059
   98   1HB   LEU  12          1HB       LEU  12  -2.042   0.326   8.006
   99   2HB   LEU  12          2HB       LEU  12  -3.385  -0.789   8.159
  100    HG   LEU  12           HG       LEU  12  -1.843  -1.571   5.876
  101   1HD1  LEU  12          1HD1      LEU  12   0.183  -2.192   7.578
  102   2HD1  LEU  12          2HD1      LEU  12   0.201  -0.828   6.436
  103   3HD1  LEU  12          3HD1      LEU  12  -0.243  -0.558   8.138
  104   1HD2  LEU  12          1HD2      LEU  12  -2.194  -3.620   6.723
  105   2HD2  LEU  12          2HD2      LEU  12  -1.615  -3.168   8.345
  106   3HD2  LEU  12          3HD2      LEU  12  -3.280  -2.774   7.852
  107    H    LEU  13           H        LEU  13  -5.610   0.810   7.695
  108    HA   LEU  13           HA       LEU  13  -5.189   3.717   7.667
  109   1HB   LEU  13          1HB       LEU  13  -7.096   3.343   6.413
  110   2HB   LEU  13          2HB       LEU  13  -7.635   2.011   7.416
  111    HG   LEU  13           HG       LEU  13  -7.523   4.756   8.616
  112   1HD1  LEU  13          1HD1      LEU  13  -9.497   5.514   7.667
  113   2HD1  LEU  13          2HD1      LEU  13  -8.655   4.779   6.281
  114   3HD1  LEU  13          3HD1      LEU  13  -9.969   3.897   7.094
  115   1HD2  LEU  13          1HD2      LEU  13  -9.284   2.322   8.999
  116   2HD2  LEU  13          2HD2      LEU  13  -8.052   2.966  10.112
  117   3HD2  LEU  13          3HD2      LEU  13  -9.544   3.888   9.806
  118    H    CYS  14           H        CYS  14  -5.651   4.902   9.613
  119    HA   CYS  14           HA       CYS  14  -5.555   3.168  11.973
  120   1HB   CYS  14          1HB       CYS  14  -3.911   5.437  11.173
  121   2HB   CYS  14          2HB       CYS  14  -4.652   5.710  12.737
  122    HG   CYS  14           HG       CYS  14  -3.399   4.165  14.044
  123    H    GLN  15           H        GLN  15  -6.687   4.113  13.926
  124    HA   GLN  15           HA       GLN  15  -9.257   4.686  13.457
  125   1HB   GLN  15          1HB       GLN  15  -9.410   5.393  15.780
  126   2HB   GLN  15          2HB       GLN  15  -8.242   4.092  15.670
  127   1HG   GLN  15          1HG       GLN  15  -7.533   7.065  15.714
  128   2HG   GLN  15          2HG       GLN  15  -7.454   6.002  17.105
  129   1HE2  GLN  15          1HE2      GLN  15  -6.398   3.729  16.255
  130   2HE2  GLN  15          2HE2      GLN  15  -4.806   3.930  15.605
  131    H    ASP  16           H        ASP  16  -6.512   6.988  13.609
  132    HA   ASP  16           HA       ASP  16  -8.100   9.283  13.640
  133   1HB   ASP  16          1HB       ASP  16  -5.387   8.690  13.820
  134   2HB   ASP  16          2HB       ASP  16  -5.476   9.472  12.254
  135    H    GLY  17           H        GLY  17  -6.615   7.220  11.082
  136   1HA   GLY  17          1HA       GLY  17  -7.826   6.987   9.012
  137   2HA   GLY  17          2HA       GLY  17  -8.180   8.704   9.060
  138    H    SER  18           H        SER  18  -5.083   6.927   9.720
  139    HA   SER  18           HA       SER  18  -3.859   8.679   7.756
  140   1HB   SER  18          1HB       SER  18  -1.835   8.439   8.929
  141   2HB   SER  18          2HB       SER  18  -3.027   8.431  10.215
  142    HG   SER  18           HG       SER  18  -1.380   6.337   9.258
  143    H    PHE  19           H        PHE  19  -2.842   7.854   5.903
  144    HA   PHE  19           HA       PHE  19  -3.378   5.058   5.366
  145   1HB   PHE  19          1HB       PHE  19  -2.207   7.377   3.713
  146   2HB   PHE  19          2HB       PHE  19  -2.664   5.824   3.045
  147    HD1  PHE  19           HD1      PHE  19  -4.917   5.356   2.472
  148    HD2  PHE  19           HD2      PHE  19  -3.987   8.884   4.638
  149    HE1  PHE  19           HE1      PHE  19  -7.243   6.211   2.075
  150    HE2  PHE  19           HE2      PHE  19  -6.313   9.741   4.240
  151    HZ   PHE  19           HZ       PHE  19  -7.912   8.394   2.963
  152    H    TYR  20           H        TYR  20  -1.844   3.734   6.315
  153    HA   TYR  20           HA       TYR  20   0.941   4.539   6.212
  154   1HB   TYR  20          1HB       TYR  20  -0.638   3.254   8.041
  155   2HB   TYR  20          2HB       TYR  20  -0.160   1.846   7.115
  156    HD1  TYR  20           HD1      TYR  20   1.590   0.643   8.026
  157    HD2  TYR  20           HD2      TYR  20   1.559   4.894   8.497
  158    HE1  TYR  20           HE1      TYR  20   3.761   0.519   9.343
  159    HE2  TYR  20           HE2      TYR  20   3.730   4.757   9.812
  160    HH   TYR  20           HH       TYR  20   5.259   3.477  10.629
  161    H    GLY  21           H        GLY  21   1.520   4.417   3.999
  162   1HA   GLY  21          1HA       GLY  21   0.897   2.133   2.403
  163   2HA   GLY  21          2HA       GLY  21   2.005   3.437   2.022
  164    H    GLY  22           H        GLY  22   1.708   0.143   2.998
  165   1HA   GLY  22          1HA       GLY  22   4.573   0.041   3.729
  166   2HA   GLY  22          2HA       GLY  22   3.346  -1.070   4.307
  167    H    TYR  23           H        TYR  23   5.907  -0.920   2.265
  168    HA   TYR  23           HA       TYR  23   4.631  -2.589   0.209
  169   1HB   TYR  23          1HB       TYR  23   6.860  -1.966  -0.974
  170   2HB   TYR  23          2HB       TYR  23   5.791  -0.611  -0.672
  171    HD1  TYR  23           HD1      TYR  23   8.997  -2.156   0.141
  172    HD2  TYR  23           HD2      TYR  23   6.300   1.010   1.146
  173    HE1  TYR  23           HE1      TYR  23  10.855  -0.963   1.399
  174    HE2  TYR  23           HE2      TYR  23   8.169   2.192   2.400
  175    HH   TYR  23           HH       TYR  23  10.188   1.946   3.266
  176    H    THR  24           H        THR  24   4.664  -4.629   1.207
  177    HA   THR  24           HA       THR  24   7.143  -5.986   1.115
  178    HB   THR  24           HB       THR  24   6.967  -4.540   3.410
  179    HG1  THR  24           HG1      THR  24   8.232  -6.520   4.238
  180   1HG2  THR  24          1HG2      THR  24   4.814  -5.986   3.965
  181   2HG2  THR  24          2HG2      THR  24   5.991  -7.284   4.275
  182   3HG2  THR  24          3HG2      THR  24   6.056  -5.778   5.221
  183    H    THR  25           H        THR  25   6.767  -8.285   2.311
  184    HA   THR  25           HA       THR  25   4.003  -9.080   1.692
  185    HB   THR  25           HB       THR  25   4.825 -10.923   0.380
  186    HG1  THR  25           HG1      THR  25   7.420 -10.032   1.430
  187   1HG2  THR  25          1HG2      THR  25   6.807  -8.648  -0.150
  188   2HG2  THR  25          2HG2      THR  25   6.368  -9.947  -1.285
  189   3HG2  THR  25          3HG2      THR  25   5.162  -8.720  -0.827
  190    H    GLU  26           H        GLU  26   3.011 -10.061   3.333
  191    HA   GLU  26           HA       GLU  26   2.703 -11.370   5.060
  192   1HB   GLU  26          1HB       GLU  26   5.173 -12.391   4.081
  193   2HB   GLU  26          2HB       GLU  26   5.394 -12.201   5.810
  194   1HG   GLU  26          1HG       GLU  26   2.968 -13.592   4.586
  195   2HG   GLU  26          2HG       GLU  26   4.419 -14.449   5.064
  196    HA   PRO  27           HA       PRO  27   4.230  -7.902   7.547
  197   1HB   PRO  27          1HB       PRO  27   1.801  -6.832   8.199
  198   2HB   PRO  27          2HB       PRO  27   2.756  -6.283   6.836
  199   1HG   PRO  27          1HG       PRO  27   0.322  -7.961   6.839
  200   2HG   PRO  27          2HG       PRO  27   1.034  -7.060   5.513
  201   1HD   PRO  27          1HD       PRO  27   1.186  -9.893   5.940
  202   2HD   PRO  27          2HD       PRO  27   1.992  -8.978   4.683
  203    H    GLU  28           H        GLU  28   2.565 -10.702   7.996
  204    HA   GLU  28           HA       GLU  28   1.713 -10.434  10.602
  205   1HB   GLU  28          1HB       GLU  28   2.376 -12.679   8.754
  206   2HB   GLU  28          2HB       GLU  28   2.413 -13.087  10.458
  207   1HG   GLU  28          1HG       GLU  28   0.065 -11.443   9.839
  208   2HG   GLU  28          2HG       GLU  28   0.117 -12.859   8.808
  209    H    ARG  29           H        ARG  29   4.775 -12.019   9.416
  210    HA   ARG  29           HA       ARG  29   5.848 -12.239  11.951
  211   1HB   ARG  29          1HB       ARG  29   8.016 -12.633  10.733
  212   2HB   ARG  29          2HB       ARG  29   6.691 -13.565  10.062
  213   1HG   ARG  29          1HG       ARG  29   6.396 -11.441   8.472
  214   2HG   ARG  29          2HG       ARG  29   8.061 -11.123   8.915
  215   1HD   ARG  29          1HD       ARG  29   7.424 -13.940   8.093
  216   2HD   ARG  29          2HD       ARG  29   7.365 -12.731   6.827
  217    HE   ARG  29           HE       ARG  29   9.698 -12.424   7.009
  218   1HH1  ARG  29          1HH1      ARG  29   8.522 -14.401   9.673
  219   2HH1  ARG  29          2HH1      ARG  29  10.106 -14.862  10.197
  220   1HH2  ARG  29          1HH2      ARG  29  11.788 -13.034   7.701
  221   2HH2  ARG  29          2HH2      ARG  29  11.977 -14.080   9.068
  222    H    ARG  30           H        ARG  30   5.878  -9.625   9.516
  223    HA   ARG  30           HA       ARG  30   7.978  -8.188  10.641
  224   1HB   ARG  30          1HB       ARG  30   6.844  -7.943   8.304
  225   2HB   ARG  30          2HB       ARG  30   5.635  -6.969   9.116
  226   1HG   ARG  30          1HG       ARG  30   7.499  -5.481   9.989
  227   2HG   ARG  30          2HG       ARG  30   8.637  -6.411   9.034
  228   1HD   ARG  30          1HD       ARG  30   7.571  -5.743   6.950
  229   2HD   ARG  30          2HD       ARG  30   6.198  -5.057   7.796
  230    HE   ARG  30           HE       ARG  30   8.557  -3.758   8.747
  231   1HH1  ARG  30          1HH1      ARG  30   6.622  -3.988   5.816
  232   2HH1  ARG  30          2HH1      ARG  30   7.061  -2.411   5.251
  233   1HH2  ARG  30          1HH2      ARG  30   9.135  -1.676   8.001
  234   2HH2  ARG  30          2HH2      ARG  30   8.499  -1.087   6.502
  235    H    LEU  31           H        LEU  31   4.387  -8.105  11.047
  236    HA   LEU  31           HA       LEU  31   4.261  -5.842  12.654
  237   1HB   LEU  31          1HB       LEU  31   2.534  -8.147  12.001
  238   2HB   LEU  31          2HB       LEU  31   2.173  -7.338  13.512
  239    HG   LEU  31           HG       LEU  31   2.376  -5.916  10.845
  240   1HD1  LEU  31          1HD1      LEU  31   0.456  -6.942  10.341
  241   2HD1  LEU  31          2HD1      LEU  31   0.202  -7.506  12.011
  242   3HD1  LEU  31          3HD1      LEU  31  -0.278  -5.856  11.545
  243   1HD2  LEU  31          1HD2      LEU  31   1.718  -5.059  13.635
  244   2HD2  LEU  31          2HD2      LEU  31   2.670  -4.237  12.377
  245   3HD2  LEU  31          3HD2      LEU  31   0.894  -4.267  12.270
  246    H    THR  32           H        THR  32   3.961  -9.282  13.790
  247    HA   THR  32           HA       THR  32   4.213  -8.864  16.444
  248    HB   THR  32           HB       THR  32   3.788 -11.051  15.303
  249    HG1  THR  32           HG1      THR  32   4.500 -11.281  17.448
  250   1HG2  THR  32          1HG2      THR  32   6.821 -11.125  14.911
  251   2HG2  THR  32          2HG2      THR  32   5.644 -12.374  14.435
  252   3HG2  THR  32          3HG2      THR  32   5.681 -10.812  13.582
  253    H    GLU  33           H        GLU  33   6.873  -8.854  14.036
  254    HA   GLU  33           HA       GLU  33   8.867  -8.697  16.009
  255   1HB   GLU  33          1HB       GLU  33   9.262  -9.512  13.686
  256   2HB   GLU  33          2HB       GLU  33   8.951  -7.905  13.065
  257   1HG   GLU  33          1HG       GLU  33  10.864  -7.364  14.988
  258   2HG   GLU  33          2HG       GLU  33  11.360  -8.961  14.463
  259    H    HIS  34           H        HIS  34   7.609  -6.217  13.655
  260    HA   HIS  34           HA       HIS  34   8.949  -4.068  14.629
  261   1HB   HIS  34          1HB       HIS  34   7.850  -3.536  12.723
  262   2HB   HIS  34          2HB       HIS  34   6.449  -4.515  13.114
  263    HD1  HIS  34           HD1      HIS  34   4.761  -3.403  14.978
  264    HD2  HIS  34           HD2      HIS  34   7.499  -0.836  13.105
  265    HE1  HIS  34           HE1      HIS  34   3.894  -1.033  15.355
  266    H    ASN  35           H        ASN  35   5.633  -5.171  15.638
  267    HA   ASN  35           HA       ASN  35   5.096  -3.329  17.483
  268   1HB   ASN  35          1HB       ASN  35   4.366  -6.141  17.019
  269   2HB   ASN  35          2HB       ASN  35   4.346  -5.775  18.734
  270   1HD2  ASN  35          1HD2      ASN  35   2.869  -5.308  15.672
  271   2HD2  ASN  35          2HD2      ASN  35   1.521  -4.335  16.162
  272    H    SER  36           H        SER  36   7.155  -6.290  17.840
  273    HA   SER  36           HA       SER  36   7.645  -5.888  20.570
  274   1HB   SER  36          1HB       SER  36   8.451  -7.754  18.457
  275   2HB   SER  36          2HB       SER  36   9.798  -7.385  19.517
  276    HG   SER  36           HG       SER  36   8.918  -8.803  20.853
  277    H    GLY  37           H        GLY  37   9.547  -5.232  17.546
  278   1HA   GLY  37          1HA       GLY  37  11.642  -3.896  19.034
  279   2HA   GLY  37          2HA       GLY  37  11.538  -4.135  17.301
  280    H    THR  38           H        THR  38  11.463  -2.215  16.229
  281    HA   THR  38           HA       THR  38  10.970  -0.108  15.715
  282    HB   THR  38           HB       THR  38   8.420  -0.822  17.259
  283    HG1  THR  38           HG1      THR  38   8.852  -2.173  15.418
  284   1HG2  THR  38          1HG2      THR  38   8.089   1.479  16.915
  285   2HG2  THR  38          2HG2      THR  38   9.211   1.532  15.534
  286   3HG2  THR  38          3HG2      THR  38   7.579   0.851  15.329
  287    H    GLY  39           H        GLY  39   9.178   0.136  18.803
  288   1HA   GLY  39          1HA       GLY  39  10.852   0.899  20.666
  289   2HA   GLY  39          2HA       GLY  39  11.027   2.270  19.587
  290    H    ALA  40           H        ALA  40  10.102   3.712  21.177
  291    HA   ALA  40           HA       ALA  40   7.410   4.214  20.859
  292   1HB   ALA  40          1HB       ALA  40   7.549   3.330  23.659
  293   2HB   ALA  40          2HB       ALA  40   6.294   3.038  22.431
  294   3HB   ALA  40          3HB       ALA  40   7.730   1.991  22.501
  295    H    LYS  41           H        LYS  41   6.745   6.114  22.108
  296    HA   LYS  41           HA       LYS  41   8.886   7.857  22.562
  297   1HB   LYS  41          1HB       LYS  41   6.205   8.111  22.094
  298   2HB   LYS  41          2HB       LYS  41   6.282   8.526  23.795
  299   1HG   LYS  41          1HG       LYS  41   8.493   9.873  22.697
  300   2HG   LYS  41          2HG       LYS  41   7.265  10.033  21.457
  301   1HD   LYS  41          1HD       LYS  41   6.634  10.611  24.378
  302   2HD   LYS  41          2HD       LYS  41   7.345  11.835  23.344
  303   1HE   LYS  41          1HE       LYS  41   5.122  12.316  22.927
  304   2HE   LYS  41          2HE       LYS  41   5.340  11.087  21.698
  305   1HZ   LYS  41          1HZ       LYS  41   4.258   9.540  22.962
  306   2HZ   LYS  41          2HZ       LYS  41   4.549  10.288  24.384
  307   3HZ   LYS  41          3HZ       LYS  41   3.425  10.887  23.361
  308    H    TYR  42           H        TYR  42   6.521   6.414  24.920
  309    HA   TYR  42           HA       TYR  42   8.703   6.373  26.871
  310   1HB   TYR  42          1HB       TYR  42   6.177   7.960  26.771
  311   2HB   TYR  42          2HB       TYR  42   6.280   7.001  28.235
  312    HD1  TYR  42           HD1      TYR  42   6.839  10.156  27.049
  313    HD2  TYR  42           HD2      TYR  42   8.898   7.101  29.226
  314    HE1  TYR  42           HE1      TYR  42   8.349  11.911  28.099
  315    HE2  TYR  42           HE2      TYR  42  10.402   8.867  30.267
  316    HH   TYR  42           HH       TYR  42  10.389  11.184  30.745
  317    H    THR  43           H        THR  43   5.254   5.481  26.161
  318    HA   THR  43           HA       THR  43   5.606   3.091  27.808
  319    HB   THR  43           HB       THR  43   3.121   2.976  27.576
  320    HG1  THR  43           HG1      THR  43   2.177   4.374  26.062
  321   1HG2  THR  43          1HG2      THR  43   4.512   5.046  28.907
  322   2HG2  THR  43          2HG2      THR  43   3.260   5.891  27.963
  323   3HG2  THR  43          3HG2      THR  43   2.796   4.629  29.128
  324    H    ARG  44           H        ARG  44   6.156   1.184  26.975
  325    HA   ARG  44           HA       ARG  44   6.115   0.979  24.108
  326   1HB   ARG  44          1HB       ARG  44   7.437  -1.127  24.516
  327   2HB   ARG  44          2HB       ARG  44   8.171   0.282  25.257
  328   1HG   ARG  44          1HG       ARG  44   8.047  -0.681  27.304
  329   2HG   ARG  44          2HG       ARG  44   6.308  -0.840  27.155
  330   1HD   ARG  44          1HD       ARG  44   7.846  -2.825  25.552
  331   2HD   ARG  44          2HD       ARG  44   8.084  -2.966  27.282
  332    HE   ARG  44           HE       ARG  44   5.277  -2.656  26.728
  333   1HH1  ARG  44          1HH1      ARG  44   7.876  -5.012  26.470
  334   2HH1  ARG  44          2HH1      ARG  44   6.819  -6.380  26.571
  335   1HH2  ARG  44          1HH2      ARG  44   3.879  -4.459  26.860
  336   2HH2  ARG  44          2HH2      ARG  44   4.531  -6.064  26.796
  337    H    LEU  45           H        LEU  45   3.650   0.837  25.978
  338    HA   LEU  45           HA       LEU  45   2.807  -1.910  25.483
  339   1HB   LEU  45          1HB       LEU  45   2.535  -1.012  27.730
  340   2HB   LEU  45          2HB       LEU  45   1.576   0.317  27.111
  341    HG   LEU  45           HG       LEU  45   0.356  -2.106  26.219
  342   1HD1  LEU  45          1HD1      LEU  45   1.078  -2.106  29.161
  343   2HD1  LEU  45          2HD1      LEU  45  -0.216  -3.098  28.445
  344   3HD1  LEU  45          3HD1      LEU  45   1.474  -3.339  27.939
  345   1HD2  LEU  45          1HD2      LEU  45  -1.483  -1.258  27.784
  346   2HD2  LEU  45          2HD2      LEU  45  -0.393   0.106  28.128
  347   3HD2  LEU  45          3HD2      LEU  45  -0.959  -0.183  26.466
  348    H    ALA  46           H        ALA  46   3.252   0.160  23.332
  349    HA   ALA  46           HA       ALA  46   0.767   1.136  22.477
  350   1HB   ALA  46          1HB       ALA  46   3.499   0.713  21.320
  351   2HB   ALA  46          2HB       ALA  46   2.155   1.005  20.190
  352   3HB   ALA  46          3HB       ALA  46   2.534   2.202  21.453
  353    H    LYS  47           H        LYS  47  -0.811  -0.529  22.683
  354    HA   LYS  47           HA       LYS  47  -0.417  -2.763  20.817
  355   1HB   LYS  47          1HB       LYS  47  -0.737  -3.103  23.400
  356   2HB   LYS  47          2HB       LYS  47  -2.426  -2.795  23.053
  357   1HG   LYS  47          1HG       LYS  47  -1.100  -4.702  21.180
  358   2HG   LYS  47          2HG       LYS  47  -1.212  -5.266  22.836
  359   1HD   LYS  47          1HD       LYS  47  -3.613  -4.110  21.354
  360   2HD   LYS  47          2HD       LYS  47  -3.203  -5.812  21.274
  361   1HE   LYS  47          1HE       LYS  47  -4.634  -5.882  23.098
  362   2HE   LYS  47          2HE       LYS  47  -3.135  -5.576  23.951
  363   1HZ   LYS  47          1HZ       LYS  47  -4.540  -3.250  22.991
  364   2HZ   LYS  47          2HZ       LYS  47  -5.257  -4.066  24.212
  365   3HZ   LYS  47          3HZ       LYS  47  -3.745  -3.481  24.400
  366    H    ARG  48           H        ARG  48  -2.712  -0.275  22.063
  367    HA   ARG  48           HA       ARG  48  -4.818  -0.914  20.455
  368   1HB   ARG  48          1HB       ARG  48  -3.955   1.351  22.090
  369   2HB   ARG  48          2HB       ARG  48  -4.745   1.940  20.642
  370   1HG   ARG  48          1HG       ARG  48  -6.762   0.677  21.109
  371   2HG   ARG  48          2HG       ARG  48  -5.971  -0.256  22.365
  372   1HD   ARG  48          1HD       ARG  48  -6.631   1.286  23.893
  373   2HD   ARG  48          2HD       ARG  48  -5.619   2.479  23.103
  374    HE   ARG  48           HE       ARG  48  -8.053   2.206  21.610
  375   1HH1  ARG  48          1HH1      ARG  48  -6.884   3.471  24.679
  376   2HH1  ARG  48          2HH1      ARG  48  -8.130   4.664  24.808
  377   1HH2  ARG  48          1HH2      ARG  48  -9.698   3.783  21.779
  378   2HH2  ARG  48          2HH2      ARG  48  -9.742   4.843  23.147
  379    H    ARG  49           H        ARG  49  -4.079  -1.498  18.318
  380    HA   ARG  49           HA       ARG  49  -3.478   0.840  16.718
  381   1HB   ARG  49          1HB       ARG  49  -1.920  -1.781  16.762
  382   2HB   ARG  49          2HB       ARG  49  -1.893  -0.737  15.355
  383   1HG   ARG  49          1HG       ARG  49  -1.436   0.814  17.800
  384   2HG   ARG  49          2HG       ARG  49  -0.290  -0.506  17.684
  385   1HD   ARG  49          1HD       ARG  49   0.758   0.378  15.822
  386   2HD   ARG  49          2HD       ARG  49  -0.737   0.981  15.133
  387    HE   ARG  49           HE       ARG  49   1.071   2.434  16.902
  388   1HH1  ARG  49          1HH1      ARG  49  -2.268   2.187  15.823
  389   2HH1  ARG  49          2HH1      ARG  49  -2.651   3.830  16.216
  390   1HH2  ARG  49          1HH2      ARG  49   0.567   4.601  17.423
  391   2HH2  ARG  49          2HH2      ARG  49  -1.028   5.212  17.132
  392    HA   PRO  50           HA       PRO  50  -6.774  -1.624  14.871
  393   1HB   PRO  50          1HB       PRO  50  -8.391   0.463  14.168
  394   2HB   PRO  50          2HB       PRO  50  -8.533  -0.388  15.693
  395   1HG   PRO  50          1HG       PRO  50  -7.394   2.288  15.161
  396   2HG   PRO  50          2HG       PRO  50  -7.929   1.606  16.684
  397   1HD   PRO  50          1HD       PRO  50  -5.218   1.914  15.800
  398   2HD   PRO  50          2HD       PRO  50  -5.757   1.128  17.270
  399    H    VAL  51           H        VAL  51  -4.745  -1.950  13.489
  400    HA   VAL  51           HA       VAL  51  -4.709  -0.248  11.179
  401    HB   VAL  51           HB       VAL  51  -2.931  -1.780  10.441
  402   1HG1  VAL  51          1HG1      VAL  51  -2.059  -1.364  13.212
  403   2HG1  VAL  51          2HG1      VAL  51  -1.443  -0.664  11.696
  404   3HG1  VAL  51          3HG1      VAL  51  -2.857   0.059  12.501
  405   1HG2  VAL  51          1HG2      VAL  51  -2.925  -3.895  11.153
  406   2HG2  VAL  51          2HG2      VAL  51  -2.407  -3.305  12.751
  407   3HG2  VAL  51          3HG2      VAL  51  -4.138  -3.530  12.403
  408    H    ILE  52           H        ILE  52  -6.498  -0.370   9.879
  409    HA   ILE  52           HA       ILE  52  -7.426  -3.070   9.206
  410    HB   ILE  52           HB       ILE  52  -9.541  -2.286   9.033
  411   1HG1  ILE  52          1HG1      ILE  52  -8.440   0.462   8.387
  412   2HG1  ILE  52          2HG1      ILE  52  -9.125  -0.684   7.252
  413   1HG2  ILE  52          1HG2      ILE  52  -8.616  -0.079  10.856
  414   2HG2  ILE  52          2HG2      ILE  52 -10.073  -1.096  10.956
  415   3HG2  ILE  52          3HG2      ILE  52  -8.479  -1.787  11.337
  416   1HD1  ILE  52          1HD1      ILE  52 -10.688   1.192   8.088
  417   2HD1  ILE  52          2HD1      ILE  52 -11.326  -0.468   8.181
  418   3HD1  ILE  52          3HD1      ILE  52 -10.708   0.331   9.647
  419    H    MET  53           H        MET  53  -7.988  -3.496   6.935
  420    HA   MET  53           HA       MET  53  -6.068  -2.167   5.240
  421   1HB   MET  53          1HB       MET  53  -7.225  -4.822   5.488
  422   2HB   MET  53          2HB       MET  53  -7.585  -4.231   3.879
  423   1HG   MET  53          1HG       MET  53  -5.419  -4.461   3.206
  424   2HG   MET  53          2HG       MET  53  -4.812  -3.612   4.614
  425   1HE   MET  53          1HE       MET  53  -2.789  -5.411   5.849
  426   2HE   MET  53          2HE       MET  53  -4.052  -4.335   6.489
  427   3HE   MET  53          3HE       MET  53  -3.880  -5.986   7.131
  428    H    ILE  54           H        ILE  54  -6.599  -1.116   3.256
  429    HA   ILE  54           HA       ILE  54  -9.397  -0.911   2.552
  430    HB   ILE  54           HB       ILE  54  -9.253   1.594   2.532
  431   1HG1  ILE  54          1HG1      ILE  54  -7.509   2.152   4.599
  432   2HG1  ILE  54          2HG1      ILE  54  -6.607   0.982   3.655
  433   1HG2  ILE  54          1HG2      ILE  54 -10.604   0.422   4.161
  434   2HG2  ILE  54          2HG2      ILE  54  -9.185   0.163   5.203
  435   3HG2  ILE  54          3HG2      ILE  54  -9.802   1.811   4.932
  436   1HD1  ILE  54          1HD1      ILE  54  -6.685   2.318   1.683
  437   2HD1  ILE  54          2HD1      ILE  54  -8.018   3.314   2.313
  438   3HD1  ILE  54          3HD1      ILE  54  -6.382   3.482   2.995
  439    H    HIS  55           H        HIS  55  -5.984   0.153   2.009
  440    HA   HIS  55           HA       HIS  55  -6.569  -0.022  -0.856
  441   1HB   HIS  55          1HB       HIS  55  -4.966   1.902   0.757
  442   2HB   HIS  55          2HB       HIS  55  -4.319   1.450  -0.807
  443    HD1  HIS  55           HD1      HIS  55  -6.614   1.457  -2.692
  444    HD2  HIS  55           HD2      HIS  55  -6.349   4.222   0.451
  445    HE1  HIS  55           HE1      HIS  55  -8.085   3.434  -3.354
  446    H    THR  56           H        THR  56  -5.638  -1.713  -1.890
  447    HA   THR  56           HA       THR  56  -3.148  -2.778  -0.738
  448    HB   THR  56           HB       THR  56  -4.161  -5.052  -1.532
  449    HG1  THR  56           HG1      THR  56  -6.490  -4.890  -1.760
  450   1HG2  THR  56          1HG2      THR  56  -5.956  -3.884   0.594
  451   2HG2  THR  56          2HG2      THR  56  -5.105  -5.448   0.572
  452   3HG2  THR  56          3HG2      THR  56  -4.211  -3.953   0.940
  453    H    GLU  57           H        GLU  57  -1.771  -3.938  -2.282
  454    HA   GLU  57           HA       GLU  57  -2.341  -3.781  -5.014
  455   1HB   GLU  57          1HB       GLU  57  -1.519  -1.327  -4.001
  456   2HB   GLU  57          2HB       GLU  57  -0.008  -2.012  -4.568
  457   1HG   GLU  57          1HG       GLU  57  -1.011  -2.430  -6.806
  458   2HG   GLU  57          2HG       GLU  57  -2.555  -1.819  -6.246
  459    H    LYS  58           H        LYS  58  -0.446  -4.580  -6.344
  460    HA   LYS  58           HA       LYS  58   1.637  -5.801  -4.707
  461   1HB   LYS  58          1HB       LYS  58   1.320  -7.976  -5.678
  462   2HB   LYS  58          2HB       LYS  58  -0.185  -7.463  -4.943
  463   1HG   LYS  58          1HG       LYS  58   0.032  -6.614  -7.765
  464   2HG   LYS  58          2HG       LYS  58   0.142  -8.355  -7.582
  465   1HD   LYS  58          1HD       LYS  58  -1.983  -7.216  -5.889
  466   2HD   LYS  58          2HD       LYS  58  -2.221  -6.820  -7.580
  467   1HE   LYS  58          1HE       LYS  58  -2.707  -8.985  -8.150
  468   2HE   LYS  58          2HE       LYS  58  -1.410  -9.638  -7.167
  469   1HZ   LYS  58          1HZ       LYS  58  -4.116  -9.484  -6.556
  470   2HZ   LYS  58          2HZ       LYS  58  -2.919 -10.166  -5.678
  471   3HZ   LYS  58          3HZ       LYS  58  -3.305  -8.596  -5.450
  472    H    PHE  59           H        PHE  59   3.548  -6.433  -5.990
  473    HA   PHE  59           HA       PHE  59   3.636  -5.577  -8.720
  474   1HB   PHE  59          1HB       PHE  59   5.117  -4.145  -6.434
  475   2HB   PHE  59          2HB       PHE  59   5.535  -3.921  -8.121
  476    HD1  PHE  59           HD1      PHE  59   3.695  -3.020  -9.679
  477    HD2  PHE  59           HD2      PHE  59   3.461  -2.827  -5.446
  478    HE1  PHE  59           HE1      PHE  59   1.990  -1.186  -9.857
  479    HE2  PHE  59           HE2      PHE  59   1.756  -0.993  -5.624
  480    HZ   PHE  59           HZ       PHE  59   1.040  -0.194  -7.828
  481    H    GLU  60           H        GLU  60   4.832  -7.149  -9.676
  482    HA   GLU  60           HA       GLU  60   6.711  -8.572  -8.021
  483   1HB   GLU  60          1HB       GLU  60   6.862 -10.066 -10.104
  484   2HB   GLU  60          2HB       GLU  60   5.309 -10.014  -9.296
  485   1HG   GLU  60          1HG       GLU  60   4.281  -8.856 -11.021
  486   2HG   GLU  60          2HG       GLU  60   5.726  -7.953 -11.427
  487    H    THR  61           H        THR  61   6.790  -5.768  -9.781
  488    HA   THR  61           HA       THR  61   9.603  -6.211 -10.538
  489    HB   THR  61           HB       THR  61   9.106  -4.581 -12.427
  490    HG1  THR  61           HG1      THR  61   6.884  -4.011 -12.645
  491   1HG2  THR  61          1HG2      THR  61   6.970  -6.514 -12.985
  492   2HG2  THR  61          2HG2      THR  61   8.555  -6.343 -13.778
  493   3HG2  THR  61          3HG2      THR  61   8.398  -7.330 -12.304
  494    H    ARG  62           H        ARG  62  11.078  -4.589 -10.059
  495    HA   ARG  62           HA       ARG  62  10.374  -3.059  -7.835
  496   1HB   ARG  62          1HB       ARG  62  12.797  -3.497  -9.526
  497   2HB   ARG  62          2HB       ARG  62  12.752  -1.943  -8.717
  498   1HG   ARG  62          1HG       ARG  62  12.038  -3.450  -6.606
  499   2HG   ARG  62          2HG       ARG  62  12.849  -4.708  -7.515
  500   1HD   ARG  62          1HD       ARG  62  14.436  -2.234  -7.503
  501   2HD   ARG  62          2HD       ARG  62  14.071  -2.755  -5.869
  502    HE   ARG  62           HE       ARG  62  15.392  -4.684  -6.188
  503   1HH1  ARG  62          1HH1      ARG  62  14.882  -3.048  -9.261
  504   2HH1  ARG  62          2HH1      ARG  62  16.053  -4.002 -10.109
  505   1HH2  ARG  62          1HH2      ARG  62  16.937  -5.942  -7.304
  506   2HH2  ARG  62          2HH2      ARG  62  17.231  -5.658  -8.989
  507    H    SER  63           H        SER  63  11.133  -2.239 -11.292
  508    HA   SER  63           HA       SER  63  11.079   0.418 -11.226
  509   1HB   SER  63          1HB       SER  63   9.623  -1.275 -13.304
  510   2HB   SER  63          2HB       SER  63  10.225   0.352 -13.549
  511    HG   SER  63           HG       SER  63  11.630  -1.446 -14.344
  512    H    GLU  64           H        GLU  64   8.086  -1.533 -11.964
  513    HA   GLU  64           HA       GLU  64   6.322   0.509 -11.794
  514   1HB   GLU  64          1HB       GLU  64   6.102  -2.457 -11.251
  515   2HB   GLU  64          2HB       GLU  64   4.707  -1.433 -10.981
  516   1HG   GLU  64          1HG       GLU  64   5.968  -0.786 -13.543
  517   2HG   GLU  64          2HG       GLU  64   5.596  -2.497 -13.458
  518    H    ALA  65           H        ALA  65   7.390  -1.702  -9.119
  519    HA   ALA  65           HA       ALA  65   5.832  -0.772  -7.099
  520   1HB   ALA  65          1HB       ALA  65   7.112  -2.483  -6.330
  521   2HB   ALA  65          2HB       ALA  65   8.481  -2.061  -7.386
  522   3HB   ALA  65          3HB       ALA  65   8.242  -1.196  -5.849
  523    H    THR  66           H        THR  66   9.222   0.409  -7.700
  524    HA   THR  66           HA       THR  66   9.056   2.598  -6.024
  525    HB   THR  66           HB       THR  66  11.133   1.608  -7.046
  526    HG1  THR  66           HG1      THR  66  12.028   3.726  -7.176
  527   1HG2  THR  66          1HG2      THR  66   9.901   2.838  -9.542
  528   2HG2  THR  66          2HG2      THR  66  11.668   2.751  -9.363
  529   3HG2  THR  66          3HG2      THR  66  10.700   1.258  -9.363
  530    H    LYS  67           H        LYS  67   7.767   2.147  -9.296
  531    HA   LYS  67           HA       LYS  67   7.406   4.890  -9.835
  532   1HB   LYS  67          1HB       LYS  67   7.096   2.456 -11.194
  533   2HB   LYS  67          2HB       LYS  67   5.484   3.140 -11.140
  534   1HG   LYS  67          1HG       LYS  67   6.061   4.983 -12.429
  535   2HG   LYS  67          2HG       LYS  67   7.698   5.048 -11.808
  536   1HD   LYS  67          1HD       LYS  67   7.929   2.713 -13.116
  537   2HD   LYS  67          2HD       LYS  67   6.578   3.347 -14.036
  538   1HE   LYS  67          1HE       LYS  67   8.908   5.197 -13.554
  539   2HE   LYS  67          2HE       LYS  67   9.146   3.886 -14.692
  540   1HZ   LYS  67          1HZ       LYS  67   8.296   5.803 -15.799
  541   2HZ   LYS  67          2HZ       LYS  67   7.155   4.636 -15.846
  542   3HZ   LYS  67          3HZ       LYS  67   7.000   5.889 -14.811
  543    H    ALA  68           H        ALA  68   5.270   2.316  -8.452
  544    HA   ALA  68           HA       ALA  68   2.974   3.808  -8.215
  545   1HB   ALA  68          1HB       ALA  68   2.301   1.857  -7.330
  546   2HB   ALA  68          2HB       ALA  68   3.989   1.298  -7.360
  547   3HB   ALA  68          3HB       ALA  68   3.343   2.102  -5.909
  548    H    GLU  69           H        GLU  69   5.961   3.820  -6.252
  549    HA   GLU  69           HA       GLU  69   4.842   5.293  -4.145
  550   1HB   GLU  69          1HB       GLU  69   7.041   3.861  -4.266
  551   2HB   GLU  69          2HB       GLU  69   7.785   5.330  -4.866
  552   1HG   GLU  69          1HG       GLU  69   6.222   6.110  -2.604
  553   2HG   GLU  69          2HG       GLU  69   7.051   4.639  -2.132
  554    H    ALA  70           H        ALA  70   7.168   6.257  -6.779
  555    HA   ALA  70           HA       ALA  70   7.311   8.908  -6.314
  556   1HB   ALA  70          1HB       ALA  70   8.639   8.303  -8.073
  557   2HB   ALA  70          2HB       ALA  70   7.448   7.143  -8.711
  558   3HB   ALA  70          3HB       ALA  70   7.254   8.883  -9.028
  559    H    ALA  71           H        ALA  71   4.541   7.060  -7.556
  560    HA   ALA  71           HA       ALA  71   3.127   9.449  -8.333
  561   1HB   ALA  71          1HB       ALA  71   1.831   6.756  -8.033
  562   2HB   ALA  71          2HB       ALA  71   1.606   7.993  -9.293
  563   3HB   ALA  71          3HB       ALA  71   3.062   6.971  -9.299
  564    H    PHE  72           H        PHE  72   2.888   6.884  -5.778
  565    HA   PHE  72           HA       PHE  72   0.697   7.787  -4.457
  566   1HB   PHE  72          1HB       PHE  72   2.010   5.730  -3.923
  567   2HB   PHE  72          2HB       PHE  72   3.398   6.698  -3.466
  568    HD1  PHE  72           HD1      PHE  72   3.228   8.157  -1.404
  569    HD2  PHE  72           HD2      PHE  72   0.338   5.197  -2.349
  570    HE1  PHE  72           HE1      PHE  72   2.436   8.168   0.978
  571    HE2  PHE  72           HE2      PHE  72  -0.453   5.208   0.033
  572    HZ   PHE  72           HZ       PHE  72   0.605   6.693   1.667
  573    H    LYS  73           H        LYS  73   4.133   8.843  -3.940
  574    HA   LYS  73           HA       LYS  73   3.639  10.597  -1.871
  575   1HB   LYS  73          1HB       LYS  73   5.779  10.141  -3.859
  576   2HB   LYS  73          2HB       LYS  73   5.728  11.762  -3.197
  577   1HG   LYS  73          1HG       LYS  73   5.341  10.225  -0.918
  578   2HG   LYS  73          2HG       LYS  73   6.401   9.193  -1.858
  579   1HD   LYS  73          1HD       LYS  73   8.113  10.462  -1.060
  580   2HD   LYS  73          2HD       LYS  73   7.585  11.693  -2.189
  581   1HE   LYS  73          1HE       LYS  73   5.869  12.308  -0.226
  582   2HE   LYS  73          2HE       LYS  73   7.045  11.484   0.777
  583   1HZ   LYS  73          1HZ       LYS  73   7.239  14.011  -0.483
  584   2HZ   LYS  73          2HZ       LYS  73   8.124  13.395   0.743
  585   3HZ   LYS  73          3HZ       LYS  73   8.542  13.081  -0.804
  586    H    LYS  74           H        LYS  74   2.795  10.795  -5.267
  587    HA   LYS  74           HA       LYS  74   2.347  13.662  -5.067
  588   1HB   LYS  74          1HB       LYS  74   2.588  11.675  -7.272
  589   2HB   LYS  74          2HB       LYS  74   1.517  13.033  -7.549
  590   1HG   LYS  74          1HG       LYS  74   3.378  14.599  -6.873
  591   2HG   LYS  74          2HG       LYS  74   4.443  13.219  -6.690
  592   1HD   LYS  74          1HD       LYS  74   3.405  12.801  -9.237
  593   2HD   LYS  74          2HD       LYS  74   3.490  14.551  -9.166
  594   1HE   LYS  74          1HE       LYS  74   5.875  14.482  -8.603
  595   2HE   LYS  74          2HE       LYS  74   5.832  12.738  -8.421
  596   1HZ   LYS  74          1HZ       LYS  74   5.660  14.310 -10.866
  597   2HZ   LYS  74          2HZ       LYS  74   6.597  13.014 -10.538
  598   3HZ   LYS  74          3HZ       LYS  74   5.004  12.814 -10.832
  599    H    LEU  75           H        LEU  75   0.538  10.586  -5.696
  600    HA   LEU  75           HA       LEU  75  -1.970  11.678  -5.929
  601   1HB   LEU  75          1HB       LEU  75  -1.227   9.044  -4.651
  602   2HB   LEU  75          2HB       LEU  75  -2.795   9.478  -5.302
  603    HG   LEU  75           HG       LEU  75  -0.274   9.351  -6.975
  604   1HD1  LEU  75          1HD1      LEU  75  -2.397   7.224  -7.007
  605   2HD1  LEU  75          2HD1      LEU  75  -0.709   7.156  -7.572
  606   3HD1  LEU  75          3HD1      LEU  75  -1.066   7.160  -5.827
  607   1HD2  LEU  75          1HD2      LEU  75  -2.518  10.664  -7.594
  608   2HD2  LEU  75          2HD2      LEU  75  -1.538   9.801  -8.804
  609   3HD2  LEU  75          3HD2      LEU  75  -2.997   9.036  -8.131
  610    H    THR  76           H        THR  76  -3.806  11.276  -4.204
  611    HA   THR  76           HA       THR  76  -2.841  11.973  -1.530
  612    HB   THR  76           HB       THR  76  -3.284  14.110  -2.763
  613    HG1  THR  76           HG1      THR  76  -4.341  14.758  -0.901
  614   1HG2  THR  76          1HG2      THR  76  -5.092  14.309  -4.142
  615   2HG2  THR  76          2HG2      THR  76  -5.567  12.637  -3.758
  616   3HG2  THR  76          3HG2      THR  76  -6.169  13.983  -2.763
  617    H    ARG  77           H        ARG  77  -5.224  12.348  -0.240
  618    HA   ARG  77           HA       ARG  77  -6.019   9.764   0.148
  619   1HB   ARG  77          1HB       ARG  77  -7.816  10.720   1.545
  620   2HB   ARG  77          2HB       ARG  77  -6.342  11.642   1.776
  621   1HG   ARG  77          1HG       ARG  77  -7.228  13.240  -0.064
  622   2HG   ARG  77          2HG       ARG  77  -8.764  12.411   0.093
  623   1HD   ARG  77          1HD       ARG  77  -9.265  13.496   2.037
  624   2HD   ARG  77          2HD       ARG  77  -7.694  13.144   2.730
  625    HE   ARG  77           HE       ARG  77  -7.030  15.303   2.163
  626   1HH1  ARG  77          1HH1      ARG  77  -9.658  14.351   0.025
  627   2HH1  ARG  77          2HH1      ARG  77  -9.740  15.888  -0.769
  628   1HH2  ARG  77          1HH2      ARG  77  -7.137  17.331   1.115
  629   2HH2  ARG  77          2HH2      ARG  77  -8.297  17.595  -0.146
  630    H    LYS  78           H        LYS  78  -6.807  11.936  -2.414
  631    HA   LYS  78           HA       LYS  78  -9.358  10.631  -2.953
  632   1HB   LYS  78          1HB       LYS  78  -8.762  13.223  -3.077
  633   2HB   LYS  78          2HB       LYS  78  -8.223  12.790  -4.687
  634   1HG   LYS  78          1HG       LYS  78 -10.557  11.522  -4.824
  635   2HG   LYS  78          2HG       LYS  78 -11.003  12.585  -3.505
  636   1HD   LYS  78          1HD       LYS  78  -9.746  14.312  -5.332
  637   2HD   LYS  78          2HD       LYS  78 -10.630  13.206  -6.366
  638   1HE   LYS  78          1HE       LYS  78 -12.071  14.314  -3.959
  639   2HE   LYS  78          2HE       LYS  78 -11.790  15.401  -5.305
  640   1HZ   LYS  78          1HZ       LYS  78 -12.773  12.815  -6.049
  641   2HZ   LYS  78          2HZ       LYS  78 -13.818  13.702  -5.162
  642   3HZ   LYS  78          3HZ       LYS  78 -13.232  14.294  -6.566
  643    H    GLN  79           H        GLN  79  -6.625  11.688  -5.091
  644    HA   GLN  79           HA       GLN  79  -7.003  10.061  -7.118
  645   1HB   GLN  79          1HB       GLN  79  -4.696  11.385  -5.929
  646   2HB   GLN  79          2HB       GLN  79  -4.199   9.880  -6.680
  647   1HG   GLN  79          1HG       GLN  79  -4.226  10.994  -8.660
  648   2HG   GLN  79          2HG       GLN  79  -5.974  10.949  -8.561
  649   1HE2  GLN  79          1HE2      GLN  79  -3.733  12.921  -9.412
  650   2HE2  GLN  79          2HE2      GLN  79  -4.247  14.446  -8.773
  651    H    LYS  80           H        LYS  80  -4.920   9.098  -4.286
  652    HA   LYS  80           HA       LYS  80  -4.361   6.556  -4.965
  653   1HB   LYS  80          1HB       LYS  80  -4.938   7.846  -2.306
  654   2HB   LYS  80          2HB       LYS  80  -4.553   6.139  -2.398
  655   1HG   LYS  80          1HG       LYS  80  -2.361   6.516  -3.085
  656   2HG   LYS  80          2HG       LYS  80  -2.764   7.993  -3.940
  657   1HD   LYS  80          1HD       LYS  80  -3.063   9.175  -1.752
  658   2HD   LYS  80          2HD       LYS  80  -2.662   7.698  -0.899
  659   1HE   LYS  80          1HE       LYS  80  -0.441   7.730  -2.293
  660   2HE   LYS  80          2HE       LYS  80  -0.850   9.396  -2.656
  661   1HZ   LYS  80          1HZ       LYS  80  -0.886   9.875  -0.336
  662   2HZ   LYS  80          2HZ       LYS  80  -0.657   8.310   0.068
  663   3HZ   LYS  80          3HZ       LYS  80   0.531   9.142  -0.681
  664    H    GLU  81           H        GLU  81  -7.419   7.721  -3.417
  665    HA   GLU  81           HA       GLU  81  -8.623   5.345  -3.025
  666   1HB   GLU  81          1HB       GLU  81  -9.472   7.694  -2.476
  667   2HB   GLU  81          2HB       GLU  81 -10.049   7.801  -4.128
  668   1HG   GLU  81          1HG       GLU  81 -11.659   6.084  -3.822
  669   2HG   GLU  81          2HG       GLU  81 -10.825   5.409  -2.436
  670    H    GLN  82           H        GLN  82  -8.807   7.355  -6.053
  671    HA   GLN  82           HA       GLN  82 -10.212   5.337  -7.424
  672   1HB   GLN  82          1HB       GLN  82  -9.254   8.057  -7.933
  673   2HB   GLN  82          2HB       GLN  82  -9.018   7.038  -9.339
  674   1HG   GLN  82          1HG       GLN  82 -11.635   7.510  -7.843
  675   2HG   GLN  82          2HG       GLN  82 -11.243   8.046  -9.465
  676   1HE2  GLN  82          1HE2      GLN  82 -12.598   5.633  -7.564
  677   2HE2  GLN  82          2HE2      GLN  82 -12.799   4.384  -8.749
  678    H    TYR  83           H        TYR  83  -6.806   6.596  -7.639
  679    HA   TYR  83           HA       TYR  83  -5.722   5.132  -9.554
  680   1HB   TYR  83          1HB       TYR  83  -4.311   6.527  -8.188
  681   2HB   TYR  83          2HB       TYR  83  -4.930   5.841  -6.698
  682    HD1  TYR  83           HD1      TYR  83  -2.447   5.518  -9.358
  683    HD2  TYR  83           HD2      TYR  83  -4.084   3.661  -5.870
  684    HE1  TYR  83           HE1      TYR  83  -0.418   3.994  -9.210
  685    HE2  TYR  83           HE2      TYR  83  -2.050   2.142  -5.733
  686    HH   TYR  83           HH       TYR  83   0.535   2.508  -6.659
  687    H    LEU  84           H        LEU  84  -6.425   3.865  -6.232
  688    HA   LEU  84           HA       LEU  84  -5.476   1.261  -6.922
  689   1HB   LEU  84          1HB       LEU  84  -6.750   2.556  -4.551
  690   2HB   LEU  84          2HB       LEU  84  -6.764   0.806  -4.665
  691    HG   LEU  84           HG       LEU  84  -4.106   1.669  -5.233
  692   1HD1  LEU  84          1HD1      LEU  84  -5.395   3.552  -3.571
  693   2HD1  LEU  84          2HD1      LEU  84  -4.343   2.575  -2.518
  694   3HD1  LEU  84          3HD1      LEU  84  -3.658   3.408  -3.934
  695   1HD2  LEU  84          1HD2      LEU  84  -4.619   0.550  -2.566
  696   2HD2  LEU  84          2HD2      LEU  84  -5.357  -0.370  -3.899
  697   3HD2  LEU  84          3HD2      LEU  84  -3.605  -0.055  -3.897
  698    H    LYS  85           H        LYS  85  -8.674   2.897  -6.615
  699    HA   LYS  85           HA       LYS  85 -10.270   0.672  -6.926
  700   1HB   LYS  85          1HB       LYS  85 -10.582   3.476  -6.800
  701   2HB   LYS  85          2HB       LYS  85 -11.380   2.977  -8.279
  702   1HG   LYS  85          1HG       LYS  85 -12.903   1.570  -7.152
  703   2HG   LYS  85          2HG       LYS  85 -11.848   1.356  -5.769
  704   1HD   LYS  85          1HD       LYS  85 -12.670   3.203  -4.708
  705   2HD   LYS  85          2HD       LYS  85 -12.588   4.183  -6.158
  706   1HE   LYS  85          1HE       LYS  85 -14.751   3.582  -6.863
  707   2HE   LYS  85          2HE       LYS  85 -14.725   2.054  -6.007
  708   1HZ   LYS  85          1HZ       LYS  85 -14.583   4.483  -4.431
  709   2HZ   LYS  85          2HZ       LYS  85 -16.023   4.092  -5.095
  710   3HZ   LYS  85          3HZ       LYS  85 -15.288   3.053  -4.073
  711    H    THR  86           H        THR  86  -9.059   2.941  -9.498
  712    HA   THR  86           HA       THR  86 -10.087   1.773 -11.698
  713    HB   THR  86           HB       THR  86  -7.996   2.650 -12.825
  714    HG1  THR  86           HG1      THR  86  -6.294   2.392 -11.418
  715   1HG2  THR  86          1HG2      THR  86  -8.044   4.872 -11.094
  716   2HG2  THR  86          2HG2      THR  86  -9.061   4.660 -12.539
  717   3HG2  THR  86          3HG2      THR  86  -9.675   4.179 -10.940
  718    H    PHE  87           H        PHE  87  -7.649   0.390  -9.548
  719    HA   PHE  87           HA       PHE  87  -7.188  -1.748 -11.476
  720   1HB   PHE  87          1HB       PHE  87  -5.225  -0.723 -10.367
  721   2HB   PHE  87          2HB       PHE  87  -5.985  -0.858  -8.793
  722    HD1  PHE  87           HD1      PHE  87  -4.423  -2.788 -11.523
  723    HD2  PHE  87           HD2      PHE  87  -5.826  -2.859  -7.519
  724    HE1  PHE  87           HE1      PHE  87  -3.297  -5.004 -11.167
  725    HE2  PHE  87           HE2      PHE  87  -4.700  -5.074  -7.164
  726    HZ   PHE  87           HZ       PHE  87  -3.450  -6.121  -8.992
  727    H    HIS  88           H        HIS  88  -7.824  -1.431  -7.903
  728    HA   HIS  88           HA       HIS  88  -8.409  -3.963  -7.310
  729   1HB   HIS  88          1HB       HIS  88  -8.409  -2.009  -5.765
  730   2HB   HIS  88          2HB       HIS  88  -9.998  -1.563  -6.357
  731    HD1  HIS  88           HD1      HIS  88  -8.239  -4.038  -4.148
  732    HD2  HIS  88           HD2      HIS  88 -12.133  -3.228  -5.480
  733    HE1  HIS  88           HE1      HIS  88  -9.800  -5.416  -2.672
  734    H    LEU  89           H        LEU  89 -10.621  -1.611  -8.926
  735    HA   LEU  89           HA       LEU  89 -12.948  -2.942  -8.942
  736   1HB   LEU  89          1HB       LEU  89 -11.604  -1.422 -11.173
  737   2HB   LEU  89          2HB       LEU  89 -13.265  -1.976 -11.259
  738    HG   LEU  89           HG       LEU  89 -12.494  -0.358  -8.874
  739   1HD1  LEU  89          1HD1      LEU  89 -12.107   1.602  -9.896
  740   2HD1  LEU  89          2HD1      LEU  89 -11.648   0.589 -11.286
  741   3HD1  LEU  89          3HD1      LEU  89 -13.285   1.280 -11.191
  742   1HD2  LEU  89          1HD2      LEU  89 -14.937  -0.855 -10.533
  743   2HD2  LEU  89          2HD2      LEU  89 -14.713  -0.937  -8.769
  744   3HD2  LEU  89          3HD2      LEU  89 -14.815   0.644  -9.581
  745    H    GLU  90           H        GLU  90 -10.380  -3.427 -11.474
  746    HA   GLU  90           HA       GLU  90 -11.699  -5.741 -12.412
  747   1HB   GLU  90          1HB       GLU  90  -9.260  -4.179 -13.089
  748   2HB   GLU  90          2HB       GLU  90  -9.154  -5.887 -13.466
  749   1HG   GLU  90          1HG       GLU  90 -10.404  -5.536 -15.321
  750   2HG   GLU  90          2HG       GLU  90 -11.756  -5.075 -14.306
  751    H    HIS  91           H        HIS  91 -11.830  -7.525 -11.097
  752    HA   HIS  91           HA       HIS  91  -9.327  -8.340  -9.806
  753   1HB   HIS  91          1HB       HIS  91 -11.279  -7.545  -8.328
  754   2HB   HIS  91          2HB       HIS  91 -12.088  -9.028  -8.797
  755    HD1  HIS  91           HD1      HIS  91  -8.934  -7.849  -7.006
  756    HD2  HIS  91           HD2      HIS  91 -11.306 -11.286  -7.402
  757    HE1  HIS  91           HE1      HIS  91  -8.054  -9.525  -5.295
  758    H    HIS  92           H        HIS  92 -12.544  -9.688 -10.852
  759    HA   HIS  92           HA       HIS  92 -13.063 -11.482 -12.003
  760   1HB   HIS  92          1HB       HIS  92 -10.302 -10.966 -13.041
  761   2HB   HIS  92          2HB       HIS  92 -11.077 -12.483 -13.456
  762    HD1  HIS  92           HD1      HIS  92 -10.425  -9.964 -15.404
  763    HD2  HIS  92           HD2      HIS  92 -14.162 -11.087 -13.867
  764    HE1  HIS  92           HE1      HIS  92 -12.172  -8.991 -16.988
  765    H    HIS  93           H        HIS  93 -13.587 -13.215 -10.773
  766    HA   HIS  93           HA       HIS  93 -12.135 -14.205  -8.717
  767   1HB   HIS  93          1HB       HIS  93 -13.520 -16.250  -8.940
  768   2HB   HIS  93          2HB       HIS  93 -14.441 -14.760  -8.996
  769    HD1  HIS  93           HD1      HIS  93 -16.150 -14.678 -10.809
  770    HD2  HIS  93           HD2      HIS  93 -12.947 -17.204 -11.786
  771    HE1  HIS  93           HE1      HIS  93 -16.723 -15.719 -13.068
  772    H    HIS  94           H        HIS  94 -11.186 -16.539  -8.558
  773    HA   HIS  94           HA       HIS  94  -9.426 -17.784  -8.999
  774   1HB   HIS  94          1HB       HIS  94 -11.123 -18.747 -10.532
  775   2HB   HIS  94          2HB       HIS  94 -10.520 -17.728 -11.825
  776    HD1  HIS  94           HD1      HIS  94 -10.102 -21.027 -10.386
  777    HD2  HIS  94           HD2      HIS  94  -7.618 -18.306 -12.392
  778    HE1  HIS  94           HE1      HIS  94  -8.103 -22.371 -11.230
  779    H    HIS  95           H        HIS  95  -7.644 -16.492  -8.559
  780    HA   HIS  95           HA       HIS  95  -6.748 -14.693 -10.642
  781   1HB   HIS  95          1HB       HIS  95  -5.115 -13.948  -8.945
  782   2HB   HIS  95          2HB       HIS  95  -6.781 -13.803  -8.416
  783    HD1  HIS  95           HD1      HIS  95  -5.777 -13.795  -5.935
  784    HD2  HIS  95           HD2      HIS  95  -5.350 -17.388  -8.056
  785    HE1  HIS  95           HE1      HIS  95  -5.193 -15.580  -4.207
  786    H    HIS  96           H        HIS  96  -4.173 -14.683 -10.877
  787    HA   HIS  96           HA       HIS  96  -2.490 -15.706 -11.853
  788   1HB   HIS  96          1HB       HIS  96  -3.056 -17.692  -9.641
  789   2HB   HIS  96          2HB       HIS  96  -1.647 -17.793 -10.678
  790    HD1  HIS  96           HD1      HIS  96  -0.162 -15.393 -10.694
  791    HD2  HIS  96           HD2      HIS  96  -2.613 -16.215  -7.390
  792    HE1  HIS  96           HE1      HIS  96   0.696 -13.932  -8.786
  Start of MODEL    5
    1   1H    MET   1          1H        MET   1  -1.810 -12.218  -0.121
    2    HA   MET   1           HA       MET   1   0.224 -10.588   0.626
    3   1HB   MET   1          1HB       MET   1  -1.427  -9.745   2.355
    4   2HB   MET   1          2HB       MET   1  -2.162  -9.965   0.780
    5   1HG   MET   1          1HG       MET   1  -2.310 -12.455   2.305
    6   2HG   MET   1          2HG       MET   1  -2.984 -11.137   3.244
    7   1HE   MET   1          1HE       MET   1  -4.360 -13.698   2.119
    8   2HE   MET   1          2HE       MET   1  -5.476 -13.456   0.754
    9   3HE   MET   1          3HE       MET   1  -3.738 -13.696   0.450
   10    H    GLU   2           H        GLU   2   0.994 -13.390   1.161
   11    HA   GLU   2           HA       GLU   2   2.069 -12.931   3.752
   12   1HB   GLU   2          1HB       GLU   2   1.202 -15.419   4.356
   13   2HB   GLU   2          2HB       GLU   2   0.316 -13.976   4.807
   14   1HG   GLU   2          1HG       GLU   2  -1.290 -14.254   3.112
   15   2HG   GLU   2          2HG       GLU   2  -0.204 -15.165   2.081
   16    H    ASN   3           H        ASN   3   4.185 -13.271   3.199
   17    HA   ASN   3           HA       ASN   3   5.988 -14.239   2.483
   18   1HB   ASN   3          1HB       ASN   3   4.247 -16.752   2.607
   19   2HB   ASN   3          2HB       ASN   3   5.955 -16.816   2.222
   20   1HD2  ASN   3          1HD2      ASN   3   3.639 -15.607   4.616
   21   2HD2  ASN   3          2HD2      ASN   3   4.646 -15.781   6.014
   22    H    LYS   4           H        LYS   4   6.506 -13.569   0.385
   23    HA   LYS   4           HA       LYS   4   5.958 -15.224  -1.806
   24   1HB   LYS   4          1HB       LYS   4   3.673 -14.234  -1.496
   25   2HB   LYS   4          2HB       LYS   4   4.353 -12.652  -1.814
   26   1HG   LYS   4          1HG       LYS   4   3.650 -13.267  -3.959
   27   2HG   LYS   4          2HG       LYS   4   5.323 -13.785  -4.001
   28   1HD   LYS   4          1HD       LYS   4   3.898 -15.973  -2.876
   29   2HD   LYS   4          2HD       LYS   4   2.888 -15.397  -4.189
   30   1HE   LYS   4          1HE       LYS   4   4.757 -15.584  -5.781
   31   2HE   LYS   4          2HE       LYS   4   5.872 -15.981  -4.492
   32   1HZ   LYS   4          1HZ       LYS   4   3.961 -17.647  -5.794
   33   2HZ   LYS   4          2HZ       LYS   4   5.329 -18.055  -5.002
   34   3HZ   LYS   4          3HZ       LYS   4   3.947 -17.804  -4.168
   35    H    LYS   5           H        LYS   5   7.582 -14.899  -3.257
   36    HA   LYS   5           HA       LYS   5   9.640 -13.165  -2.689
   37   1HB   LYS   5          1HB       LYS   5  10.565 -13.821  -4.791
   38   2HB   LYS   5          2HB       LYS   5   9.743 -15.211  -4.112
   39   1HG   LYS   5          1HG       LYS   5   7.699 -14.030  -5.566
   40   2HG   LYS   5          2HG       LYS   5   9.094 -13.636  -6.551
   41   1HD   LYS   5          1HD       LYS   5   9.675 -15.936  -6.868
   42   2HD   LYS   5          2HD       LYS   5   8.685 -16.465  -5.523
   43   1HE   LYS   5          1HE       LYS   5   6.623 -15.783  -6.786
   44   2HE   LYS   5          2HE       LYS   5   7.622 -15.283  -8.135
   45   1HZ   LYS   5          1HZ       LYS   5   8.121 -17.945  -7.203
   46   2HZ   LYS   5          2HZ       LYS   5   6.635 -17.722  -7.841
   47   3HZ   LYS   5          3HZ       LYS   5   7.964 -17.387  -8.729
   48    H    SER   6           H        SER   6  10.469 -11.365  -4.194
   49    HA   SER   6           HA       SER   6  10.201  -9.487  -5.294
   50   1HB   SER   6          1HB       SER   6   7.203  -9.603  -5.456
   51   2HB   SER   6          2HB       SER   6   8.359  -9.039  -6.646
   52    HG   SER   6           HG       SER   6   7.177 -11.230  -6.938
   53    H    HIS   7           H        HIS   7   8.198  -7.445  -5.052
   54    HA   HIS   7           HA       HIS   7   8.144  -7.115  -2.139
   55   1HB   HIS   7          1HB       HIS   7   8.344  -4.862  -4.144
   56   2HB   HIS   7          2HB       HIS   7   8.572  -4.788  -2.408
   57    HD1  HIS   7           HD1      HIS   7  10.984  -4.353  -1.959
   58    HD2  HIS   7           HD2      HIS   7  10.442  -7.073  -5.106
   59    HE1  HIS   7           HE1      HIS   7  13.318  -5.080  -2.686
   60    H    TYR   8           H        TYR   8   6.169  -6.762  -1.216
   61    HA   TYR   8           HA       TYR   8   3.938  -6.355  -3.083
   62   1HB   TYR   8          1HB       TYR   8   4.525  -7.879  -0.543
   63   2HB   TYR   8          2HB       TYR   8   2.927  -7.158  -0.609
   64    HD1  TYR   8           HD1      TYR   8   5.056  -8.855  -3.204
   65    HD2  TYR   8           HD2      TYR   8   1.349  -8.794  -1.069
   66    HE1  TYR   8           HE1      TYR   8   4.221 -10.820  -4.584
   67    HE2  TYR   8           HE2      TYR   8   0.526 -10.760  -2.455
   68    HH   TYR   8           HH       TYR   8   1.585 -12.646  -3.707
   69    H    PHE   9           H        PHE   9   3.073  -4.346  -3.101
   70    HA   PHE   9           HA       PHE   9   3.594  -2.629  -0.818
   71   1HB   PHE   9          1HB       PHE   9   3.914  -2.043  -3.332
   72   2HB   PHE   9          2HB       PHE   9   2.170  -2.124  -3.497
   73    HD1  PHE   9           HD1      PHE   9   4.968  -0.112  -2.451
   74    HD2  PHE   9           HD2      PHE   9   0.747  -0.483  -2.236
   75    HE1  PHE   9           HE1      PHE   9   4.792   2.296  -1.768
   76    HE2  PHE   9           HE2      PHE   9   0.570   1.926  -1.552
   77    HZ   PHE   9           HZ       PHE   9   2.595   3.287  -1.327
   78    H    TYR  10           H        TYR  10   2.088  -2.151   0.718
   79    HA   TYR  10           HA       TYR  10  -0.727  -2.536   0.012
   80   1HB   TYR  10          1HB       TYR  10  -0.918  -3.650   2.316
   81   2HB   TYR  10          2HB       TYR  10   0.051  -4.581   1.191
   82    HD1  TYR  10           HD1      TYR  10  -0.038  -3.009   4.402
   83    HD2  TYR  10           HD2      TYR  10   2.624  -4.288   1.307
   84    HE1  TYR  10           HE1      TYR  10   1.895  -3.004   6.052
   85    HE2  TYR  10           HE2      TYR  10   4.549  -4.278   2.968
   86    HH   TYR  10           HH       TYR  10   4.019  -3.267   6.333
   87    H    VAL  11           H        VAL  11  -2.125  -1.691   2.003
   88    HA   VAL  11           HA       VAL  11  -0.791   0.589   3.242
   89    HB   VAL  11           HB       VAL  11  -3.161   0.673   1.389
   90   1HG1  VAL  11          1HG1      VAL  11  -2.775   3.244   2.522
   91   2HG1  VAL  11          2HG1      VAL  11  -4.196   2.183   2.661
   92   3HG1  VAL  11          3HG1      VAL  11  -2.898   2.095   3.876
   93   1HG2  VAL  11          1HG2      VAL  11  -0.982   1.063   0.374
   94   2HG2  VAL  11          2HG2      VAL  11  -1.916   2.578   0.410
   95   3HG2  VAL  11          3HG2      VAL  11  -0.611   2.310   1.589
   96    H    LEU  12           H        LEU  12  -1.319   0.738   5.371
   97    HA   LEU  12           HA       LEU  12  -3.498  -0.986   6.273
   98   1HB   LEU  12          1HB       LEU  12  -0.869  -0.251   7.275
   99   2HB   LEU  12          2HB       LEU  12  -2.115  -0.015   8.485
  100    HG   LEU  12           HG       LEU  12  -2.863  -2.428   7.891
  101   1HD1  LEU  12          1HD1      LEU  12  -0.262  -2.211   6.438
  102   2HD1  LEU  12          2HD1      LEU  12  -0.651  -3.737   7.268
  103   3HD1  LEU  12          3HD1      LEU  12  -1.745  -3.100   6.017
  104   1HD2  LEU  12          1HD2      LEU  12  -1.701  -1.571   9.993
  105   2HD2  LEU  12          2HD2      LEU  12  -1.541  -3.306   9.626
  106   3HD2  LEU  12          3HD2      LEU  12  -0.193  -2.194   9.280
  107    H    LEU  13           H        LEU  13  -5.260  -0.201   7.433
  108    HA   LEU  13           HA       LEU  13  -5.336   2.716   7.755
  109   1HB   LEU  13          1HB       LEU  13  -6.696   2.594   5.956
  110   2HB   LEU  13          2HB       LEU  13  -7.142   0.925   6.247
  111    HG   LEU  13           HG       LEU  13  -8.191   3.233   7.900
  112   1HD1  LEU  13          1HD1      LEU  13  -9.261   3.838   6.017
  113   2HD1  LEU  13          2HD1      LEU  13  -9.003   2.261   5.231
  114   3HD1  LEU  13          3HD1      LEU  13 -10.321   2.464   6.410
  115   1HD2  LEU  13          1HD2      LEU  13  -9.997   1.083   7.875
  116   2HD2  LEU  13          2HD2      LEU  13  -8.387   0.360   8.110
  117   3HD2  LEU  13          3HD2      LEU  13  -8.965   1.625   9.221
  118    H    CYS  14           H        CYS  14  -6.105   3.443   9.711
  119    HA   CYS  14           HA       CYS  14  -6.848   1.318  11.578
  120   1HB   CYS  14          1HB       CYS  14  -5.674   4.068  12.103
  121   2HB   CYS  14          2HB       CYS  14  -6.190   2.954  13.354
  122    HG   CYS  14           HG       CYS  14  -4.651   1.108  11.514
  123    H    GLN  15           H        GLN  15  -8.460   2.169  13.349
  124    HA   GLN  15           HA       GLN  15 -10.814   2.787  12.154
  125   1HB   GLN  15          1HB       GLN  15  -9.836   3.139  15.008
  126   2HB   GLN  15          2HB       GLN  15 -11.483   3.538  14.564
  127   1HG   GLN  15          1HG       GLN  15 -10.413   0.860  13.687
  128   2HG   GLN  15          2HG       GLN  15 -10.789   1.066  15.386
  129   1HE2  GLN  15          1HE2      GLN  15 -12.691   0.307  15.871
  130   2HE2  GLN  15          2HE2      GLN  15 -14.146   0.427  14.938
  131    H    ASP  16           H        ASP  16  -8.246   4.954  13.347
  132    HA   ASP  16           HA       ASP  16  -9.759   7.276  13.397
  133   1HB   ASP  16          1HB       ASP  16  -6.969   6.486  13.614
  134   2HB   ASP  16          2HB       ASP  16  -7.077   7.902  12.589
  135    H    GLY  17           H        GLY  17  -7.730   5.657  10.868
  136   1HA   GLY  17          1HA       GLY  17  -8.565   5.742   8.594
  137   2HA   GLY  17          2HA       GLY  17  -8.960   7.431   8.846
  138    H    SER  18           H        SER  18  -5.994   5.610   9.853
  139    HA   SER  18           HA       SER  18  -4.472   7.615   8.416
  140   1HB   SER  18          1HB       SER  18  -4.182   6.341  10.958
  141   2HB   SER  18          2HB       SER  18  -2.837   5.795   9.977
  142    HG   SER  18           HG       SER  18  -1.932   7.717  10.177
  143    H    PHE  19           H        PHE  19  -3.654   7.076   6.428
  144    HA   PHE  19           HA       PHE  19  -3.491   4.237   5.781
  145   1HB   PHE  19          1HB       PHE  19  -3.331   6.845   4.152
  146   2HB   PHE  19          2HB       PHE  19  -3.277   5.248   3.431
  147    HD1  PHE  19           HD1      PHE  19  -5.381   7.904   4.506
  148    HD2  PHE  19           HD2      PHE  19  -5.312   3.717   3.819
  149    HE1  PHE  19           HE1      PHE  19  -7.886   7.888   4.352
  150    HE2  PHE  19           HE2      PHE  19  -7.818   3.700   3.665
  151    HZ   PHE  19           HZ       PHE  19  -9.075   5.787   3.933
  152    H    TYR  20           H        TYR  20  -1.553   3.208   5.769
  153    HA   TYR  20           HA       TYR  20   0.833   4.877   5.351
  154   1HB   TYR  20          1HB       TYR  20  -0.067   3.430   7.652
  155   2HB   TYR  20          2HB       TYR  20   1.123   2.370   6.923
  156    HD1  TYR  20           HD1      TYR  20   3.195   2.514   7.936
  157    HD2  TYR  20           HD2      TYR  20   0.875   6.081   7.493
  158    HE1  TYR  20           HE1      TYR  20   5.056   3.866   9.018
  159    HE2  TYR  20           HE2      TYR  20   2.743   7.421   8.576
  160    HH   TYR  20           HH       TYR  20   4.713   6.652  10.354
  161    H    GLY  21           H        GLY  21   1.699   4.336   3.410
  162   1HA   GLY  21          1HA       GLY  21   1.222   1.697   2.297
  163   2HA   GLY  21          2HA       GLY  21   2.003   3.064   1.527
  164    H    GLY  22           H        GLY  22   2.857   0.175   1.766
  165   1HA   GLY  22          1HA       GLY  22   5.611   0.697   2.436
  166   2HA   GLY  22          2HA       GLY  22   4.810  -0.377   3.565
  167    H    TYR  23           H        TYR  23   6.988  -0.813   1.447
  168    HA   TYR  23           HA       TYR  23   5.593  -2.925  -0.058
  169   1HB   TYR  23          1HB       TYR  23   7.682  -2.545  -1.584
  170   2HB   TYR  23          2HB       TYR  23   6.521  -1.232  -1.557
  171    HD1  TYR  23           HD1      TYR  23   6.995   0.809  -0.133
  172    HD2  TYR  23           HD2      TYR  23   9.927  -2.225  -0.845
  173    HE1  TYR  23           HE1      TYR  23   8.838   2.416   0.565
  174    HE2  TYR  23           HE2      TYR  23  11.759  -0.609  -0.145
  175    HH   TYR  23           HH       TYR  23  11.817   1.476   1.422
  176    H    THR  24           H        THR  24   5.950  -4.863   0.918
  177    HA   THR  24           HA       THR  24   8.608  -5.814   1.188
  178    HB   THR  24           HB       THR  24   7.958  -4.233   3.299
  179    HG1  THR  24           HG1      THR  24   9.962  -5.286   3.255
  180   1HG2  THR  24          1HG2      THR  24   6.913  -5.353   5.062
  181   2HG2  THR  24          2HG2      THR  24   6.023  -6.092   3.709
  182   3HG2  THR  24          3HG2      THR  24   7.388  -6.957   4.454
  183    H    THR  25           H        THR  25   8.434  -8.034   2.589
  184    HA   THR  25           HA       THR  25   5.992  -9.338   1.579
  185    HB   THR  25           HB       THR  25   7.503 -11.332   1.233
  186    HG1  THR  25           HG1      THR  25   9.785 -10.875   1.584
  187   1HG2  THR  25          1HG2      THR  25   7.250  -9.327  -0.528
  188   2HG2  THR  25          2HG2      THR  25   8.943  -9.014  -0.078
  189   3HG2  THR  25          3HG2      THR  25   8.484 -10.586  -0.775
  190    H    GLU  26           H        GLU  26   4.672 -10.107   3.092
  191    HA   GLU  26           HA       GLU  26   4.008 -11.119   4.913
  192   1HB   GLU  26          1HB       GLU  26   6.885 -11.395   5.869
  193   2HB   GLU  26          2HB       GLU  26   5.500 -12.334   6.391
  194   1HG   GLU  26          1HG       GLU  26   5.587 -13.721   4.567
  195   2HG   GLU  26          2HG       GLU  26   5.911 -12.405   3.455
  196    HA   PRO  27           HA       PRO  27   4.634  -7.133   6.990
  197   1HB   PRO  27          1HB       PRO  27   2.079  -6.193   6.754
  198   2HB   PRO  27          2HB       PRO  27   3.353  -5.800   5.616
  199   1HG   PRO  27          1HG       PRO  27   1.085  -7.667   5.287
  200   2HG   PRO  27          2HG       PRO  27   2.102  -6.946   4.056
  201   1HD   PRO  27          1HD       PRO  27   2.241  -9.638   5.036
  202   2HD   PRO  27          2HD       PRO  27   3.330  -8.883   3.889
  203    H    GLU  28           H        GLU  28   3.153  -9.976   7.545
  204    HA   GLU  28           HA       GLU  28   1.622  -9.261   9.783
  205   1HB   GLU  28          1HB       GLU  28   2.770 -11.885   8.769
  206   2HB   GLU  28          2HB       GLU  28   1.860 -11.807  10.264
  207   1HG   GLU  28          1HG       GLU  28   0.727 -10.611   7.713
  208   2HG   GLU  28          2HG       GLU  28   0.584 -12.329   8.026
  209    H    ARG  29           H        ARG  29   4.835 -10.956   9.493
  210    HA   ARG  29           HA       ARG  29   5.330 -10.868  12.212
  211   1HB   ARG  29          1HB       ARG  29   7.639 -11.492  11.600
  212   2HB   ARG  29          2HB       ARG  29   6.508 -12.371  10.592
  213   1HG   ARG  29          1HG       ARG  29   6.826 -10.694   8.765
  214   2HG   ARG  29          2HG       ARG  29   7.948  -9.803   9.773
  215   1HD   ARG  29          1HD       ARG  29   8.414 -12.746   9.161
  216   2HD   ARG  29          2HD       ARG  29   8.918 -11.506   8.030
  217    HE   ARG  29           HE       ARG  29   9.801 -11.050  10.802
  218   1HH1  ARG  29          1HH1      ARG  29  10.594 -12.465   7.680
  219   2HH1  ARG  29          2HH1      ARG  29  12.301 -12.481   7.979
  220   1HH2  ARG  29          1HH2      ARG  29  12.052 -11.071  11.197
  221   2HH2  ARG  29          2HH2      ARG  29  13.136 -11.684   9.991
  222    H    ARG  30           H        ARG  30   6.024  -8.602   9.518
  223    HA   ARG  30           HA       ARG  30   7.779  -6.998  10.984
  224   1HB   ARG  30          1HB       ARG  30   7.542  -7.072   8.447
  225   2HB   ARG  30          2HB       ARG  30   6.030  -6.202   8.604
  226   1HG   ARG  30          1HG       ARG  30   7.904  -4.720  10.148
  227   2HG   ARG  30          2HG       ARG  30   8.766  -5.171   8.690
  228   1HD   ARG  30          1HD       ARG  30   7.693  -3.495   7.597
  229   2HD   ARG  30          2HD       ARG  30   6.192  -4.379   7.790
  230    HE   ARG  30           HE       ARG  30   6.702  -3.035  10.246
  231   1HH1  ARG  30          1HH1      ARG  30   5.940  -2.248   6.903
  232   2HH1  ARG  30          2HH1      ARG  30   5.145  -0.761   7.299
  233   1HH2  ARG  30          1HH2      ARG  30   5.653  -1.074  10.771
  234   2HH2  ARG  30          2HH2      ARG  30   4.980  -0.089   9.515
  235    H    LEU  31           H        LEU  31   4.231  -7.064  10.475
  236    HA   LEU  31           HA       LEU  31   3.739  -4.518  11.598
  237   1HB   LEU  31          1HB       LEU  31   2.156  -5.439  10.107
  238   2HB   LEU  31          2HB       LEU  31   2.038  -6.932  11.015
  239    HG   LEU  31           HG       LEU  31   1.129  -5.403  12.934
  240   1HD1  LEU  31          1HD1      LEU  31   0.311  -3.682  10.594
  241   2HD1  LEU  31          2HD1      LEU  31   0.099  -3.376  12.335
  242   3HD1  LEU  31          3HD1      LEU  31   1.723  -3.309  11.610
  243   1HD2  LEU  31          1HD2      LEU  31  -0.083  -7.174  11.589
  244   2HD2  LEU  31          2HD2      LEU  31  -1.091  -5.875  12.272
  245   3HD2  LEU  31          3HD2      LEU  31  -0.663  -5.855  10.545
  246    H    THR  32           H        THR  32   3.081  -7.844  12.921
  247    HA   THR  32           HA       THR  32   2.452  -7.124  15.468
  248    HB   THR  32           HB       THR  32   2.593  -9.445  14.184
  249    HG1  THR  32           HG1      THR  32   1.803  -8.982  16.404
  250   1HG2  THR  32          1HG2      THR  32   4.469 -10.837  14.982
  251   2HG2  THR  32          2HG2      THR  32   5.126  -9.462  14.064
  252   3HG2  THR  32          3HG2      THR  32   5.168  -9.447  15.844
  253    H    GLU  33           H        GLU  33   5.714  -7.325  14.006
  254    HA   GLU  33           HA       GLU  33   7.257  -7.290  16.190
  255   1HB   GLU  33          1HB       GLU  33   7.560  -6.679  13.445
  256   2HB   GLU  33          2HB       GLU  33   8.208  -5.284  14.283
  257   1HG   GLU  33          1HG       GLU  33   9.662  -6.771  15.660
  258   2HG   GLU  33          2HG       GLU  33   8.998  -8.179  14.857
  259    H    HIS  34           H        HIS  34   5.703  -4.395  14.645
  260    HA   HIS  34           HA       HIS  34   6.700  -2.591  16.545
  261   1HB   HIS  34          1HB       HIS  34   6.073  -1.607  14.555
  262   2HB   HIS  34          2HB       HIS  34   4.600  -2.548  14.415
  263    HD1  HIS  34           HD1      HIS  34   2.453  -1.578  15.429
  264    HD2  HIS  34           HD2      HIS  34   5.885   0.656  16.343
  265    HE1  HIS  34           HE1      HIS  34   1.632   0.598  16.481
  266    H    ASN  35           H        ASN  35   3.525  -4.305  16.202
  267    HA   ASN  35           HA       ASN  35   2.293  -3.162  18.346
  268   1HB   ASN  35          1HB       ASN  35   2.086  -5.854  16.969
  269   2HB   ASN  35          2HB       ASN  35   1.175  -5.610  18.447
  270   1HD2  ASN  35          1HD2      ASN  35   0.803  -5.656  15.305
  271   2HD2  ASN  35          2HD2      ASN  35  -0.380  -4.421  15.030
  272    H    SER  36           H        SER  36   4.972  -5.413  18.174
  273    HA   SER  36           HA       SER  36   4.617  -6.070  20.990
  274   1HB   SER  36          1HB       SER  36   4.861  -7.909  19.160
  275   2HB   SER  36          2HB       SER  36   6.547  -7.437  19.082
  276    HG   SER  36           HG       SER  36   6.548  -9.041  20.605
  277    H    GLY  37           H        GLY  37   5.704  -3.518  19.696
  278   1HA   GLY  37          1HA       GLY  37   7.250  -2.036  20.507
  279   2HA   GLY  37          2HA       GLY  37   8.088  -3.332  21.338
  280    H    THR  38           H        THR  38   8.727  -1.069  19.165
  281    HA   THR  38           HA       THR  38  10.661  -2.739  17.777
  282    HB   THR  38           HB       THR  38   8.434  -1.130  16.443
  283    HG1  THR  38           HG1      THR  38   9.651  -3.767  16.037
  284   1HG2  THR  38          1HG2      THR  38   9.851  -0.642  14.718
  285   2HG2  THR  38          2HG2      THR  38  11.200  -1.442  15.560
  286   3HG2  THR  38          3HG2      THR  38  10.118  -2.390  14.512
  287    H    GLY  39           H        GLY  39  12.176  -1.707  19.168
  288   1HA   GLY  39          1HA       GLY  39  13.607  -0.083  19.779
  289   2HA   GLY  39          2HA       GLY  39  13.503   0.443  18.112
  290    H    ALA  40           H        ALA  40  11.226   0.480  20.955
  291    HA   ALA  40           HA       ALA  40  11.222   3.367  20.895
  292   1HB   ALA  40          1HB       ALA  40   8.902   3.628  20.403
  293   2HB   ALA  40          2HB       ALA  40   9.540   2.540  19.146
  294   3HB   ALA  40          3HB       ALA  40   8.605   1.875  20.508
  295    H    LYS  41           H        LYS  41   9.562   4.134  22.698
  296    HA   LYS  41           HA       LYS  41  10.382   2.829  25.064
  297   1HB   LYS  41          1HB       LYS  41   9.193   4.553  26.201
  298   2HB   LYS  41          2HB       LYS  41   9.957   5.280  24.802
  299   1HG   LYS  41          1HG       LYS  41   7.888   5.378  23.579
  300   2HG   LYS  41          2HG       LYS  41   7.093   4.264  24.674
  301   1HD   LYS  41          1HD       LYS  41   7.114   5.916  26.482
  302   2HD   LYS  41          2HD       LYS  41   8.117   7.005  25.544
  303   1HE   LYS  41          1HE       LYS  41   6.268   7.167  23.824
  304   2HE   LYS  41          2HE       LYS  41   5.266   6.154  24.844
  305   1HZ   LYS  41          1HZ       LYS  41   6.106   8.058  26.531
  306   2HZ   LYS  41          2HZ       LYS  41   5.928   8.902  25.144
  307   3HZ   LYS  41          3HZ       LYS  41   4.668   8.063  25.758
  308    H    TYR  42           H        TYR  42   8.809   2.049  26.780
  309    HA   TYR  42           HA       TYR  42   7.085   0.096  25.539
  310   1HB   TYR  42          1HB       TYR  42   7.187  -0.853  27.763
  311   2HB   TYR  42          2HB       TYR  42   8.751  -0.084  27.584
  312    HD1  TYR  42           HD1      TYR  42   9.201   2.113  28.702
  313    HD2  TYR  42           HD2      TYR  42   5.596  -0.086  29.393
  314    HE1  TYR  42           HE1      TYR  42   8.765   3.476  30.803
  315    HE2  TYR  42           HE2      TYR  42   5.172   1.285  31.492
  316    HH   TYR  42           HH       TYR  42   7.151   4.060  32.263
  317    H    THR  43           H        THR  43   4.841  -0.281  26.354
  318    HA   THR  43           HA       THR  43   3.553   2.116  27.416
  319    HB   THR  43           HB       THR  43   1.840   1.948  25.556
  320    HG1  THR  43           HG1      THR  43   3.933   0.098  24.649
  321   1HG2  THR  43          1HG2      THR  43   3.811   3.518  25.274
  322   2HG2  THR  43          2HG2      THR  43   4.705   2.190  24.497
  323   3HG2  THR  43          3HG2      THR  43   3.237   2.844  23.730
  324    H    ARG  44           H        ARG  44   2.090   1.656  28.950
  325    HA   ARG  44           HA       ARG  44   1.554  -1.152  29.326
  326   1HB   ARG  44          1HB       ARG  44   0.951  -0.572  31.595
  327   2HB   ARG  44          2HB       ARG  44   2.386   0.361  31.216
  328   1HG   ARG  44          1HG       ARG  44   0.682   2.228  30.453
  329   2HG   ARG  44          2HG       ARG  44  -0.490   1.316  31.383
  330   1HD   ARG  44          1HD       ARG  44   1.433   1.402  33.261
  331   2HD   ARG  44          2HD       ARG  44   1.958   2.801  32.347
  332    HE   ARG  44           HE       ARG  44  -0.874   2.986  32.767
  333   1HH1  ARG  44          1HH1      ARG  44   2.153   3.214  34.547
  334   2HH1  ARG  44          2HH1      ARG  44   1.514   4.285  35.748
  335   1HH2  ARG  44          1HH2      ARG  44  -1.718   4.397  34.352
  336   2HH2  ARG  44          2HH2      ARG  44  -0.704   4.963  35.637
  337    H    LEU  45           H        LEU  45   0.093   1.772  28.130
  338    HA   LEU  45           HA       LEU  45  -2.605   1.082  28.751
  339   1HB   LEU  45          1HB       LEU  45  -3.178   3.055  27.739
  340   2HB   LEU  45          2HB       LEU  45  -1.571   3.392  28.348
  341    HG   LEU  45           HG       LEU  45  -1.013   2.506  25.808
  342   1HD1  LEU  45          1HD1      LEU  45  -2.857   2.512  24.565
  343   2HD1  LEU  45          2HD1      LEU  45  -3.811   3.299  25.846
  344   3HD1  LEU  45          3HD1      LEU  45  -2.850   4.286  24.719
  345   1HD2  LEU  45          1HD2      LEU  45   0.140   4.388  26.071
  346   2HD2  LEU  45          2HD2      LEU  45  -1.312   5.269  25.540
  347   3HD2  LEU  45          3HD2      LEU  45  -1.014   5.008  27.275
  348    H    ALA  46           H        ALA  46  -0.307   0.508  26.082
  349    HA   ALA  46           HA       ALA  46  -0.553  -0.526  24.117
  350   1HB   ALA  46          1HB       ALA  46  -1.984  -2.339  26.087
  351   2HB   ALA  46          2HB       ALA  46  -1.629  -2.830  24.414
  352   3HB   ALA  46          3HB       ALA  46  -0.298  -2.436  25.526
  353    H    LYS  47           H        LYS  47  -1.795   1.146  23.049
  354    HA   LYS  47           HA       LYS  47  -4.564   1.333  23.213
  355   1HB   LYS  47          1HB       LYS  47  -2.517   2.712  21.972
  356   2HB   LYS  47          2HB       LYS  47  -3.393   2.040  20.612
  357   1HG   LYS  47          1HG       LYS  47  -5.419   2.941  22.371
  358   2HG   LYS  47          2HG       LYS  47  -4.186   4.184  22.458
  359   1HD   LYS  47          1HD       LYS  47  -4.383   3.525  19.699
  360   2HD   LYS  47          2HD       LYS  47  -6.035   3.573  20.276
  361   1HE   LYS  47          1HE       LYS  47  -5.213   5.831  21.467
  362   2HE   LYS  47          2HE       LYS  47  -3.979   5.787  20.222
  363   1HZ   LYS  47          1HZ       LYS  47  -5.683   6.905  19.223
  364   2HZ   LYS  47          2HZ       LYS  47  -5.969   5.391  18.683
  365   3HZ   LYS  47          3HZ       LYS  47  -6.866   6.006  19.902
  366    H    ARG  48           H        ARG  48  -2.483  -0.365  20.766
  367    HA   ARG  48           HA       ARG  48  -2.913  -1.958  19.368
  368   1HB   ARG  48          1HB       ARG  48  -4.047  -2.793  21.881
  369   2HB   ARG  48          2HB       ARG  48  -5.127  -3.360  20.622
  370   1HG   ARG  48          1HG       ARG  48  -3.182  -4.401  19.429
  371   2HG   ARG  48          2HG       ARG  48  -2.111  -3.848  20.699
  372   1HD   ARG  48          1HD       ARG  48  -2.535  -5.954  21.553
  373   2HD   ARG  48          2HD       ARG  48  -3.919  -5.139  22.254
  374    HE   ARG  48           HE       ARG  48  -4.442  -6.154  19.559
  375   1HH1  ARG  48          1HH1      ARG  48  -4.415  -6.968  22.983
  376   2HH1  ARG  48          2HH1      ARG  48  -5.549  -8.266  22.813
  377   1HH2  ARG  48          1HH2      ARG  48  -5.938  -7.867  19.335
  378   2HH2  ARG  48          2HH2      ARG  48  -6.422  -8.782  20.725
  379    H    ARG  49           H        ARG  49  -3.807  -0.981  17.526
  380    HA   ARG  49           HA       ARG  49  -6.709  -0.736  17.562
  381   1HB   ARG  49          1HB       ARG  49  -6.428   1.013  15.796
  382   2HB   ARG  49          2HB       ARG  49  -5.587   1.447  17.270
  383   1HG   ARG  49          1HG       ARG  49  -3.756  -0.103  15.683
  384   2HG   ARG  49          2HG       ARG  49  -4.494   1.073  14.613
  385   1HD   ARG  49          1HD       ARG  49  -3.869   2.918  16.139
  386   2HD   ARG  49          2HD       ARG  49  -3.240   1.778  17.312
  387    HE   ARG  49           HE       ARG  49  -1.815   1.140  15.039
  388   1HH1  ARG  49          1HH1      ARG  49  -2.405   4.163  16.740
  389   2HH1  ARG  49          2HH1      ARG  49  -0.900   4.874  16.263
  390   1HH2  ARG  49          1HH2      ARG  49   0.173   2.077  14.410
  391   2HH2  ARG  49          2HH2      ARG  49   0.577   3.679  14.929
  392    HA   PRO  50           HA       PRO  50  -6.744  -3.550  14.230
  393   1HB   PRO  50          1HB       PRO  50  -9.077  -2.912  12.959
  394   2HB   PRO  50          2HB       PRO  50  -9.014  -3.883  14.417
  395   1HG   PRO  50          1HG       PRO  50  -9.834  -1.060  14.105
  396   2HG   PRO  50          2HG       PRO  50 -10.159  -2.157  15.433
  397   1HD   PRO  50          1HD       PRO  50  -8.221  -0.044  15.387
  398   2HD   PRO  50          2HD       PRO  50  -8.465  -1.214  16.669
  399    H    VAL  51           H        VAL  51  -6.314  -3.969  12.020
  400    HA   VAL  51           HA       VAL  51  -5.954  -1.509  10.482
  401    HB   VAL  51           HB       VAL  51  -3.751  -2.387   9.719
  402   1HG1  VAL  51          1HG1      VAL  51  -2.767  -2.026  12.253
  403   2HG1  VAL  51          2HG1      VAL  51  -3.238  -0.717  11.143
  404   3HG1  VAL  51          3HG1      VAL  51  -4.381  -1.286  12.382
  405   1HG2  VAL  51          1HG2      VAL  51  -4.432  -4.512  11.700
  406   2HG2  VAL  51          2HG2      VAL  51  -3.535  -4.616  10.167
  407   3HG2  VAL  51          3HG2      VAL  51  -2.738  -3.974  11.623
  408    H    ILE  52           H        ILE  52  -6.693  -1.703   8.410
  409    HA   ILE  52           HA       ILE  52  -7.165  -4.442   7.462
  410    HB   ILE  52           HB       ILE  52  -9.240  -3.796   6.530
  411   1HG1  ILE  52          1HG1      ILE  52  -9.600  -1.122   7.534
  412   2HG1  ILE  52          2HG1      ILE  52  -8.152  -1.174   6.549
  413   1HG2  ILE  52          1HG2      ILE  52  -9.828  -4.416   8.623
  414   2HG2  ILE  52          2HG2      ILE  52  -8.745  -3.236   9.402
  415   3HG2  ILE  52          3HG2      ILE  52 -10.310  -2.707   8.739
  416   1HD1  ILE  52          1HD1      ILE  52  -9.458  -2.319   4.728
  417   2HD1  ILE  52          2HD1      ILE  52 -10.926  -2.147   5.722
  418   3HD1  ILE  52          3HD1      ILE  52 -10.083  -0.699   5.119
  419    H    MET  53           H        MET  53  -7.266  -4.586   5.031
  420    HA   MET  53           HA       MET  53  -5.247  -2.781   3.979
  421   1HB   MET  53          1HB       MET  53  -5.822  -5.633   3.778
  422   2HB   MET  53          2HB       MET  53  -5.882  -4.944   2.168
  423   1HG   MET  53          1HG       MET  53  -3.623  -4.373   2.165
  424   2HG   MET  53          2HG       MET  53  -3.577  -4.085   3.892
  425   1HE   MET  53          1HE       MET  53  -2.691  -5.166   5.324
  426   2HE   MET  53          2HE       MET  53  -2.808  -6.910   5.656
  427   3HE   MET  53          3HE       MET  53  -1.394  -6.263   4.793
  428    H    ILE  54           H        ILE  54  -5.750  -1.272   2.437
  429    HA   ILE  54           HA       ILE  54  -8.309  -1.636   1.042
  430    HB   ILE  54           HB       ILE  54  -8.612   0.777   1.116
  431   1HG1  ILE  54          1HG1      ILE  54  -6.149   1.310   1.288
  432   2HG1  ILE  54          2HG1      ILE  54  -7.215   2.272   2.290
  433   1HG2  ILE  54          1HG2      ILE  54  -9.834  -0.230   2.788
  434   2HG2  ILE  54          2HG2      ILE  54  -8.389  -0.794   3.660
  435   3HG2  ILE  54          3HG2      ILE  54  -8.847   0.924   3.717
  436   1HD1  ILE  54          1HD1      ILE  54  -6.597   0.060   3.914
  437   2HD1  ILE  54          2HD1      ILE  54  -5.068   0.443   3.089
  438   3HD1  ILE  54          3HD1      ILE  54  -5.899   1.691   4.046
  439    H    HIS  55           H        HIS  55  -4.936  -0.402   1.011
  440    HA   HIS  55           HA       HIS  55  -5.148  -0.258  -1.904
  441   1HB   HIS  55          1HB       HIS  55  -4.171   1.588  -0.056
  442   2HB   HIS  55          2HB       HIS  55  -2.722   0.857  -0.720
  443    HD1  HIS  55           HD1      HIS  55  -5.019   3.543  -1.350
  444    HD2  HIS  55           HD2      HIS  55  -2.874   0.870  -3.768
  445    HE1  HIS  55           HE1      HIS  55  -4.933   4.592  -3.674
  446    H    THR  56           H        THR  56  -4.252  -1.889  -3.054
  447    HA   THR  56           HA       THR  56  -1.999  -3.321  -1.820
  448    HB   THR  56           HB       THR  56  -3.085  -5.412  -2.857
  449    HG1  THR  56           HG1      THR  56  -5.424  -4.990  -3.290
  450   1HG2  THR  56          1HG2      THR  56  -3.388  -4.865  -0.395
  451   2HG2  THR  56          2HG2      THR  56  -4.840  -3.933  -0.829
  452   3HG2  THR  56          3HG2      THR  56  -4.794  -5.690  -1.104
  453    H    GLU  57           H        GLU  57  -0.423  -4.148  -3.249
  454    HA   GLU  57           HA       GLU  57  -0.740  -3.885  -6.021
  455   1HB   GLU  57          1HB       GLU  57   0.150  -1.515  -4.619
  456   2HB   GLU  57          2HB       GLU  57   1.473  -2.115  -5.600
  457   1HG   GLU  57          1HG       GLU  57  -1.363  -1.583  -6.609
  458   2HG   GLU  57          2HG       GLU  57   0.011  -0.525  -6.859
  459    H    LYS  58           H        LYS  58   0.733  -5.244  -7.033
  460    HA   LYS  58           HA       LYS  58   2.918  -6.209  -5.321
  461   1HB   LYS  58          1HB       LYS  58   1.242  -7.677  -7.377
  462   2HB   LYS  58          2HB       LYS  58   2.709  -8.329  -6.675
  463   1HG   LYS  58          1HG       LYS  58   1.491  -9.064  -4.911
  464   2HG   LYS  58          2HG       LYS  58   1.197  -7.396  -4.460
  465   1HD   LYS  58          1HD       LYS  58  -0.640  -7.694  -6.491
  466   2HD   LYS  58          2HD       LYS  58  -0.599  -9.328  -5.860
  467   1HE   LYS  58          1HE       LYS  58  -1.068  -8.478  -3.568
  468   2HE   LYS  58          2HE       LYS  58  -1.049  -6.829  -4.159
  469   1HZ   LYS  58          1HZ       LYS  58  -2.808  -8.561  -5.599
  470   2HZ   LYS  58          2HZ       LYS  58  -3.219  -8.363  -4.031
  471   3HZ   LYS  58          3HZ       LYS  58  -3.075  -7.062  -5.009
  472    H    PHE  59           H        PHE  59   4.956  -6.704  -6.380
  473    HA   PHE  59           HA       PHE  59   5.241  -5.735  -9.092
  474   1HB   PHE  59          1HB       PHE  59   6.795  -4.659  -6.661
  475   2HB   PHE  59          2HB       PHE  59   7.092  -4.187  -8.323
  476    HD1  PHE  59           HD1      PHE  59   4.772  -3.386  -9.542
  477    HD2  PHE  59           HD2      PHE  59   5.650  -3.119  -5.399
  478    HE1  PHE  59           HE1      PHE  59   3.113  -1.518  -9.311
  479    HE2  PHE  59           HE2      PHE  59   3.992  -1.251  -5.168
  480    HZ   PHE  59           HZ       PHE  59   2.742  -0.473  -7.126
  481    H    GLU  60           H        GLU  60   6.304  -7.386 -10.074
  482    HA   GLU  60           HA       GLU  60   7.807  -9.218  -8.560
  483   1HB   GLU  60          1HB       GLU  60   6.495  -9.639 -10.737
  484   2HB   GLU  60          2HB       GLU  60   7.841  -8.908 -11.587
  485   1HG   GLU  60          1HG       GLU  60   9.393 -10.593 -10.553
  486   2HG   GLU  60          2HG       GLU  60   8.027 -11.338  -9.745
  487    H    THR  61           H        THR  61   8.624  -6.570 -10.886
  488    HA   THR  61           HA       THR  61  11.452  -6.926 -10.192
  489    HB   THR  61           HB       THR  61  11.790  -5.521 -12.248
  490    HG1  THR  61           HG1      THR  61   9.663  -5.158 -13.414
  491   1HG2  THR  61          1HG2      THR  61  10.320  -8.104 -12.251
  492   2HG2  THR  61          2HG2      THR  61  10.056  -7.134 -13.720
  493   3HG2  THR  61          3HG2      THR  61  11.708  -7.596 -13.244
  494    H    ARG  62           H        ARG  62  12.764  -4.930  -9.860
  495    HA   ARG  62           HA       ARG  62  11.431  -3.387  -7.895
  496   1HB   ARG  62          1HB       ARG  62  13.875  -4.188  -7.819
  497   2HB   ARG  62          2HB       ARG  62  14.241  -2.970  -9.024
  498   1HG   ARG  62          1HG       ARG  62  13.290  -1.211  -7.459
  499   2HG   ARG  62          2HG       ARG  62  13.087  -2.458  -6.244
  500   1HD   ARG  62          1HD       ARG  62  15.802  -2.072  -7.541
  501   2HD   ARG  62          2HD       ARG  62  15.293  -0.982  -6.268
  502    HE   ARG  62           HE       ARG  62  14.904  -3.791  -5.559
  503   1HH1  ARG  62          1HH1      ARG  62  17.231  -1.152  -5.636
  504   2HH1  ARG  62          2HH1      ARG  62  18.220  -1.817  -4.379
  505   1HH2  ARG  62          1HH2      ARG  62  16.209  -4.669  -3.901
  506   2HH2  ARG  62          2HH2      ARG  62  17.635  -3.832  -3.386
  507    H    SER  63           H        SER  63  12.550  -2.996 -11.265
  508    HA   SER  63           HA       SER  63  12.591  -0.287 -11.464
  509   1HB   SER  63          1HB       SER  63  11.606  -2.313 -13.522
  510   2HB   SER  63          2HB       SER  63  12.049  -0.658 -13.891
  511    HG   SER  63           HG       SER  63  14.217  -1.160 -13.021
  512    H    GLU  64           H        GLU  64   9.782  -2.507 -12.136
  513    HA   GLU  64           HA       GLU  64   7.994  -0.409 -12.534
  514   1HB   GLU  64          1HB       GLU  64   7.931  -3.333 -12.420
  515   2HB   GLU  64          2HB       GLU  64   6.498  -2.649 -11.680
  516   1HG   GLU  64          1HG       GLU  64   7.507  -1.713 -14.399
  517   2HG   GLU  64          2HG       GLU  64   6.419  -3.079 -14.236
  518    H    ALA  65           H        ALA  65   9.333  -1.899  -9.659
  519    HA   ALA  65           HA       ALA  65   7.200  -1.265  -7.904
  520   1HB   ALA  65          1HB       ALA  65  10.063  -1.510  -7.011
  521   2HB   ALA  65          2HB       ALA  65   8.581  -2.160  -6.268
  522   3HB   ALA  65          3HB       ALA  65   9.257  -2.927  -7.724
  523    H    THR  66           H        THR  66  10.549   0.145  -8.071
  524    HA   THR  66           HA       THR  66  10.019   2.387  -6.579
  525    HB   THR  66           HB       THR  66  12.263   1.497  -7.361
  526    HG1  THR  66           HG1      THR  66  11.511   4.241  -8.091
  527   1HG2  THR  66          1HG2      THR  66  12.029   1.155  -9.733
  528   2HG2  THR  66          2HG2      THR  66  11.270   2.750  -9.962
  529   3HG2  THR  66          3HG2      THR  66  13.006   2.636  -9.587
  530    H    LYS  67           H        LYS  67   8.954   1.633  -9.833
  531    HA   LYS  67           HA       LYS  67   8.478   4.356 -10.548
  532   1HB   LYS  67          1HB       LYS  67   8.889   2.245 -12.045
  533   2HB   LYS  67          2HB       LYS  67   7.164   1.989 -11.863
  534   1HG   LYS  67          1HG       LYS  67   6.655   4.177 -12.808
  535   2HG   LYS  67          2HG       LYS  67   8.339   4.658 -12.758
  536   1HD   LYS  67          1HD       LYS  67   7.777   2.147 -14.280
  537   2HD   LYS  67          2HD       LYS  67   7.109   3.607 -14.978
  538   1HE   LYS  67          1HE       LYS  67   9.694   4.402 -14.257
  539   2HE   LYS  67          2HE       LYS  67   9.933   2.746 -14.776
  540   1HZ   LYS  67          1HZ       LYS  67   9.445   4.985 -16.349
  541   2HZ   LYS  67          2HZ       LYS  67   9.755   3.457 -16.834
  542   3HZ   LYS  67          3HZ       LYS  67   8.215   3.935 -16.579
  543    H    ALA  68           H        ALA  68   6.514   1.591  -9.302
  544    HA   ALA  68           HA       ALA  68   4.084   3.019  -9.343
  545   1HB   ALA  68          1HB       ALA  68   4.314   0.911  -7.314
  546   2HB   ALA  68          2HB       ALA  68   3.267   1.001  -8.751
  547   3HB   ALA  68          3HB       ALA  68   4.936   0.402  -8.902
  548    H    GLU  69           H        GLU  69   6.811   2.775  -7.068
  549    HA   GLU  69           HA       GLU  69   5.404   3.831  -4.883
  550   1HB   GLU  69          1HB       GLU  69   7.732   2.540  -5.076
  551   2HB   GLU  69          2HB       GLU  69   8.390   4.160  -5.187
  552   1HG   GLU  69          1HG       GLU  69   6.516   3.244  -2.955
  553   2HG   GLU  69          2HG       GLU  69   8.265   3.231  -2.823
  554    H    ALA  70           H        ALA  70   7.668   5.260  -7.332
  555    HA   ALA  70           HA       ALA  70   7.757   7.821  -6.356
  556   1HB   ALA  70          1HB       ALA  70   8.509   8.424  -8.543
  557   2HB   ALA  70          2HB       ALA  70   9.040   6.744  -8.285
  558   3HB   ALA  70          3HB       ALA  70   7.616   7.082  -9.298
  559    H    ALA  71           H        ALA  71   5.281   6.240  -8.453
  560    HA   ALA  71           HA       ALA  71   3.783   8.577  -8.891
  561   1HB   ALA  71          1HB       ALA  71   3.798   5.961  -9.798
  562   2HB   ALA  71          2HB       ALA  71   2.299   6.031  -8.840
  563   3HB   ALA  71          3HB       ALA  71   2.556   7.178 -10.177
  564    H    PHE  72           H        PHE  72   3.317   5.804  -6.582
  565    HA   PHE  72           HA       PHE  72   1.111   6.813  -5.298
  566   1HB   PHE  72          1HB       PHE  72   1.996   4.534  -4.966
  567   2HB   PHE  72          2HB       PHE  72   3.542   5.156  -4.423
  568    HD1  PHE  72           HD1      PHE  72   0.163   4.295  -3.457
  569    HD2  PHE  72           HD2      PHE  72   3.732   6.199  -2.176
  570    HE1  PHE  72           HE1      PHE  72  -0.622   4.163  -1.076
  571    HE2  PHE  72           HE2      PHE  72   2.948   6.067   0.205
  572    HZ   PHE  72           HZ       PHE  72   0.780   5.050   0.726
  573    H    LYS  73           H        LYS  73   4.485   7.830  -5.115
  574    HA   LYS  73           HA       LYS  73   4.129   9.186  -2.605
  575   1HB   LYS  73          1HB       LYS  73   6.284   8.269  -3.014
  576   2HB   LYS  73          2HB       LYS  73   6.387   8.994  -4.606
  577   1HG   LYS  73          1HG       LYS  73   7.025  11.042  -3.782
  578   2HG   LYS  73          2HG       LYS  73   5.919  10.960  -2.425
  579   1HD   LYS  73          1HD       LYS  73   8.440   9.252  -2.551
  580   2HD   LYS  73          2HD       LYS  73   8.457  10.876  -1.893
  581   1HE   LYS  73          1HE       LYS  73   6.544  10.142  -0.332
  582   2HE   LYS  73          2HE       LYS  73   6.830   8.501  -0.879
  583   1HZ   LYS  73          1HZ       LYS  73   8.333  10.050   0.940
  584   2HZ   LYS  73          2HZ       LYS  73   8.378   8.440   0.671
  585   3HZ   LYS  73          3HZ       LYS  73   9.289   9.446  -0.237
  586    H    LYS  74           H        LYS  74   3.361   9.752  -5.919
  587    HA   LYS  74           HA       LYS  74   3.413  12.647  -5.520
  588   1HB   LYS  74          1HB       LYS  74   4.004  10.962  -7.722
  589   2HB   LYS  74          2HB       LYS  74   2.539  11.829  -8.141
  590   1HG   LYS  74          1HG       LYS  74   3.569  13.960  -7.888
  591   2HG   LYS  74          2HG       LYS  74   4.872  13.323  -6.904
  592   1HD   LYS  74          1HD       LYS  74   4.524  12.420  -9.787
  593   2HD   LYS  74          2HD       LYS  74   5.361  13.914  -9.416
  594   1HE   LYS  74          1HE       LYS  74   6.129  11.299  -8.059
  595   2HE   LYS  74          2HE       LYS  74   6.785  11.736  -9.623
  596   1HZ   LYS  74          1HZ       LYS  74   7.831  12.497  -7.319
  597   2HZ   LYS  74          2HZ       LYS  74   8.041  13.320  -8.713
  598   3HZ   LYS  74          3HZ       LYS  74   6.909  13.806  -7.641
  599    H    LEU  75           H        LEU  75   1.408   9.999  -4.987
  600    HA   LEU  75           HA       LEU  75  -1.021  11.371  -5.794
  601   1HB   LEU  75          1HB       LEU  75  -0.600   8.668  -4.515
  602   2HB   LEU  75          2HB       LEU  75  -2.127   9.305  -5.089
  603    HG   LEU  75           HG       LEU  75   0.240   8.341  -6.666
  604   1HD1  LEU  75          1HD1      LEU  75  -1.092   6.617  -7.061
  605   2HD1  LEU  75          2HD1      LEU  75  -2.352   7.358  -6.044
  606   3HD1  LEU  75          3HD1      LEU  75  -2.305   7.697  -7.791
  607   1HD2  LEU  75          1HD2      LEU  75  -0.948   9.280  -8.717
  608   2HD2  LEU  75          2HD2      LEU  75  -1.817  10.347  -7.589
  609   3HD2  LEU  75          3HD2      LEU  75  -0.042  10.431  -7.704
  610    H    THR  76           H        THR  76  -2.821  11.604  -4.178
  611    HA   THR  76           HA       THR  76  -1.786  12.014  -1.459
  612    HB   THR  76           HB       THR  76  -1.730  14.208  -2.543
  613    HG1  THR  76           HG1      THR  76  -3.026  15.066  -0.915
  614   1HG2  THR  76          1HG2      THR  76  -4.239  15.003  -3.194
  615   2HG2  THR  76          2HG2      THR  76  -3.139  14.305  -4.406
  616   3HG2  THR  76          3HG2      THR  76  -4.382  13.286  -3.642
  617    H    ARG  77           H        ARG  77  -3.966  12.779  -0.109
  618    HA   ARG  77           HA       ARG  77  -5.297  10.470   0.281
  619   1HB   ARG  77          1HB       ARG  77  -6.973  11.844   1.532
  620   2HB   ARG  77          2HB       ARG  77  -5.333  12.358   1.876
  621   1HG   ARG  77          1HG       ARG  77  -6.258  13.818  -0.443
  622   2HG   ARG  77          2HG       ARG  77  -7.500  13.918   0.791
  623   1HD   ARG  77          1HD       ARG  77  -5.320  14.384   2.358
  624   2HD   ARG  77          2HD       ARG  77  -4.687  14.976   0.835
  625    HE   ARG  77           HE       ARG  77  -6.880  16.156   2.402
  626   1HH1  ARG  77          1HH1      ARG  77  -5.285  16.016  -0.732
  627   2HH1  ARG  77          2HH1      ARG  77  -5.895  17.550  -1.254
  628   1HH2  ARG  77          1HH2      ARG  77  -7.686  18.180   1.714
  629   2HH2  ARG  77          2HH2      ARG  77  -7.270  18.791   0.148
  630    H    LYS  78           H        LYS  78  -5.680  12.759  -2.313
  631    HA   LYS  78           HA       LYS  78  -8.410  12.015  -2.880
  632   1HB   LYS  78          1HB       LYS  78  -7.028  14.298  -3.287
  633   2HB   LYS  78          2HB       LYS  78  -6.779  13.539  -4.847
  634   1HG   LYS  78          1HG       LYS  78  -8.819  14.460  -5.350
  635   2HG   LYS  78          2HG       LYS  78  -9.454  13.049  -4.525
  636   1HD   LYS  78          1HD       LYS  78 -10.276  14.304  -2.813
  637   2HD   LYS  78          2HD       LYS  78  -8.754  15.144  -2.598
  638   1HE   LYS  78          1HE       LYS  78 -10.271  15.918  -5.051
  639   2HE   LYS  78          2HE       LYS  78 -11.061  16.327  -3.540
  640   1HZ   LYS  78          1HZ       LYS  78  -9.287  17.876  -4.606
  641   2HZ   LYS  78          2HZ       LYS  78  -9.409  17.742  -2.983
  642   3HZ   LYS  78          3HZ       LYS  78  -8.239  16.933  -3.783
  643    H    GLN  79           H        GLN  79  -5.479  12.038  -5.015
  644    HA   GLN  79           HA       GLN  79  -6.343  10.284  -6.821
  645   1HB   GLN  79          1HB       GLN  79  -3.536  10.594  -5.681
  646   2HB   GLN  79          2HB       GLN  79  -3.877   9.650  -7.118
  647   1HG   GLN  79          1HG       GLN  79  -5.066  12.386  -7.119
  648   2HG   GLN  79          2HG       GLN  79  -3.313  12.352  -7.120
  649   1HE2  GLN  79          1HE2      GLN  79  -2.253  11.955  -8.934
  650   2HE2  GLN  79          2HE2      GLN  79  -2.943  11.438 -10.436
  651    H    LYS  80           H        LYS  80  -5.032   9.534  -3.567
  652    HA   LYS  80           HA       LYS  80  -4.837   6.753  -3.982
  653   1HB   LYS  80          1HB       LYS  80  -4.815   8.591  -1.610
  654   2HB   LYS  80          2HB       LYS  80  -4.984   6.867  -1.348
  655   1HG   LYS  80          1HG       LYS  80  -2.805   6.457  -1.889
  656   2HG   LYS  80          2HG       LYS  80  -2.881   7.463  -3.322
  657   1HD   LYS  80          1HD       LYS  80  -2.354   9.450  -2.114
  658   2HD   LYS  80          2HD       LYS  80  -2.797   8.744  -0.571
  659   1HE   LYS  80          1HE       LYS  80  -0.543   7.470  -2.131
  660   2HE   LYS  80          2HE       LYS  80  -0.227   8.982  -1.304
  661   1HZ   LYS  80          1HZ       LYS  80  -1.272   7.839   0.679
  662   2HZ   LYS  80          2HZ       LYS  80  -1.073   6.440  -0.139
  663   3HZ   LYS  80          3HZ       LYS  80   0.226   7.354   0.243
  664    H    GLU  81           H        GLU  81  -7.311   8.756  -2.220
  665    HA   GLU  81           HA       GLU  81  -9.020   6.644  -1.775
  666   1HB   GLU  81          1HB       GLU  81  -9.123   8.879  -0.651
  667   2HB   GLU  81          2HB       GLU  81  -9.717   9.591  -2.137
  668   1HG   GLU  81          1HG       GLU  81 -11.826   9.026  -1.532
  669   2HG   GLU  81          2HG       GLU  81 -11.388   7.334  -1.665
  670    H    GLN  82           H        GLN  82  -8.197   8.258  -4.718
  671    HA   GLN  82           HA       GLN  82 -10.701   7.882  -5.987
  672   1HB   GLN  82          1HB       GLN  82  -7.976   8.848  -6.759
  673   2HB   GLN  82          2HB       GLN  82  -8.957   8.202  -8.060
  674   1HG   GLN  82          1HG       GLN  82  -9.785  10.425  -6.133
  675   2HG   GLN  82          2HG       GLN  82  -9.320  10.641  -7.808
  676   1HE2  GLN  82          1HE2      GLN  82 -11.860  10.695  -5.897
  677   2HE2  GLN  82          2HE2      GLN  82 -13.125  10.088  -6.914
  678    H    TYR  83           H        TYR  83  -7.589   6.104  -5.754
  679    HA   TYR  83           HA       TYR  83  -8.286   4.175  -7.724
  680   1HB   TYR  83          1HB       TYR  83  -5.950   4.526  -7.216
  681   2HB   TYR  83          2HB       TYR  83  -6.252   4.619  -5.493
  682    HD1  TYR  83           HD1      TYR  83  -6.994   2.418  -4.306
  683    HD2  TYR  83           HD2      TYR  83  -5.146   2.536  -8.163
  684    HE1  TYR  83           HE1      TYR  83  -6.307  -0.017  -4.058
  685    HE2  TYR  83           HE2      TYR  83  -4.465   0.100  -7.902
  686    HH   TYR  83           HH       TYR  83  -4.891  -1.576  -4.867
  687    H    LEU  84           H        LEU  84  -8.963   4.615  -4.286
  688    HA   LEU  84           HA       LEU  84  -9.459   1.882  -3.730
  689   1HB   LEU  84          1HB       LEU  84  -9.891   4.499  -2.375
  690   2HB   LEU  84          2HB       LEU  84 -10.820   3.123  -1.813
  691    HG   LEU  84           HG       LEU  84  -8.783   3.461  -0.497
  692   1HD1  LEU  84          1HD1      LEU  84  -9.636   1.230  -0.571
  693   2HD1  LEU  84          2HD1      LEU  84  -8.860   0.922  -2.143
  694   3HD1  LEU  84          3HD1      LEU  84  -7.862   1.142  -0.685
  695   1HD2  LEU  84          1HD2      LEU  84  -6.767   2.499  -2.257
  696   2HD2  LEU  84          2HD2      LEU  84  -7.581   3.868  -3.053
  697   3HD2  LEU  84          3HD2      LEU  84  -6.871   4.074  -1.434
  698    H    LYS  85           H        LYS  85 -11.561   4.720  -4.540
  699    HA   LYS  85           HA       LYS  85 -13.941   3.222  -4.484
  700   1HB   LYS  85          1HB       LYS  85 -13.753   5.701  -4.236
  701   2HB   LYS  85          2HB       LYS  85 -13.355   5.817  -5.939
  702   1HG   LYS  85          1HG       LYS  85 -15.508   5.148  -6.636
  703   2HG   LYS  85          2HG       LYS  85 -15.848   4.305  -5.138
  704   1HD   LYS  85          1HD       LYS  85 -16.582   6.209  -4.068
  705   2HD   LYS  85          2HD       LYS  85 -15.358   7.223  -4.806
  706   1HE   LYS  85          1HE       LYS  85 -16.622   7.438  -6.855
  707   2HE   LYS  85          2HE       LYS  85 -17.704   6.132  -6.417
  708   1HZ   LYS  85          1HZ       LYS  85 -18.023   8.796  -5.871
  709   2HZ   LYS  85          2HZ       LYS  85 -18.965   7.567  -5.353
  710   3HZ   LYS  85          3HZ       LYS  85 -17.731   8.099  -4.423
  711    H    THR  86           H        THR  86 -11.972   4.469  -7.276
  712    HA   THR  86           HA       THR  86 -13.390   3.228  -9.278
  713    HB   THR  86           HB       THR  86 -11.346   4.927  -9.231
  714    HG1  THR  86           HG1      THR  86 -12.443   4.261 -11.168
  715   1HG2  THR  86          1HG2      THR  86  -9.205   3.996  -9.639
  716   2HG2  THR  86          2HG2      THR  86  -9.821   2.937  -8.350
  717   3HG2  THR  86          3HG2      THR  86  -9.876   2.398 -10.046
  718    H    PHE  87           H        PHE  87 -11.367   1.780  -6.818
  719    HA   PHE  87           HA       PHE  87 -11.070  -0.653  -8.358
  720   1HB   PHE  87          1HB       PHE  87  -9.196   0.037  -6.957
  721   2HB   PHE  87          2HB       PHE  87 -10.253   0.434  -5.615
  722    HD1  PHE  87           HD1      PHE  87 -11.020  -1.268  -4.091
  723    HD2  PHE  87           HD2      PHE  87  -8.624  -2.303  -7.438
  724    HE1  PHE  87           HE1      PHE  87 -10.612  -3.537  -3.098
  725    HE2  PHE  87           HE2      PHE  87  -8.217  -4.572  -6.445
  726    HZ   PHE  87           HZ       PHE  87  -9.215  -5.163  -4.287
  727    H    HIS  88           H        HIS  88 -12.961   0.685  -5.626
  728    HA   HIS  88           HA       HIS  88 -14.007  -1.823  -4.843
  729   1HB   HIS  88          1HB       HIS  88 -14.016   0.841  -3.893
  730   2HB   HIS  88          2HB       HIS  88 -15.698   0.408  -4.128
  731    HD1  HIS  88           HD1      HIS  88 -13.421   0.480  -1.503
  732    HD2  HIS  88           HD2      HIS  88 -15.934  -2.543  -2.964
  733    HE1  HIS  88           HE1      HIS  88 -13.732  -1.178   0.411
  734    H    LEU  89           H        LEU  89 -15.239   0.935  -6.844
  735    HA   LEU  89           HA       LEU  89 -17.748   0.018  -7.359
  736   1HB   LEU  89          1HB       LEU  89 -15.841   1.445  -9.216
  737   2HB   LEU  89          2HB       LEU  89 -17.565   1.279  -9.487
  738    HG   LEU  89           HG       LEU  89 -16.329   2.684  -7.102
  739   1HD1  LEU  89          1HD1      LEU  89 -15.759   4.108  -8.820
  740   2HD1  LEU  89          2HD1      LEU  89 -17.181   3.680  -9.799
  741   3HD1  LEU  89          3HD1      LEU  89 -17.368   4.724  -8.368
  742   1HD2  LEU  89          1HD2      LEU  89 -19.195   2.495  -8.064
  743   2HD2  LEU  89          2HD2      LEU  89 -18.514   1.820  -6.563
  744   3HD2  LEU  89          3HD2      LEU  89 -18.620   3.584  -6.780
  745    H    GLU  90           H        GLU  90 -14.783  -0.678  -9.347
  746    HA   GLU  90           HA       GLU  90 -15.845  -3.305  -9.812
  747   1HB   GLU  90          1HB       GLU  90 -16.169  -1.215 -11.758
  748   2HB   GLU  90          2HB       GLU  90 -14.973  -2.331 -12.386
  749   1HG   GLU  90          1HG       GLU  90 -16.591  -4.236 -11.792
  750   2HG   GLU  90          2HG       GLU  90 -17.794  -3.011 -11.444
  751    H    HIS  91           H        HIS  91 -14.201  -4.840 -10.236
  752    HA   HIS  91           HA       HIS  91 -11.502  -3.700 -10.167
  753   1HB   HIS  91          1HB       HIS  91 -10.868  -5.919  -9.147
  754   2HB   HIS  91          2HB       HIS  91 -11.838  -4.857  -8.146
  755    HD1  HIS  91           HD1      HIS  91 -11.654  -8.288  -9.230
  756    HD2  HIS  91           HD2      HIS  91 -14.770  -5.624  -8.338
  757    HE1  HIS  91           HE1      HIS  91 -13.719  -9.722  -8.797
  758    H    HIS  92           H        HIS  92 -13.241  -6.732 -11.194
  759    HA   HIS  92           HA       HIS  92 -13.089  -7.951 -13.009
  760   1HB   HIS  92          1HB       HIS  92 -13.064  -5.308 -13.936
  761   2HB   HIS  92          2HB       HIS  92 -11.773  -6.093 -14.823
  762    HD1  HIS  92           HD1      HIS  92 -12.888  -6.345 -17.086
  763    HD2  HIS  92           HD2      HIS  92 -15.214  -7.870 -13.946
  764    HE1  HIS  92           HE1      HIS  92 -14.853  -7.557 -18.174
  765    H    HIS  93           H        HIS  93 -11.488  -9.215 -11.777
  766    HA   HIS  93           HA       HIS  93  -8.748  -8.683 -12.027
  767   1HB   HIS  93          1HB       HIS  93 -10.462 -10.619 -10.763
  768   2HB   HIS  93          2HB       HIS  93  -9.161 -11.459 -11.580
  769    HD1  HIS  93           HD1      HIS  93  -6.678 -10.889 -10.804
  770    HD2  HIS  93           HD2      HIS  93  -9.726  -9.200  -8.469
  771    HE1  HIS  93           HE1      HIS  93  -5.573 -10.109  -8.640
  772    H    HIS  94           H        HIS  94  -7.184  -9.421 -13.478
  773    HA   HIS  94           HA       HIS  94  -8.253 -10.928 -15.751
  774   1HB   HIS  94          1HB       HIS  94  -7.935  -8.646 -16.442
  775   2HB   HIS  94          2HB       HIS  94  -6.331  -8.590 -15.739
  776    HD1  HIS  94           HD1      HIS  94  -5.592  -7.864 -18.235
  777    HD2  HIS  94           HD2      HIS  94  -6.908 -11.820 -17.772
  778    HE1  HIS  94           HE1      HIS  94  -4.808  -9.126 -20.309
  779    H    HIS  95           H        HIS  95  -7.313 -12.890 -15.986
  780    HA   HIS  95           HA       HIS  95  -5.057 -13.537 -14.377
  781   1HB   HIS  95          1HB       HIS  95  -6.988 -15.060 -14.894
  782   2HB   HIS  95          2HB       HIS  95  -6.397 -15.183 -16.538
  783    HD1  HIS  95           HD1      HIS  95  -5.746 -17.650 -16.488
  784    HD2  HIS  95           HD2      HIS  95  -3.966 -15.409 -13.421
  785    HE1  HIS  95           HE1      HIS  95  -4.012 -19.175 -15.402
  786    H    HIS  96           H        HIS  96  -2.987 -13.048 -14.882
  787    HA   HIS  96           HA       HIS  96  -1.213 -12.487 -16.053
  788   1HB   HIS  96          1HB       HIS  96  -0.846 -14.673 -16.625
  789   2HB   HIS  96          2HB       HIS  96  -2.348 -14.822 -17.514
  790    HD1  HIS  96           HD1      HIS  96  -1.626 -15.507 -19.818
  791    HD2  HIS  96           HD2      HIS  96   0.634 -12.303 -18.329
  792    HE1  HIS  96           HE1      HIS  96  -0.105 -14.759 -21.725
  Start of MODEL    6
    1   1H    MET   1          1H        MET   1   2.484 -16.120  -4.571
    2    HA   MET   1           HA       MET   1   0.859 -14.643  -4.030
    3   1HB   MET   1          1HB       MET   1   0.751 -17.262  -2.891
    4   2HB   MET   1          2HB       MET   1   0.127 -16.203  -1.643
    5   1HG   MET   1          1HG       MET   1  -1.401 -15.169  -3.443
    6   2HG   MET   1          2HG       MET   1  -0.897 -16.468  -4.505
    7   1HE   MET   1          1HE       MET   1  -2.589 -17.745  -5.009
    8   2HE   MET   1          2HE       MET   1  -1.900 -19.141  -4.147
    9   3HE   MET   1          3HE       MET   1  -3.625 -18.745  -3.962
   10    H    GLU   2           H        GLU   2   2.439 -15.691  -0.922
   11    HA   GLU   2           HA       GLU   2   2.425 -12.900  -0.149
   12   1HB   GLU   2          1HB       GLU   2   1.145 -15.178   1.386
   13   2HB   GLU   2          2HB       GLU   2   1.779 -13.787   2.243
   14   1HG   GLU   2          1HG       GLU   2   0.245 -12.289   1.224
   15   2HG   GLU   2          2HG       GLU   2  -0.062 -13.362  -0.127
   16    H    ASN   3           H        ASN   3   3.658 -12.884   2.233
   17    HA   ASN   3           HA       ASN   3   5.513 -13.208   3.314
   18   1HB   ASN   3          1HB       ASN   3   6.128 -15.800   1.853
   19   2HB   ASN   3          2HB       ASN   3   6.472 -15.385   3.520
   20   1HD2  ASN   3          1HD2      ASN   3   5.044 -15.810   5.083
   21   2HD2  ASN   3          2HD2      ASN   3   3.485 -16.531   4.858
   22    H    LYS   4           H        LYS   4   8.065 -14.239   2.605
   23    HA   LYS   4           HA       LYS   4   9.149 -12.312   1.039
   24   1HB   LYS   4          1HB       LYS   4  10.556 -13.644   2.400
   25   2HB   LYS   4          2HB       LYS   4  10.035 -15.135   1.642
   26   1HG   LYS   4          1HG       LYS   4  11.038 -13.428  -0.447
   27   2HG   LYS   4          2HG       LYS   4  12.201 -13.379   0.864
   28   1HD   LYS   4          1HD       LYS   4  12.841 -15.554   0.547
   29   2HD   LYS   4          2HD       LYS   4  11.192 -16.110   0.336
   30   1HE   LYS   4          1HE       LYS   4  12.017 -16.456  -1.820
   31   2HE   LYS   4          2HE       LYS   4  11.364 -14.840  -2.000
   32   1HZ   LYS   4          1HZ       LYS   4  14.000 -15.653  -2.266
   33   2HZ   LYS   4          2HZ       LYS   4  13.383 -14.155  -2.477
   34   3HZ   LYS   4          3HZ       LYS   4  13.940 -14.611  -1.011
   35    H    LYS   5           H        LYS   5   8.066 -11.751  -0.847
   36    HA   LYS   5           HA       LYS   5   8.751 -13.095  -3.160
   37   1HB   LYS   5          1HB       LYS   5   6.864 -14.610  -1.929
   38   2HB   LYS   5          2HB       LYS   5   5.834 -13.555  -2.875
   39   1HG   LYS   5          1HG       LYS   5   6.274 -14.846  -4.686
   40   2HG   LYS   5          2HG       LYS   5   7.926 -14.263  -4.645
   41   1HD   LYS   5          1HD       LYS   5   7.169 -16.503  -2.769
   42   2HD   LYS   5          2HD       LYS   5   7.355 -16.883  -4.470
   43   1HE   LYS   5          1HE       LYS   5   9.647 -16.392  -4.482
   44   2HE   LYS   5          2HE       LYS   5   9.519 -15.231  -3.176
   45   1HZ   LYS   5          1HZ       LYS   5   8.757 -17.783  -2.290
   46   2HZ   LYS   5          2HZ       LYS   5  10.239 -17.856  -2.972
   47   3HZ   LYS   5          3HZ       LYS   5   9.959 -16.822  -1.740
   48    H    SER   6           H        SER   6   9.207 -11.060  -3.953
   49    HA   SER   6           HA       SER   6   8.822  -9.166  -4.940
   50   1HB   SER   6          1HB       SER   6   7.106  -9.593  -6.368
   51   2HB   SER   6          2HB       SER   6   6.222 -10.513  -5.166
   52    HG   SER   6           HG       SER   6   5.182  -8.473  -5.935
   53    H    HIS   7           H        HIS   7   7.581  -6.912  -4.614
   54    HA   HIS   7           HA       HIS   7   7.507  -6.525  -1.731
   55   1HB   HIS   7          1HB       HIS   7   8.023  -4.718  -4.084
   56   2HB   HIS   7          2HB       HIS   7   7.587  -4.047  -2.525
   57    HD1  HIS   7           HD1      HIS   7  10.488  -4.519  -4.377
   58    HD2  HIS   7           HD2      HIS   7   9.456  -5.572  -0.450
   59    HE1  HIS   7           HE1      HIS   7  12.686  -4.832  -3.121
   60    H    TYR   8           H        TYR   8   5.581  -6.370  -0.705
   61    HA   TYR   8           HA       TYR   8   3.245  -5.740  -2.366
   62   1HB   TYR   8          1HB       TYR   8   3.941  -7.378   0.092
   63   2HB   TYR   8          2HB       TYR   8   2.338  -6.670   0.074
   64    HD1  TYR   8           HD1      TYR   8   0.580  -7.745  -1.054
   65    HD2  TYR   8           HD2      TYR   8   4.620  -8.827  -1.957
   66    HE1  TYR   8           HE1      TYR   8  -0.249  -9.679  -2.483
   67    HE2  TYR   8           HE2      TYR   8   3.778 -10.756  -3.383
   68    HH   TYR   8           HH       TYR   8   0.605 -11.849  -3.243
   69    H    PHE   9           H        PHE   9   2.916  -3.544  -2.326
   70    HA   PHE   9           HA       PHE   9   3.436  -2.096   0.110
   71   1HB   PHE   9          1HB       PHE   9   3.825  -1.407  -2.400
   72   2HB   PHE   9          2HB       PHE   9   2.086  -1.204  -2.499
   73    HD1  PHE   9           HD1      PHE   9   1.153   0.251  -0.370
   74    HD2  PHE   9           HD2      PHE   9   5.014   0.533  -2.106
   75    HE1  PHE   9           HE1      PHE   9   1.374   2.593   0.507
   76    HE2  PHE   9           HE2      PHE   9   5.236   2.877  -1.230
   77    HZ   PHE   9           HZ       PHE   9   3.414   3.878   0.066
   78    H    TYR  10           H        TYR  10   1.954  -2.171   1.738
   79    HA   TYR  10           HA       TYR  10  -0.878  -2.099   0.938
   80   1HB   TYR  10          1HB       TYR  10   0.809  -3.552   2.992
   81   2HB   TYR  10          2HB       TYR  10  -0.766  -3.024   3.552
   82    HD1  TYR  10           HD1      TYR  10  -0.124  -4.079   0.060
   83    HD2  TYR  10           HD2      TYR  10  -1.675  -5.229   3.879
   84    HE1  TYR  10           HE1      TYR  10  -1.190  -6.136  -0.984
   85    HE2  TYR  10           HE2      TYR  10  -2.735  -7.283   2.821
   86    HH   TYR  10           HH       TYR  10  -1.858  -8.502  -0.020
   87    H    VAL  11           H        VAL  11  -1.938  -0.255   1.459
   88    HA   VAL  11           HA       VAL  11  -0.630   1.574   3.295
   89    HB   VAL  11           HB       VAL  11  -3.165   1.999   1.719
   90   1HG1  VAL  11          1HG1      VAL  11  -3.029   3.857   3.024
   91   2HG1  VAL  11          2HG1      VAL  11  -1.272   3.702   3.260
   92   3HG1  VAL  11          3HG1      VAL  11  -1.910   4.380   1.743
   93   1HG2  VAL  11          1HG2      VAL  11  -0.990   3.197   0.357
   94   2HG2  VAL  11          2HG2      VAL  11  -0.524   1.509   0.680
   95   3HG2  VAL  11          3HG2      VAL  11  -2.032   1.863  -0.196
   96    H    LEU  12           H        LEU  12  -0.978   1.101   5.421
   97    HA   LEU  12           HA       LEU  12  -3.484  -0.059   6.226
   98   1HB   LEU  12          1HB       LEU  12  -1.028   0.794   7.763
   99   2HB   LEU  12          2HB       LEU  12  -2.432   0.035   8.485
  100    HG   LEU  12           HG       LEU  12  -0.695  -1.223   6.343
  101   1HD1  LEU  12          1HD1      LEU  12  -0.785  -1.853   9.306
  102   2HD1  LEU  12          2HD1      LEU  12   0.259  -2.600   8.072
  103   3HD1  LEU  12          3HD1      LEU  12   0.480  -0.889   8.505
  104   1HD2  LEU  12          1HD2      LEU  12  -3.047  -2.272   7.931
  105   2HD2  LEU  12          2HD2      LEU  12  -2.883  -2.130   6.164
  106   3HD2  LEU  12          3HD2      LEU  12  -1.904  -3.320   7.056
  107    H    LEU  13           H        LEU  13  -4.992   0.910   7.715
  108    HA   LEU  13           HA       LEU  13  -4.742   3.823   7.913
  109   1HB   LEU  13          1HB       LEU  13  -6.284   3.982   6.322
  110   2HB   LEU  13          2HB       LEU  13  -6.714   2.287   6.419
  111    HG   LEU  13           HG       LEU  13  -8.094   2.834   8.463
  112   1HD1  LEU  13          1HD1      LEU  13  -7.791   5.711   7.581
  113   2HD1  LEU  13          2HD1      LEU  13  -8.656   5.076   9.002
  114   3HD1  LEU  13          3HD1      LEU  13  -6.879   4.994   8.931
  115   1HD2  LEU  13          1HD2      LEU  13  -9.007   4.354   6.017
  116   2HD2  LEU  13          2HD2      LEU  13  -8.948   2.577   6.082
  117   3HD2  LEU  13          3HD2      LEU  13  -9.989   3.474   7.214
  118    H    CYS  14           H        CYS  14  -4.615   4.289  10.038
  119    HA   CYS  14           HA       CYS  14  -5.468   2.422  11.979
  120   1HB   CYS  14          1HB       CYS  14  -4.164   5.097  11.981
  121   2HB   CYS  14          2HB       CYS  14  -5.045   4.664  13.432
  122    HG   CYS  14           HG       CYS  14  -2.221   4.076  12.954
  123    H    GLN  15           H        GLN  15  -6.865   3.590  13.939
  124    HA   GLN  15           HA       GLN  15  -9.415   3.898  12.789
  125   1HB   GLN  15          1HB       GLN  15  -8.539   3.001  15.188
  126   2HB   GLN  15          2HB       GLN  15  -8.934   4.644  15.656
  127   1HG   GLN  15          1HG       GLN  15 -10.999   3.611  15.996
  128   2HG   GLN  15          2HG       GLN  15 -11.203   4.174  14.348
  129   1HE2  GLN  15          1HE2      GLN  15 -11.124   1.522  16.448
  130   2HE2  GLN  15          2HE2      GLN  15 -11.254   0.231  15.299
  131    H    ASP  16           H        ASP  16  -7.306   6.112  14.766
  132    HA   ASP  16           HA       ASP  16  -8.893   8.295  14.687
  133   1HB   ASP  16          1HB       ASP  16  -5.962   7.780  14.908
  134   2HB   ASP  16          2HB       ASP  16  -6.377   9.414  14.437
  135    H    GLY  17           H        GLY  17  -6.648   6.962  12.217
  136   1HA   GLY  17          1HA       GLY  17  -7.358   7.369   9.902
  137   2HA   GLY  17          2HA       GLY  17  -7.552   9.058  10.329
  138    H    SER  18           H        SER  18  -5.003   6.486  10.746
  139    HA   SER  18           HA       SER  18  -3.078   8.530   9.976
  140   1HB   SER  18          1HB       SER  18  -3.068   7.007  12.235
  141   2HB   SER  18          2HB       SER  18  -2.158   5.945  11.179
  142    HG   SER  18           HG       SER  18  -1.220   8.482  10.838
  143    H    PHE  19           H        PHE  19  -2.461   8.376   7.852
  144    HA   PHE  19           HA       PHE  19  -2.807   5.870   6.477
  145   1HB   PHE  19          1HB       PHE  19  -2.202   8.777   5.915
  146   2HB   PHE  19          2HB       PHE  19  -1.581   7.641   4.736
  147    HD1  PHE  19           HD1      PHE  19  -4.737   8.518   6.515
  148    HD2  PHE  19           HD2      PHE  19  -2.953   6.946   3.001
  149    HE1  PHE  19           HE1      PHE  19  -6.989   8.438   5.409
  150    HE2  PHE  19           HE2      PHE  19  -5.206   6.865   1.894
  151    HZ   PHE  19           HZ       PHE  19  -7.196   7.613   3.111
  152    H    TYR  20           H        TYR  20  -1.254   4.350   7.001
  153    HA   TYR  20           HA       TYR  20   1.519   5.188   6.516
  154   1HB   TYR  20          1HB       TYR  20   0.201   4.337   8.942
  155   2HB   TYR  20          2HB       TYR  20   1.146   2.959   8.414
  156    HD1  TYR  20           HD1      TYR  20   3.665   3.466   7.802
  157    HD2  TYR  20           HD2      TYR  20   1.217   5.991  10.239
  158    HE1  TYR  20           HE1      TYR  20   5.746   4.510   8.824
  159    HE2  TYR  20           HE2      TYR  20   3.305   7.026  11.252
  160    HH   TYR  20           HH       TYR  20   5.514   7.285  10.944
  161    H    GLY  21           H        GLY  21   1.843   4.252   4.515
  162   1HA   GLY  21          1HA       GLY  21   1.166   1.381   4.294
  163   2HA   GLY  21          2HA       GLY  21   1.155   2.515   2.959
  164    H    GLY  22           H        GLY  22   2.736  -0.020   3.367
  165   1HA   GLY  22          1HA       GLY  22   5.299   1.060   2.551
  166   2HA   GLY  22          2HA       GLY  22   5.321   0.181   4.066
  167    H    TYR  23           H        TYR  23   6.703  -0.637   1.655
  168    HA   TYR  23           HA       TYR  23   5.108  -2.943   0.792
  169   1HB   TYR  23          1HB       TYR  23   6.799  -2.921  -1.075
  170   2HB   TYR  23          2HB       TYR  23   6.060  -1.340  -0.918
  171    HD1  TYR  23           HD1      TYR  23   9.110  -3.307  -0.107
  172    HD2  TYR  23           HD2      TYR  23   7.368   0.587  -0.416
  173    HE1  TYR  23           HE1      TYR  23  11.410  -2.249   0.138
  174    HE2  TYR  23           HE2      TYR  23   9.672   1.632  -0.170
  175    HH   TYR  23           HH       TYR  23  11.965   1.033  -0.536
  176    H    THR  24           H        THR  24   5.664  -4.985   1.406
  177    HA   THR  24           HA       THR  24   8.339  -5.734   1.946
  178    HB   THR  24           HB       THR  24   7.308  -4.303   4.032
  179    HG1  THR  24           HG1      THR  24   9.449  -5.312   3.792
  180   1HG2  THR  24          1HG2      THR  24   5.562  -6.360   4.190
  181   2HG2  THR  24          2HG2      THR  24   6.944  -7.144   4.992
  182   3HG2  THR  24          3HG2      THR  24   6.267  -5.636   5.656
  183    H    THR  25           H        THR  25   8.198  -8.017   3.247
  184    HA   THR  25           HA       THR  25   5.982  -9.461   1.948
  185    HB   THR  25           HB       THR  25   7.547 -11.157   1.316
  186    HG1  THR  25           HG1      THR  25   9.792 -10.887   2.339
  187   1HG2  THR  25          1HG2      THR  25   7.996  -9.003   0.039
  188   2HG2  THR  25          2HG2      THR  25   9.225  -8.595   1.261
  189   3HG2  THR  25          3HG2      THR  25   9.440 -10.028   0.225
  190    H    GLU  26           H        GLU  26   4.702 -10.683   3.205
  191    HA   GLU  26           HA       GLU  26   3.998 -11.837   4.918
  192   1HB   GLU  26          1HB       GLU  26   6.827 -12.179   5.154
  193   2HB   GLU  26          2HB       GLU  26   6.232 -11.849   6.770
  194   1HG   GLU  26          1HG       GLU  26   4.737 -13.829   5.036
  195   2HG   GLU  26          2HG       GLU  26   6.229 -14.333   5.804
  196    HA   PRO  27           HA       PRO  27   3.635  -7.867   7.106
  197   1HB   PRO  27          1HB       PRO  27   1.034  -7.321   6.471
  198   2HB   PRO  27          2HB       PRO  27   2.394  -6.689   5.567
  199   1HG   PRO  27          1HG       PRO  27   0.533  -8.866   4.834
  200   2HG   PRO  27          2HG       PRO  27   1.608  -7.944   3.800
  201   1HD   PRO  27          1HD       PRO  27   2.014 -10.623   4.742
  202   2HD   PRO  27          2HD       PRO  27   3.138  -9.659   3.804
  203    H    GLU  28           H        GLU  28   2.559 -10.926   7.361
  204    HA   GLU  28           HA       GLU  28   0.672 -10.454   9.432
  205   1HB   GLU  28          1HB       GLU  28   2.059 -13.010   8.512
  206   2HB   GLU  28          2HB       GLU  28   0.745 -12.958   9.670
  207   1HG   GLU  28          1HG       GLU  28   0.235 -11.509   7.106
  208   2HG   GLU  28          2HG       GLU  28   0.393 -13.249   6.960
  209    H    ARG  29           H        ARG  29   3.895 -12.156   9.358
  210    HA   ARG  29           HA       ARG  29   4.131 -12.226  12.100
  211   1HB   ARG  29          1HB       ARG  29   6.451 -12.873  11.697
  212   2HB   ARG  29          2HB       ARG  29   5.468 -13.586  10.433
  213   1HG   ARG  29          1HG       ARG  29   6.098 -11.801   8.859
  214   2HG   ARG  29          2HG       ARG  29   6.947 -10.933  10.123
  215   1HD   ARG  29          1HD       ARG  29   8.449 -12.305   8.589
  216   2HD   ARG  29          2HD       ARG  29   8.651 -12.646  10.296
  217    HE   ARG  29           HE       ARG  29   6.650 -14.383   9.101
  218   1HH1  ARG  29          1HH1      ARG  29  10.119 -13.916   9.468
  219   2HH1  ARG  29          2HH1      ARG  29  10.495 -15.592   9.246
  220   1HH2  ARG  29          1HH2      ARG  29   7.147 -16.593   8.808
  221   2HH2  ARG  29          2HH2      ARG  29   8.794 -17.126   8.868
  222    H    ARG  30           H        ARG  30   4.719  -9.673   9.736
  223    HA   ARG  30           HA       ARG  30   6.532  -8.202  11.260
  224   1HB   ARG  30          1HB       ARG  30   5.871  -8.008   8.723
  225   2HB   ARG  30          2HB       ARG  30   4.562  -6.985   9.281
  226   1HG   ARG  30          1HG       ARG  30   6.506  -5.734  10.614
  227   2HG   ARG  30          2HG       ARG  30   7.545  -6.494   9.425
  228   1HD   ARG  30          1HD       ARG  30   7.050  -4.705   8.094
  229   2HD   ARG  30          2HD       ARG  30   5.511  -5.496   7.818
  230    HE   ARG  30           HE       ARG  30   5.003  -4.148  10.140
  231   1HH1  ARG  30          1HH1      ARG  30   6.482  -3.113   7.120
  232   2HH1  ARG  30          2HH1      ARG  30   5.953  -1.471   7.274
  233   1HH2  ARG  30          1HH2      ARG  30   4.302  -1.982  10.344
  234   2HH2  ARG  30          2HH2      ARG  30   4.703  -0.824   9.119
  235    H    LEU  31           H        LEU  31   3.001  -7.615  10.547
  236    HA   LEU  31           HA       LEU  31   2.522  -5.530  12.168
  237   1HB   LEU  31          1HB       LEU  31   1.026  -7.263  10.699
  238   2HB   LEU  31          2HB       LEU  31   0.488  -7.658  12.320
  239    HG   LEU  31           HG       LEU  31   0.252  -5.014  12.516
  240   1HD1  LEU  31          1HD1      LEU  31   0.802  -5.413   9.711
  241   2HD1  LEU  31          2HD1      LEU  31  -0.820  -4.719   9.937
  242   3HD1  LEU  31          3HD1      LEU  31   0.602  -3.902  10.629
  243   1HD2  LEU  31          1HD2      LEU  31  -1.781  -5.825  12.905
  244   2HD2  LEU  31          2HD2      LEU  31  -2.098  -5.642  11.163
  245   3HD2  LEU  31          3HD2      LEU  31  -1.525  -7.201  11.806
  246    H    THR  32           H        THR  32   2.261  -9.000  13.225
  247    HA   THR  32           HA       THR  32   1.799  -8.481  15.898
  248    HB   THR  32           HB       THR  32   1.540 -10.693  14.813
  249    HG1  THR  32           HG1      THR  32   3.742 -10.602  16.754
  250   1HG2  THR  32          1HG2      THR  32   3.653 -12.072  14.477
  251   2HG2  THR  32          2HG2      THR  32   3.474 -10.758  13.292
  252   3HG2  THR  32          3HG2      THR  32   4.597 -10.575  14.661
  253    H    GLU  33           H        GLU  33   4.882  -8.513  14.079
  254    HA   GLU  33           HA       GLU  33   6.503  -8.470  16.337
  255   1HB   GLU  33          1HB       GLU  33   6.848  -8.507  13.544
  256   2HB   GLU  33          2HB       GLU  33   7.608  -7.009  14.041
  257   1HG   GLU  33          1HG       GLU  33   9.115  -8.131  15.537
  258   2HG   GLU  33          2HG       GLU  33   8.168  -9.607  15.519
  259    H    HIS  34           H        HIS  34   5.740  -5.729  14.058
  260    HA   HIS  34           HA       HIS  34   6.804  -3.704  15.451
  261   1HB   HIS  34          1HB       HIS  34   5.852  -3.351  13.296
  262   2HB   HIS  34          2HB       HIS  34   4.251  -3.816  13.839
  263    HD1  HIS  34           HD1      HIS  34   2.779  -1.814  13.959
  264    HD2  HIS  34           HD2      HIS  34   6.706  -0.937  15.141
  265    HE1  HIS  34           HE1      HIS  34   2.794   0.651  14.611
  266    H    ASN  35           H        ASN  35   3.317  -4.697  15.791
  267    HA   ASN  35           HA       ASN  35   2.623  -3.115  17.807
  268   1HB   ASN  35          1HB       ASN  35   1.853  -5.864  16.932
  269   2HB   ASN  35          2HB       ASN  35   1.417  -5.500  18.590
  270   1HD2  ASN  35          1HD2      ASN  35   0.704  -5.062  15.304
  271   2HD2  ASN  35          2HD2      ASN  35  -0.607  -3.939  15.435
  272    H    SER  36           H        SER  36   3.971  -6.490  18.179
  273    HA   SER  36           HA       SER  36   4.142  -6.551  20.873
  274   1HB   SER  36          1HB       SER  36   4.642  -8.422  19.238
  275   2HB   SER  36          2HB       SER  36   6.213  -7.702  18.952
  276    HG   SER  36           HG       SER  36   6.293  -9.399  20.564
  277    H    GLY  37           H        GLY  37   6.754  -5.508  18.558
  278   1HA   GLY  37          1HA       GLY  37   8.209  -3.754  18.822
  279   2HA   GLY  37          2HA       GLY  37   7.672  -3.529  20.475
  280    H    THR  38           H        THR  38  10.375  -4.183  18.820
  281    HA   THR  38           HA       THR  38  11.313  -6.537  20.154
  282    HB   THR  38           HB       THR  38  11.977  -5.551  17.830
  283    HG1  THR  38           HG1      THR  38  14.038  -6.069  19.853
  284   1HG2  THR  38          1HG2      THR  38  13.669  -3.855  19.739
  285   2HG2  THR  38          2HG2      THR  38  14.069  -4.113  18.024
  286   3HG2  THR  38          3HG2      THR  38  12.577  -3.252  18.470
  287    H    GLY  39           H        GLY  39  12.911  -6.711  21.780
  288   1HA   GLY  39          1HA       GLY  39  14.290  -5.863  23.438
  289   2HA   GLY  39          2HA       GLY  39  13.604  -4.265  23.221
  290    H    ALA  40           H        ALA  40  12.776  -3.708  25.210
  291    HA   ALA  40           HA       ALA  40  10.550  -5.281  26.164
  292   1HB   ALA  40          1HB       ALA  40  11.472  -6.063  28.096
  293   2HB   ALA  40          2HB       ALA  40  12.998  -5.929  27.189
  294   3HB   ALA  40          3HB       ALA  40  12.507  -4.630  28.303
  295    H    LYS  41           H        LYS  41   9.073  -3.641  26.022
  296    HA   LYS  41           HA       LYS  41   9.242  -1.522  27.868
  297   1HB   LYS  41          1HB       LYS  41   9.484   0.373  26.421
  298   2HB   LYS  41          2HB       LYS  41  10.870  -0.671  26.194
  299   1HG   LYS  41          1HG       LYS  41  10.367  -1.032  24.002
  300   2HG   LYS  41          2HG       LYS  41   8.695  -1.411  24.368
  301   1HD   LYS  41          1HD       LYS  41   8.149   0.571  23.400
  302   2HD   LYS  41          2HD       LYS  41   8.820   1.352  24.818
  303   1HE   LYS  41          1HE       LYS  41  10.717   2.033  23.711
  304   2HE   LYS  41          2HE       LYS  41  10.870   0.526  22.830
  305   1HZ   LYS  41          1HZ       LYS  41   9.048   2.739  22.203
  306   2HZ   LYS  41          2HZ       LYS  41  10.320   2.227  21.316
  307   3HZ   LYS  41          3HZ       LYS  41   8.991   1.290  21.454
  308    H    TYR  42           H        TYR  42   7.217  -0.398  28.035
  309    HA   TYR  42           HA       TYR  42   5.001  -0.324  27.991
  310   1HB   TYR  42          1HB       TYR  42   5.975  -0.617  25.148
  311   2HB   TYR  42          2HB       TYR  42   4.263  -0.925  25.364
  312    HD1  TYR  42           HD1      TYR  42   6.339   1.490  24.262
  313    HD2  TYR  42           HD2      TYR  42   3.298   1.006  27.233
  314    HE1  TYR  42           HE1      TYR  42   5.876   3.989  24.207
  315    HE2  TYR  42           HE2      TYR  42   2.846   3.506  27.167
  316    HH   TYR  42           HH       TYR  42   4.689   5.647  26.310
  317    H    THR  43           H        THR  43   2.883  -1.578  27.269
  318    HA   THR  43           HA       THR  43   3.314  -4.304  28.099
  319    HB   THR  43           HB       THR  43   0.831  -2.645  27.415
  320    HG1  THR  43           HG1      THR  43   2.288  -2.149  29.321
  321   1HG2  THR  43          1HG2      THR  43   0.914  -5.419  27.549
  322   2HG2  THR  43          2HG2      THR  43   0.656  -4.982  29.256
  323   3HG2  THR  43          3HG2      THR  43  -0.496  -4.436  28.012
  324    H    ARG  44           H        ARG  44   4.278  -5.569  26.577
  325    HA   ARG  44           HA       ARG  44   4.137  -5.367  23.935
  326   1HB   ARG  44          1HB       ARG  44   4.129  -7.907  25.635
  327   2HB   ARG  44          2HB       ARG  44   4.425  -7.929  23.906
  328   1HG   ARG  44          1HG       ARG  44   6.609  -7.507  24.344
  329   2HG   ARG  44          2HG       ARG  44   6.141  -5.903  24.873
  330   1HD   ARG  44          1HD       ARG  44   6.627  -6.408  27.035
  331   2HD   ARG  44          2HD       ARG  44   5.566  -7.801  27.000
  332    HE   ARG  44           HE       ARG  44   7.836  -8.621  25.589
  333   1HH1  ARG  44          1HH1      ARG  44   7.201  -7.376  28.818
  334   2HH1  ARG  44          2HH1      ARG  44   8.533  -8.213  29.542
  335   1HH2  ARG  44          1HH2      ARG  44   9.593  -9.726  26.543
  336   2HH2  ARG  44          2HH2      ARG  44   9.903  -9.560  28.239
  337    H    LEU  45           H        LEU  45   1.879  -7.362  25.983
  338    HA   LEU  45           HA       LEU  45   0.265  -8.391  24.087
  339   1HB   LEU  45          1HB       LEU  45   0.257  -8.446  26.713
  340   2HB   LEU  45          2HB       LEU  45  -0.960  -7.197  26.542
  341    HG   LEU  45           HG       LEU  45  -1.969  -9.399  26.813
  342   1HD1  LEU  45          1HD1      LEU  45  -2.843  -7.505  25.189
  343   2HD1  LEU  45          2HD1      LEU  45  -2.560  -8.756  23.955
  344   3HD1  LEU  45          3HD1      LEU  45  -3.664  -9.079  25.313
  345   1HD2  LEU  45          1HD2      LEU  45   0.105 -10.383  25.359
  346   2HD2  LEU  45          2HD2      LEU  45  -1.407 -11.264  25.690
  347   3HD2  LEU  45          3HD2      LEU  45  -1.199 -10.403  24.147
  348    H    ALA  46           H        ALA  46  -0.403  -5.214  25.736
  349    HA   ALA  46           HA       ALA  46  -2.491  -4.380  24.269
  350   1HB   ALA  46          1HB       ALA  46  -0.271  -2.424  24.789
  351   2HB   ALA  46          2HB       ALA  46  -2.016  -2.274  25.104
  352   3HB   ALA  46          3HB       ALA  46  -1.001  -3.274  26.171
  353    H    LYS  47           H        LYS  47  -2.927  -4.028  22.149
  354    HA   LYS  47           HA       LYS  47  -0.638  -3.953  20.339
  355   1HB   LYS  47          1HB       LYS  47  -3.523  -4.749  20.074
  356   2HB   LYS  47          2HB       LYS  47  -2.633  -4.253  18.649
  357   1HG   LYS  47          1HG       LYS  47  -1.314  -6.137  18.647
  358   2HG   LYS  47          2HG       LYS  47  -1.148  -6.151  20.391
  359   1HD   LYS  47          1HD       LYS  47  -2.655  -7.843  20.468
  360   2HD   LYS  47          2HD       LYS  47  -3.886  -6.719  19.931
  361   1HE   LYS  47          1HE       LYS  47  -3.093  -7.198  17.519
  362   2HE   LYS  47          2HE       LYS  47  -2.139  -8.509  18.186
  363   1HZ   LYS  47          1HZ       LYS  47  -4.337  -9.200  17.446
  364   2HZ   LYS  47          2HZ       LYS  47  -4.125  -9.488  19.039
  365   3HZ   LYS  47          3HZ       LYS  47  -5.042  -8.227  18.554
  366    H    ARG  48           H        ARG  48  -3.850  -2.310  20.801
  367    HA   ARG  48           HA       ARG  48  -4.493  -0.280  20.441
  368   1HB   ARG  48          1HB       ARG  48  -1.624   0.097  21.179
  369   2HB   ARG  48          2HB       ARG  48  -2.341   1.461  20.343
  370   1HG   ARG  48          1HG       ARG  48  -3.687   2.007  22.115
  371   2HG   ARG  48          2HG       ARG  48  -4.101   0.335  22.445
  372   1HD   ARG  48          1HD       ARG  48  -1.693   0.087  23.394
  373   2HD   ARG  48          2HD       ARG  48  -1.601   1.836  23.331
  374    HE   ARG  48           HE       ARG  48  -4.011   0.854  24.681
  375   1HH1  ARG  48          1HH1      ARG  48  -0.627   1.727  25.091
  376   2HH1  ARG  48          2HH1      ARG  48  -0.780   2.038  26.788
  377   1HH2  ARG  48          1HH2      ARG  48  -4.214   1.262  26.920
  378   2HH2  ARG  48          2HH2      ARG  48  -2.834   1.771  27.836
  379    H    ARG  49           H        ARG  49  -4.629   1.475  18.759
  380    HA   ARG  49           HA       ARG  49  -4.643   2.168  16.714
  381   1HB   ARG  49          1HB       ARG  49  -1.825   0.987  16.675
  382   2HB   ARG  49          2HB       ARG  49  -2.477   1.891  15.324
  383   1HG   ARG  49          1HG       ARG  49  -2.279   3.908  16.404
  384   2HG   ARG  49          2HG       ARG  49  -2.835   3.260  17.933
  385   1HD   ARG  49          1HD       ARG  49  -0.450   2.011  17.882
  386   2HD   ARG  49          2HD       ARG  49  -0.033   3.333  16.810
  387    HE   ARG  49           HE       ARG  49  -1.314   4.547  18.991
  388   1HH1  ARG  49          1HH1      ARG  49   1.523   2.520  18.521
  389   2HH1  ARG  49          2HH1      ARG  49   2.377   3.177  19.878
  390   1HH2  ARG  49          1HH2      ARG  49  -0.189   5.415  20.781
  391   2HH2  ARG  49          2HH2      ARG  49   1.394   4.835  21.172
  392    HA   PRO  50           HA       PRO  50  -5.793  -1.882  15.071
  393   1HB   PRO  50          1HB       PRO  50  -8.389  -1.275  14.473
  394   2HB   PRO  50          2HB       PRO  50  -7.897  -1.981  15.999
  395   1HG   PRO  50          1HG       PRO  50  -8.699   0.804  15.419
  396   2HG   PRO  50          2HG       PRO  50  -8.618  -0.016  16.966
  397   1HD   PRO  50          1HD       PRO  50  -6.736   1.885  15.931
  398   2HD   PRO  50          2HD       PRO  50  -6.598   0.979  17.426
  399    H    VAL  51           H        VAL  51  -4.442  -1.901  13.320
  400    HA   VAL  51           HA       VAL  51  -4.959  -0.025  11.225
  401    HB   VAL  51           HB       VAL  51  -3.095  -1.033  10.147
  402   1HG1  VAL  51          1HG1      VAL  51  -2.723   0.354  12.244
  403   2HG1  VAL  51          2HG1      VAL  51  -2.448  -1.180  13.103
  404   3HG1  VAL  51          3HG1      VAL  51  -1.380  -0.708  11.762
  405   1HG2  VAL  51          1HG2      VAL  51  -3.053  -3.284  10.141
  406   2HG2  VAL  51          2HG2      VAL  51  -2.126  -3.116  11.650
  407   3HG2  VAL  51          3HG2      VAL  51  -3.881  -3.403  11.713
  408    H    ILE  52           H        ILE  52  -6.050  -0.340   9.296
  409    HA   ILE  52           HA       ILE  52  -7.283  -2.989   8.979
  410    HB   ILE  52           HB       ILE  52  -9.319  -2.018   8.333
  411   1HG1  ILE  52          1HG1      ILE  52  -8.059   0.736   8.487
  412   2HG1  ILE  52          2HG1      ILE  52  -8.298  -0.157   6.996
  413   1HG2  ILE  52          1HG2      ILE  52  -8.243  -0.553  10.756
  414   2HG2  ILE  52          2HG2      ILE  52  -9.962  -0.668  10.310
  415   3HG2  ILE  52          3HG2      ILE  52  -9.048  -2.139  10.727
  416   1HD1  ILE  52          1HD1      ILE  52 -10.353   1.074   8.826
  417   2HD1  ILE  52          2HD1      ILE  52 -10.258   1.104   7.049
  418   3HD1  ILE  52          3HD1      ILE  52 -10.807  -0.367   7.887
  419    H    MET  53           H        MET  53  -7.633  -3.681   6.772
  420    HA   MET  53           HA       MET  53  -5.597  -2.580   5.062
  421   1HB   MET  53          1HB       MET  53  -6.783  -5.153   5.540
  422   2HB   MET  53          2HB       MET  53  -7.201  -4.736   3.889
  423   1HG   MET  53          1HG       MET  53  -5.074  -5.120   3.176
  424   2HG   MET  53          2HG       MET  53  -4.409  -4.049   4.394
  425   1HE   MET  53          1HE       MET  53  -3.646  -5.887   7.349
  426   2HE   MET  53          2HE       MET  53  -2.399  -5.663   6.098
  427   3HE   MET  53          3HE       MET  53  -3.649  -4.420   6.342
  428    H    ILE  54           H        ILE  54  -5.952  -1.516   3.097
  429    HA   ILE  54           HA       ILE  54  -8.707  -1.324   2.170
  430    HB   ILE  54           HB       ILE  54  -8.150   1.206   1.835
  431   1HG1  ILE  54          1HG1      ILE  54  -6.844   1.268   4.432
  432   2HG1  ILE  54          2HG1      ILE  54  -5.860   0.425   3.253
  433   1HG2  ILE  54          1HG2      ILE  54  -9.936   1.270   3.146
  434   2HG2  ILE  54          2HG2      ILE  54  -9.534  -0.321   3.838
  435   3HG2  ILE  54          3HG2      ILE  54  -8.865   1.159   4.565
  436   1HD1  ILE  54          1HD1      ILE  54  -6.704   3.293   3.322
  437   2HD1  ILE  54          2HD1      ILE  54  -5.189   2.567   2.737
  438   3HD1  ILE  54          3HD1      ILE  54  -6.647   2.527   1.716
  439    H    HIS  55           H        HIS  55  -5.218  -0.510   1.671
  440    HA   HIS  55           HA       HIS  55  -5.706  -0.857  -1.195
  441   1HB   HIS  55          1HB       HIS  55  -3.543   0.650   0.296
  442   2HB   HIS  55          2HB       HIS  55  -3.506   0.358  -1.431
  443    HD1  HIS  55           HD1      HIS  55  -6.103   1.132  -2.539
  444    HD2  HIS  55           HD2      HIS  55  -4.501   3.146   0.773
  445    HE1  HIS  55           HE1      HIS  55  -7.257   3.407  -2.458
  446    H    THR  56           H        THR  56  -4.121  -2.104  -2.440
  447    HA   THR  56           HA       THR  56  -2.185  -3.666  -1.011
  448    HB   THR  56           HB       THR  56  -3.391  -5.848  -1.782
  449    HG1  THR  56           HG1      THR  56  -5.500  -3.803  -1.754
  450   1HG2  THR  56          1HG2      THR  56  -5.118  -4.367   0.221
  451   2HG2  THR  56          2HG2      THR  56  -4.554  -6.054   0.261
  452   3HG2  THR  56          3HG2      THR  56  -3.429  -4.731   0.651
  453    H    GLU  57           H        GLU  57  -0.507  -3.306  -2.332
  454    HA   GLU  57           HA       GLU  57  -1.053  -3.697  -5.174
  455   1HB   GLU  57          1HB       GLU  57  -0.228  -1.358  -4.111
  456   2HB   GLU  57          2HB       GLU  57   1.342  -2.118  -4.275
  457   1HG   GLU  57          1HG       GLU  57   1.275  -1.336  -6.422
  458   2HG   GLU  57          2HG       GLU  57   0.239  -2.714  -6.729
  459    H    LYS  58           H        LYS  58   0.345  -5.059  -6.356
  460    HA   LYS  58           HA       LYS  58   2.520  -6.275  -4.813
  461   1HB   LYS  58          1HB       LYS  58   0.700  -7.832  -4.642
  462   2HB   LYS  58          2HB       LYS  58   0.346  -7.712  -6.354
  463   1HG   LYS  58          1HG       LYS  58   2.957  -8.449  -6.527
  464   2HG   LYS  58          2HG       LYS  58   2.582  -9.166  -4.972
  465   1HD   LYS  58          1HD       LYS  58   1.367 -10.833  -5.930
  466   2HD   LYS  58          2HD       LYS  58   0.433  -9.700  -6.886
  467   1HE   LYS  58          1HE       LYS  58   2.585  -9.524  -8.387
  468   2HE   LYS  58          2HE       LYS  58   3.095 -10.993  -7.581
  469   1HZ   LYS  58          1HZ       LYS  58   1.612 -12.167  -8.706
  470   2HZ   LYS  58          2HZ       LYS  58   0.400 -11.095  -8.490
  471   3HZ   LYS  58          3HZ       LYS  58   1.470 -10.883  -9.706
  472    H    PHE  59           H        PHE  59   4.415  -5.991  -5.848
  473    HA   PHE  59           HA       PHE  59   4.420  -6.184  -8.745
  474   1HB   PHE  59          1HB       PHE  59   5.977  -4.042  -8.586
  475   2HB   PHE  59          2HB       PHE  59   4.242  -3.801  -8.521
  476    HD1  PHE  59           HD1      PHE  59   7.335  -3.841  -6.545
  477    HD2  PHE  59           HD2      PHE  59   3.164  -3.059  -6.499
  478    HE1  PHE  59           HE1      PHE  59   7.579  -2.665  -4.341
  479    HE2  PHE  59           HE2      PHE  59   3.409  -1.883  -4.295
  480    HZ   PHE  59           HZ       PHE  59   5.613  -1.700  -3.243
  481    H    GLU  60           H        GLU  60   6.009  -7.600  -9.274
  482    HA   GLU  60           HA       GLU  60   8.051  -8.090  -7.310
  483   1HB   GLU  60          1HB       GLU  60   8.619 -10.037  -8.708
  484   2HB   GLU  60          2HB       GLU  60   6.897  -9.998  -8.382
  485   1HG   GLU  60          1HG       GLU  60   6.989  -8.527 -10.706
  486   2HG   GLU  60          2HG       GLU  60   8.351  -9.601 -10.963
  487    H    THR  61           H        THR  61   7.570  -6.357 -10.317
  488    HA   THR  61           HA       THR  61  10.461  -6.159 -10.749
  489    HB   THR  61           HB       THR  61   9.571  -5.006 -12.902
  490    HG1  THR  61           HG1      THR  61   7.211  -5.761 -13.137
  491   1HG2  THR  61          1HG2      THR  61  10.126  -7.580 -12.614
  492   2HG2  THR  61          2HG2      THR  61   8.357  -7.775 -12.582
  493   3HG2  THR  61          3HG2      THR  61   9.148  -7.067 -14.010
  494    H    ARG  62           H        ARG  62  11.612  -4.255 -10.619
  495    HA   ARG  62           HA       ARG  62  10.625  -2.425  -8.781
  496   1HB   ARG  62          1HB       ARG  62  13.109  -2.970 -10.149
  497   2HB   ARG  62          2HB       ARG  62  12.780  -1.258 -10.328
  498   1HG   ARG  62          1HG       ARG  62  12.335  -1.189  -7.797
  499   2HG   ARG  62          2HG       ARG  62  12.944  -2.830  -7.718
  500   1HD   ARG  62          1HD       ARG  62  14.616  -0.703  -9.086
  501   2HD   ARG  62          2HD       ARG  62  14.588  -0.772  -7.334
  502    HE   ARG  62           HE       ARG  62  15.741  -2.837  -7.392
  503   1HH1  ARG  62          1HH1      ARG  62  14.758  -1.883 -10.633
  504   2HH1  ARG  62          2HH1      ARG  62  15.736  -3.076 -11.421
  505   1HH2  ARG  62          1HH2      ARG  62  17.034  -4.411  -8.429
  506   2HH2  ARG  62          2HH2      ARG  62  17.039  -4.525 -10.158
  507    H    SER  63           H        SER  63  10.851  -2.468 -12.366
  508    HA   SER  63           HA       SER  63  10.431   0.134 -12.936
  509   1HB   SER  63          1HB       SER  63   9.947  -2.453 -14.267
  510   2HB   SER  63          2HB       SER  63   8.846  -1.207 -14.818
  511    HG   SER  63           HG       SER  63  11.379  -1.564 -15.576
  512    H    GLU  64           H        GLU  64   7.998  -2.391 -12.058
  513    HA   GLU  64           HA       GLU  64   5.854  -0.544 -12.349
  514   1HB   GLU  64          1HB       GLU  64   6.194  -3.426 -11.824
  515   2HB   GLU  64          2HB       GLU  64   4.881  -2.726 -10.898
  516   1HG   GLU  64          1HG       GLU  64   3.726  -3.189 -12.853
  517   2HG   GLU  64          2HG       GLU  64   4.278  -1.574 -13.245
  518    H    ALA  65           H        ALA  65   8.005  -1.699  -9.779
  519    HA   ALA  65           HA       ALA  65   6.400  -0.909  -7.602
  520   1HB   ALA  65          1HB       ALA  65   9.431  -1.036  -7.662
  521   2HB   ALA  65          2HB       ALA  65   8.334  -1.374  -6.301
  522   3HB   ALA  65          3HB       ALA  65   8.421  -2.501  -7.675
  523    H    THR  66           H        THR  66   9.226   0.667  -9.262
  524    HA   THR  66           HA       THR  66   9.101   3.032  -7.772
  525    HB   THR  66           HB       THR  66  11.002   2.115  -9.237
  526    HG1  THR  66           HG1      THR  66   9.842   4.786  -9.595
  527   1HG2  THR  66          1HG2      THR  66  10.968   2.389 -11.567
  528   2HG2  THR  66          2HG2      THR  66   9.260   1.970 -11.291
  529   3HG2  THR  66          3HG2      THR  66   9.737   3.673 -11.495
  530    H    LYS  67           H        LYS  67   7.390   1.988 -10.742
  531    HA   LYS  67           HA       LYS  67   6.378   4.490 -11.424
  532   1HB   LYS  67          1HB       LYS  67   6.038   1.729 -12.216
  533   2HB   LYS  67          2HB       LYS  67   4.480   2.529 -12.153
  534   1HG   LYS  67          1HG       LYS  67   4.988   3.975 -13.880
  535   2HG   LYS  67          2HG       LYS  67   6.665   4.140 -13.395
  536   1HD   LYS  67          1HD       LYS  67   7.306   2.601 -14.929
  537   2HD   LYS  67          2HD       LYS  67   6.240   1.402 -14.223
  538   1HE   LYS  67          1HE       LYS  67   4.408   2.968 -15.559
  539   2HE   LYS  67          2HE       LYS  67   5.805   3.162 -16.598
  540   1HZ   LYS  67          1HZ       LYS  67   5.512   0.475 -15.828
  541   2HZ   LYS  67          2HZ       LYS  67   4.130   1.017 -16.507
  542   3HZ   LYS  67          3HZ       LYS  67   5.538   1.116 -17.329
  543    H    ALA  68           H        ALA  68   4.910   1.829  -9.434
  544    HA   ALA  68           HA       ALA  68   2.554   3.043  -8.806
  545   1HB   ALA  68          1HB       ALA  68   3.988   1.607  -6.613
  546   2HB   ALA  68          2HB       ALA  68   2.354   1.350  -7.273
  547   3HB   ALA  68          3HB       ALA  68   3.774   0.728  -8.147
  548    H    GLU  69           H        GLU  69   5.803   3.526  -7.315
  549    HA   GLU  69           HA       GLU  69   4.845   5.220  -5.305
  550   1HB   GLU  69          1HB       GLU  69   7.010   4.026  -5.165
  551   2HB   GLU  69          2HB       GLU  69   7.634   4.954  -6.514
  552   1HG   GLU  69          1HG       GLU  69   6.599   6.300  -3.985
  553   2HG   GLU  69          2HG       GLU  69   8.260   5.761  -4.129
  554    H    ALA  70           H        ALA  70   6.575   5.882  -8.437
  555    HA   ALA  70           HA       ALA  70   6.670   8.588  -8.344
  556   1HB   ALA  70          1HB       ALA  70   7.667   7.276 -10.129
  557   2HB   ALA  70          2HB       ALA  70   6.064   6.746 -10.691
  558   3HB   ALA  70          3HB       ALA  70   6.542   8.452 -10.850
  559    H    ALA  71           H        ALA  71   3.892   6.547  -9.477
  560    HA   ALA  71           HA       ALA  71   2.217   8.680 -10.107
  561   1HB   ALA  71          1HB       ALA  71   0.471   7.001 -10.126
  562   2HB   ALA  71          2HB       ALA  71   1.959   6.260 -10.759
  563   3HB   ALA  71          3HB       ALA  71   1.435   5.919  -9.094
  564    H    PHE  72           H        PHE  72   2.685   6.807  -7.047
  565    HA   PHE  72           HA       PHE  72   0.656   7.979  -5.596
  566   1HB   PHE  72          1HB       PHE  72   2.883   6.226  -5.270
  567   2HB   PHE  72          2HB       PHE  72   3.201   7.520  -4.132
  568    HD1  PHE  72           HD1      PHE  72   0.401   5.280  -5.180
  569    HD2  PHE  72           HD2      PHE  72   2.318   7.345  -2.008
  570    HE1  PHE  72           HE1      PHE  72  -1.179   4.226  -3.540
  571    HE2  PHE  72           HE2      PHE  72   0.738   6.292  -0.366
  572    HZ   PHE  72           HZ       PHE  72  -0.992   4.745  -1.153
  573    H    LYS  73           H        LYS  73   3.559   9.405  -6.848
  574    HA   LYS  73           HA       LYS  73   3.757  11.401  -4.785
  575   1HB   LYS  73          1HB       LYS  73   5.673  10.377  -6.172
  576   2HB   LYS  73          2HB       LYS  73   5.143  11.431  -7.468
  577   1HG   LYS  73          1HG       LYS  73   5.430  13.418  -6.021
  578   2HG   LYS  73          2HG       LYS  73   5.852  12.399  -4.659
  579   1HD   LYS  73          1HD       LYS  73   7.713  11.472  -6.366
  580   2HD   LYS  73          2HD       LYS  73   7.465  13.028  -7.133
  581   1HE   LYS  73          1HE       LYS  73   7.766  13.112  -4.159
  582   2HE   LYS  73          2HE       LYS  73   9.196  12.607  -5.040
  583   1HZ   LYS  73          1HZ       LYS  73   8.178  14.747  -6.411
  584   2HZ   LYS  73          2HZ       LYS  73   8.086  15.171  -4.836
  585   3HZ   LYS  73          3HZ       LYS  73   9.519  14.725  -5.480
  586    H    LYS  74           H        LYS  74   2.289  10.985  -8.009
  587    HA   LYS  74           HA       LYS  74   1.500  13.790  -8.003
  588   1HB   LYS  74          1HB       LYS  74   0.796  13.374 -10.305
  589   2HB   LYS  74          2HB       LYS  74   2.466  12.909 -10.059
  590   1HG   LYS  74          1HG       LYS  74   2.035  10.655 -10.346
  591   2HG   LYS  74          2HG       LYS  74   0.465  10.743  -9.572
  592   1HD   LYS  74          1HD       LYS  74  -0.508  11.806 -11.589
  593   2HD   LYS  74          2HD       LYS  74   1.065  11.835 -12.362
  594   1HE   LYS  74          1HE       LYS  74   1.144   9.306 -12.194
  595   2HE   LYS  74          2HE       LYS  74  -0.481   9.329 -11.535
  596   1HZ   LYS  74          1HZ       LYS  74  -0.770   9.031 -13.785
  597   2HZ   LYS  74          2HZ       LYS  74  -1.038  10.633 -13.620
  598   3HZ   LYS  74          3HZ       LYS  74   0.387  10.101 -14.215
  599    H    LEU  75           H        LEU  75   0.502  11.707  -6.041
  600    HA   LEU  75           HA       LEU  75  -2.331  12.137  -6.626
  601   1HB   LEU  75          1HB       LEU  75  -1.137   9.542  -5.639
  602   2HB   LEU  75          2HB       LEU  75  -2.847   9.893  -5.789
  603    HG   LEU  75           HG       LEU  75  -0.979   9.982  -8.163
  604   1HD1  LEU  75          1HD1      LEU  75  -2.347   7.613  -6.905
  605   2HD1  LEU  75          2HD1      LEU  75  -2.007   7.667  -8.651
  606   3HD1  LEU  75          3HD1      LEU  75  -0.671   7.778  -7.480
  607   1HD2  LEU  75          1HD2      LEU  75  -3.307  11.075  -8.167
  608   2HD2  LEU  75          2HD2      LEU  75  -2.893   9.969  -9.499
  609   3HD2  LEU  75          3HD2      LEU  75  -3.937   9.411  -8.170
  610    H    THR  76           H        THR  76  -3.660  11.732  -4.518
  611    HA   THR  76           HA       THR  76  -2.064  12.492  -2.174
  612    HB   THR  76           HB       THR  76  -2.876  14.615  -2.972
  613    HG1  THR  76           HG1      THR  76  -4.569  14.961  -1.301
  614   1HG2  THR  76          1HG2      THR  76  -4.580  13.670  -4.619
  615   2HG2  THR  76          2HG2      THR  76  -5.645  13.332  -3.232
  616   3HG2  THR  76          3HG2      THR  76  -5.206  15.010  -3.631
  617    H    ARG  77           H        ARG  77  -3.739  12.543  -0.180
  618    HA   ARG  77           HA       ARG  77  -4.299   9.970   0.335
  619   1HB   ARG  77          1HB       ARG  77  -5.862  10.865   2.130
  620   2HB   ARG  77          2HB       ARG  77  -4.289  11.639   2.109
  621   1HG   ARG  77          1HG       ARG  77  -5.235  13.531   0.775
  622   2HG   ARG  77          2HG       ARG  77  -6.807  12.756   0.782
  623   1HD   ARG  77          1HD       ARG  77  -6.436  12.758   3.440
  624   2HD   ARG  77          2HD       ARG  77  -5.324  14.062   3.071
  625    HE   ARG  77           HE       ARG  77  -7.540  14.822   1.653
  626   1HH1  ARG  77          1HH1      ARG  77  -7.137  13.751   4.982
  627   2HH1  ARG  77          2HH1      ARG  77  -8.478  14.675   5.576
  628   1HH2  ARG  77          1HH2      ARG  77  -9.307  16.041   2.438
  629   2HH2  ARG  77          2HH2      ARG  77  -9.719  15.986   4.118
  630    H    LYS  78           H        LYS  78  -6.030  12.135  -1.765
  631    HA   LYS  78           HA       LYS  78  -8.462  10.532  -1.623
  632   1HB   LYS  78          1HB       LYS  78  -7.964  13.275  -1.974
  633   2HB   LYS  78          2HB       LYS  78  -8.493  12.709  -3.546
  634   1HG   LYS  78          1HG       LYS  78 -10.432  11.520  -2.331
  635   2HG   LYS  78          2HG       LYS  78  -9.957  12.395  -0.888
  636   1HD   LYS  78          1HD       LYS  78 -10.526  14.503  -1.812
  637   2HD   LYS  78          2HD       LYS  78 -10.409  13.927  -3.463
  638   1HE   LYS  78          1HE       LYS  78 -12.570  13.157  -3.483
  639   2HE   LYS  78          2HE       LYS  78 -12.449  12.479  -1.871
  640   1HZ   LYS  78          1HZ       LYS  78 -13.966  14.314  -1.917
  641   2HZ   LYS  78          2HZ       LYS  78 -12.679  14.713  -0.991
  642   3HZ   LYS  78          3HZ       LYS  78 -12.822  15.327  -2.497
  643    H    GLN  79           H        GLN  79  -6.591  12.030  -4.352
  644    HA   GLN  79           HA       GLN  79  -7.398  10.485  -6.325
  645   1HB   GLN  79          1HB       GLN  79  -5.083  12.102  -5.785
  646   2HB   GLN  79          2HB       GLN  79  -4.531  10.657  -6.610
  647   1HG   GLN  79          1HG       GLN  79  -5.159  11.718  -8.529
  648   2HG   GLN  79          2HG       GLN  79  -6.796  11.284  -8.078
  649   1HE2  GLN  79          1HE2      GLN  79  -4.294  13.747  -7.552
  650   2HE2  GLN  79          2HE2      GLN  79  -5.348  15.118  -7.442
  651    H    LYS  80           H        LYS  80  -5.070   9.529  -3.769
  652    HA   LYS  80           HA       LYS  80  -4.256   7.127  -4.959
  653   1HB   LYS  80          1HB       LYS  80  -4.173   8.310  -2.207
  654   2HB   LYS  80          2HB       LYS  80  -3.827   6.603  -2.394
  655   1HG   LYS  80          1HG       LYS  80  -1.853   6.978  -3.531
  656   2HG   LYS  80          2HG       LYS  80  -2.476   8.380  -4.375
  657   1HD   LYS  80          1HD       LYS  80  -2.276   9.737  -2.288
  658   2HD   LYS  80          2HD       LYS  80  -1.677   8.333  -1.426
  659   1HE   LYS  80          1HE       LYS  80   0.071   8.333  -3.524
  660   2HE   LYS  80          2HE       LYS  80  -0.292  10.047  -3.463
  661   1HZ   LYS  80          1HZ       LYS  80   0.427  10.150  -1.254
  662   2HZ   LYS  80          2HZ       LYS  80   0.468   8.528  -1.073
  663   3HZ   LYS  80          3HZ       LYS  80   1.565   9.270  -2.027
  664    H    GLU  81           H        GLU  81  -6.799   7.834  -2.464
  665    HA   GLU  81           HA       GLU  81  -7.676   5.320  -2.076
  666   1HB   GLU  81          1HB       GLU  81  -8.462   7.465  -0.953
  667   2HB   GLU  81          2HB       GLU  81  -9.497   7.749  -2.338
  668   1HG   GLU  81          1HG       GLU  81 -11.072   6.459  -1.338
  669   2HG   GLU  81          2HG       GLU  81 -10.037   5.073  -1.620
  670    H    GLN  82           H        GLN  82  -8.769   7.617  -4.666
  671    HA   GLN  82           HA       GLN  82 -10.515   5.729  -5.795
  672   1HB   GLN  82          1HB       GLN  82  -9.843   8.491  -6.164
  673   2HB   GLN  82          2HB       GLN  82  -9.674   7.712  -7.726
  674   1HG   GLN  82          1HG       GLN  82 -11.931   7.891  -7.925
  675   2HG   GLN  82          2HG       GLN  82 -12.045   6.598  -6.746
  676   1HE2  GLN  82          1HE2      GLN  82 -11.798   7.314  -4.418
  677   2HE2  GLN  82          2HE2      GLN  82 -12.661   8.734  -3.926
  678    H    TYR  83           H        TYR  83  -7.197   6.915  -6.648
  679    HA   TYR  83           HA       TYR  83  -6.726   5.667  -8.974
  680   1HB   TYR  83          1HB       TYR  83  -5.010   6.981  -7.862
  681   2HB   TYR  83          2HB       TYR  83  -5.159   6.062  -6.377
  682    HD1  TYR  83           HD1      TYR  83  -4.825   4.539  -9.747
  683    HD2  TYR  83           HD2      TYR  83  -2.850   5.523  -6.082
  684    HE1  TYR  83           HE1      TYR  83  -2.837   3.107 -10.426
  685    HE2  TYR  83           HE2      TYR  83  -0.869   4.088  -6.772
  686    HH   TYR  83           HH       TYR  83  -0.233   2.458  -8.178
  687    H    LEU  84           H        LEU  84  -6.399   4.122  -5.700
  688    HA   LEU  84           HA       LEU  84  -5.815   1.584  -6.872
  689   1HB   LEU  84          1HB       LEU  84  -6.453   2.444  -4.047
  690   2HB   LEU  84          2HB       LEU  84  -6.013   0.809  -4.505
  691    HG   LEU  84           HG       LEU  84  -3.919   2.154  -5.574
  692   1HD1  LEU  84          1HD1      LEU  84  -3.268   3.741  -3.588
  693   2HD1  LEU  84          2HD1      LEU  84  -4.265   4.332  -4.938
  694   3HD1  LEU  84          3HD1      LEU  84  -5.030   3.882  -3.396
  695   1HD2  LEU  84          1HD2      LEU  84  -2.942   0.656  -4.265
  696   2HD2  LEU  84          2HD2      LEU  84  -3.212   1.722  -2.864
  697   3HD2  LEU  84          3HD2      LEU  84  -4.426   0.493  -3.295
  698    H    LYS  85           H        LYS  85  -8.692   3.404  -5.965
  699    HA   LYS  85           HA       LYS  85 -10.451   1.294  -5.552
  700   1HB   LYS  85          1HB       LYS  85 -10.815   3.744  -5.079
  701   2HB   LYS  85          2HB       LYS  85 -11.093   3.984  -6.793
  702   1HG   LYS  85          1HG       LYS  85 -13.023   2.516  -6.781
  703   2HG   LYS  85          2HG       LYS  85 -12.647   1.917  -5.178
  704   1HD   LYS  85          1HD       LYS  85 -13.223   4.014  -4.139
  705   2HD   LYS  85          2HD       LYS  85 -13.212   4.866  -5.670
  706   1HE   LYS  85          1HE       LYS  85 -15.358   4.251  -6.166
  707   2HE   LYS  85          2HE       LYS  85 -15.093   2.589  -5.678
  708   1HZ   LYS  85          1HZ       LYS  85 -15.884   4.855  -4.032
  709   2HZ   LYS  85          2HZ       LYS  85 -16.530   3.357  -4.102
  710   3HZ   LYS  85          3HZ       LYS  85 -15.109   3.599  -3.334
  711    H    THR  86           H        THR  86  -9.807   3.174  -8.601
  712    HA   THR  86           HA       THR  86 -11.409   1.757 -10.293
  713    HB   THR  86           HB       THR  86  -9.654   3.821 -10.514
  714    HG1  THR  86           HG1      THR  86 -10.118   3.464 -12.844
  715   1HG2  THR  86          1HG2      THR  86  -8.337   1.419 -11.888
  716   2HG2  THR  86          2HG2      THR  86  -7.918   3.122 -12.195
  717   3HG2  THR  86          3HG2      THR  86  -7.612   2.404 -10.595
  718    H    PHE  87           H        PHE  87  -8.281   0.767  -8.897
  719    HA   PHE  87           HA       PHE  87  -8.099  -1.503 -10.637
  720   1HB   PHE  87          1HB       PHE  87  -6.064  -0.444  -9.773
  721   2HB   PHE  87          2HB       PHE  87  -6.691  -0.427  -8.136
  722    HD1  PHE  87           HD1      PHE  87  -6.906  -2.610  -6.892
  723    HD2  PHE  87           HD2      PHE  87  -4.836  -2.295 -10.584
  724    HE1  PHE  87           HE1      PHE  87  -5.730  -4.776  -6.419
  725    HE2  PHE  87           HE2      PHE  87  -3.660  -4.460 -10.109
  726    HZ   PHE  87           HZ       PHE  87  -4.121  -5.676  -8.033
  727    H    HIS  88           H        HIS  88  -9.202  -0.780  -7.298
  728    HA   HIS  88           HA       HIS  88  -9.441  -3.496  -6.560
  729   1HB   HIS  88          1HB       HIS  88  -9.647  -0.964  -5.323
  730   2HB   HIS  88          2HB       HIS  88 -11.202  -1.736  -5.090
  731    HD1  HIS  88           HD1      HIS  88 -10.758  -2.068  -2.545
  732    HD2  HIS  88           HD2      HIS  88  -7.997  -4.003  -5.040
  733    HE1  HIS  88           HE1      HIS  88  -9.447  -3.669  -1.053
  734    H    LEU  89           H        LEU  89 -11.174  -1.509  -8.738
  735    HA   LEU  89           HA       LEU  89 -13.768  -2.578  -8.251
  736   1HB   LEU  89          1HB       LEU  89 -12.554  -0.553  -9.861
  737   2HB   LEU  89          2HB       LEU  89 -13.512  -1.588 -10.901
  738    HG   LEU  89           HG       LEU  89 -15.003   0.078 -10.290
  739   1HD1  LEU  89          1HD1      LEU  89 -16.678  -1.224  -9.624
  740   2HD1  LEU  89          2HD1      LEU  89 -15.468  -2.503  -9.355
  741   3HD1  LEU  89          3HD1      LEU  89 -15.961  -1.446  -8.010
  742   1HD2  LEU  89          1HD2      LEU  89 -13.285   0.661  -8.263
  743   2HD2  LEU  89          2HD2      LEU  89 -14.890   1.400  -8.479
  744   3HD2  LEU  89          3HD2      LEU  89 -14.684   0.032  -7.359
  745    H    GLU  90           H        GLU  90 -11.092  -3.235 -10.592
  746    HA   GLU  90           HA       GLU  90 -12.280  -5.860 -10.933
  747   1HB   GLU  90          1HB       GLU  90 -11.785  -3.812 -13.062
  748   2HB   GLU  90          2HB       GLU  90 -11.344  -5.461 -13.458
  749   1HG   GLU  90          1HG       GLU  90 -13.524  -5.903 -13.886
  750   2HG   GLU  90          2HG       GLU  90 -13.880  -5.658 -12.188
  751    H    HIS  91           H        HIS  91 -10.731  -7.165 -10.038
  752    HA   HIS  91           HA       HIS  91  -8.071  -6.461  -9.785
  753   1HB   HIS  91          1HB       HIS  91  -9.341  -8.191  -8.483
  754   2HB   HIS  91          2HB       HIS  91  -9.223  -9.262  -9.864
  755    HD1  HIS  91           HD1      HIS  91  -7.387 -10.917  -9.592
  756    HD2  HIS  91           HD2      HIS  91  -6.450  -7.237  -7.809
  757    HE1  HIS  91           HE1      HIS  91  -5.067 -11.189  -8.565
  758    H    HIS  92           H        HIS  92  -6.139  -7.258 -10.868
  759    HA   HIS  92           HA       HIS  92  -4.913  -7.606 -12.653
  760   1HB   HIS  92          1HB       HIS  92  -7.177  -9.509 -13.270
  761   2HB   HIS  92          2HB       HIS  92  -5.763  -9.380 -14.295
  762    HD1  HIS  92           HD1      HIS  92  -6.632 -11.926 -12.524
  763    HD2  HIS  92           HD2      HIS  92  -3.624  -9.148 -11.613
  764    HE1  HIS  92           HE1      HIS  92  -5.023 -13.110 -10.938
  765    H    HIS  93           H        HIS  93  -4.865  -7.439 -15.197
  766    HA   HIS  93           HA       HIS  93  -7.046  -5.861 -16.225
  767   1HB   HIS  93          1HB       HIS  93  -6.041  -3.965 -15.485
  768   2HB   HIS  93          2HB       HIS  93  -4.452  -4.697 -15.393
  769    HD1  HIS  93           HD1      HIS  93  -2.863  -3.650 -16.995
  770    HD2  HIS  93           HD2      HIS  93  -6.774  -3.739 -18.507
  771    HE1  HIS  93           HE1      HIS  93  -2.762  -2.559 -19.298
  772    H    HIS  94           H        HIS  94  -3.565  -6.715 -16.862
  773    HA   HIS  94           HA       HIS  94  -4.049  -7.043 -19.623
  774   1HB   HIS  94          1HB       HIS  94  -1.840  -6.711 -18.024
  775   2HB   HIS  94          2HB       HIS  94  -1.700  -8.400 -18.467
  776    HD1  HIS  94           HD1      HIS  94  -1.930  -4.951 -20.072
  777    HD2  HIS  94           HD2      HIS  94  -0.816  -8.875 -21.051
  778    HE1  HIS  94           HE1      HIS  94  -0.853  -4.833 -22.383
  779    H    HIS  95           H        HIS  95  -4.023  -9.028 -20.872
  780    HA   HIS  95           HA       HIS  95  -4.861 -11.329 -19.261
  781   1HB   HIS  95          1HB       HIS  95  -5.939 -10.206 -21.832
  782   2HB   HIS  95          2HB       HIS  95  -6.086 -11.922 -21.505
  783    HD1  HIS  95           HD1      HIS  95  -7.477 -12.589 -19.286
  784    HD2  HIS  95           HD2      HIS  95  -7.770  -8.590 -20.520
  785    HE1  HIS  95           HE1      HIS  95  -9.508 -11.617 -18.085
  786    H    HIS  96           H        HIS  96  -3.639 -10.495 -22.588
  787    HA   HIS  96           HA       HIS  96  -1.385 -12.204 -22.182
  788   1HB   HIS  96          1HB       HIS  96  -3.232 -13.796 -22.764
  789   2HB   HIS  96          2HB       HIS  96  -3.400 -12.982 -24.306
  790    HD1  HIS  96           HD1      HIS  96  -2.138 -14.064 -26.163
  791    HD2  HIS  96           HD2      HIS  96  -0.339 -14.750 -22.436
  792    HE1  HIS  96           HE1      HIS  96  -0.138 -15.585 -26.604
  Start of MODEL    7
    1   1H    MET   1          1H        MET   1  -0.592 -14.101  -1.709
    2    HA   MET   1           HA       MET   1  -2.469 -12.289  -1.548
    3   1HB   MET   1          1HB       MET   1  -2.449 -13.893   1.060
    4   2HB   MET   1          2HB       MET   1  -3.064 -12.254   0.993
    5   1HG   MET   1          1HG       MET   1  -5.066 -13.136   0.368
    6   2HG   MET   1          2HG       MET   1  -4.334 -13.512  -1.181
    7   1HE   MET   1          1HE       MET   1  -5.110 -17.070  -1.320
    8   2HE   MET   1          2HE       MET   1  -5.498 -15.420  -1.864
    9   3HE   MET   1          3HE       MET   1  -3.828 -16.028  -1.985
   10    H    GLU   2           H        GLU   2  -0.172 -13.623   0.942
   11    HA   GLU   2           HA       GLU   2   1.415 -11.230   0.527
   12   1HB   GLU   2          1HB       GLU   2   0.533 -12.310   3.238
   13   2HB   GLU   2          2HB       GLU   2   1.795 -11.110   3.033
   14   1HG   GLU   2          1HG       GLU   2   0.288  -9.434   2.718
   15   2HG   GLU   2          2HG       GLU   2  -0.606 -10.358   1.526
   16    H    ASN   3           H        ASN   3   3.628 -11.569   1.887
   17    HA   ASN   3           HA       ASN   3   5.422 -12.744   2.260
   18   1HB   ASN   3          1HB       ASN   3   3.854 -15.332   1.811
   19   2HB   ASN   3          2HB       ASN   3   5.357 -15.153   2.696
   20   1HD2  ASN   3          1HD2      ASN   3   3.824 -16.361   4.201
   21   2HD2  ASN   3          2HD2      ASN   3   2.950 -15.414   5.358
   22    H    LYS   4           H        LYS   4   6.829 -14.664   1.051
   23    HA   LYS   4           HA       LYS   4   7.747 -15.402  -0.816
   24   1HB   LYS   4          1HB       LYS   4   5.707 -16.583  -1.266
   25   2HB   LYS   4          2HB       LYS   4   4.927 -15.142  -1.883
   26   1HG   LYS   4          1HG       LYS   4   5.585 -16.001  -3.916
   27   2HG   LYS   4          2HG       LYS   4   7.081 -15.168  -3.535
   28   1HD   LYS   4          1HD       LYS   4   8.172 -17.161  -2.841
   29   2HD   LYS   4          2HD       LYS   4   6.664 -18.011  -2.564
   30   1HE   LYS   4          1HE       LYS   4   6.856 -17.139  -5.358
   31   2HE   LYS   4          2HE       LYS   4   8.262 -18.087  -4.911
   32   1HZ   LYS   4          1HZ       LYS   4   6.280 -19.348  -5.699
   33   2HZ   LYS   4          2HZ       LYS   4   6.903 -19.861  -4.280
   34   3HZ   LYS   4          3HZ       LYS   4   5.535 -18.969  -4.296
   35    H    LYS   5           H        LYS   5   8.993 -14.533  -2.499
   36    HA   LYS   5           HA       LYS   5   9.510 -11.912  -2.541
   37   1HB   LYS   5          1HB       LYS   5  10.363 -12.304  -4.903
   38   2HB   LYS   5          2HB       LYS   5  10.988 -13.360  -3.653
   39   1HG   LYS   5          1HG       LYS   5   8.539 -14.500  -4.746
   40   2HG   LYS   5          2HG       LYS   5   9.638 -14.113  -6.056
   41   1HD   LYS   5          1HD       LYS   5  11.341 -15.258  -4.157
   42   2HD   LYS   5          2HD       LYS   5   9.871 -16.192  -3.961
   43   1HE   LYS   5          1HE       LYS   5   9.843 -16.525  -6.498
   44   2HE   LYS   5          2HE       LYS   5  11.418 -15.761  -6.559
   45   1HZ   LYS   5          1HZ       LYS   5  11.486 -18.191  -6.404
   46   2HZ   LYS   5          2HZ       LYS   5  12.294 -17.465  -5.186
   47   3HZ   LYS   5          3HZ       LYS   5  10.823 -18.120  -4.914
   48    H    SER   6           H        SER   6   8.285 -10.136  -2.826
   49    HA   SER   6           HA       SER   6   7.077  -9.383  -5.043
   50   1HB   SER   6          1HB       SER   6   5.439 -11.464  -3.772
   51   2HB   SER   6          2HB       SER   6   4.543  -9.970  -3.960
   52    HG   SER   6           HG       SER   6   5.850 -11.527  -6.012
   53    H    HIS   7           H        HIS   7   6.687  -7.213  -4.697
   54    HA   HIS   7           HA       HIS   7   6.625  -6.320  -1.969
   55   1HB   HIS   7          1HB       HIS   7   6.491  -4.666  -4.499
   56   2HB   HIS   7          2HB       HIS   7   6.914  -4.115  -2.891
   57    HD1  HIS   7           HD1      HIS   7   8.442  -5.124  -5.985
   58    HD2  HIS   7           HD2      HIS   7   9.419  -5.556  -1.929
   59    HE1  HIS   7           HE1      HIS   7  10.939  -5.643  -5.902
   60    H    TYR   8           H        TYR   8   4.664  -6.725  -0.982
   61    HA   TYR   8           HA       TYR   8   2.237  -6.104  -2.464
   62   1HB   TYR   8          1HB       TYR   8   3.086  -7.458   0.146
   63   2HB   TYR   8          2HB       TYR   8   1.406  -7.010  -0.067
   64    HD1  TYR   8           HD1      TYR   8   3.981  -9.415  -0.877
   65    HD2  TYR   8           HD2      TYR   8   0.093  -8.018  -1.988
   66    HE1  TYR   8           HE1      TYR   8   3.555 -11.581  -2.138
   67    HE2  TYR   8           HE2      TYR   8  -0.320 -10.187  -3.246
   68    HH   TYR   8           HH       TYR   8   0.949 -11.927  -4.294
   69    H    PHE   9           H        PHE   9   1.508  -4.035  -2.421
   70    HA   PHE   9           HA       PHE   9   2.264  -2.344  -0.206
   71   1HB   PHE   9          1HB       PHE   9   1.946  -1.997  -2.915
   72   2HB   PHE   9          2HB       PHE   9   0.321  -1.580  -2.406
   73    HD1  PHE   9           HD1      PHE   9   0.421   0.039  -0.169
   74    HD2  PHE   9           HD2      PHE   9   3.319  -0.191  -3.260
   75    HE1  PHE   9           HE1      PHE   9   1.189   2.366   0.378
   76    HE2  PHE   9           HE2      PHE   9   4.086   2.135  -2.714
   77    HZ   PHE   9           HZ       PHE   9   3.013   3.386  -0.901
   78    H    TYR  10           H        TYR  10   1.047  -2.175   1.611
   79    HA   TYR  10           HA       TYR  10  -1.856  -2.523   1.298
   80   1HB   TYR  10          1HB       TYR  10  -1.700  -3.638   3.564
   81   2HB   TYR  10          2HB       TYR  10  -0.734  -4.495   2.381
   82    HD1  TYR  10           HD1      TYR  10   1.783  -4.097   2.330
   83    HD2  TYR  10           HD2      TYR  10  -0.714  -2.721   5.522
   84    HE1  TYR  10           HE1      TYR  10   3.820  -3.860   3.833
   85    HE2  TYR  10           HE2      TYR  10   1.332  -2.491   7.013
   86    HH   TYR  10           HH       TYR  10   3.631  -3.603   7.098
   87    H    VAL  11           H        VAL  11  -3.162  -1.054   2.385
   88    HA   VAL  11           HA       VAL  11  -1.691   1.060   3.798
   89    HB   VAL  11           HB       VAL  11  -4.365   1.197   2.392
   90   1HG1  VAL  11          1HG1      VAL  11  -3.159   2.912   4.293
   91   2HG1  VAL  11          2HG1      VAL  11  -3.002   3.719   2.713
   92   3HG1  VAL  11          3HG1      VAL  11  -4.607   3.219   3.301
   93   1HG2  VAL  11          1HG2      VAL  11  -3.366   1.764   0.450
   94   2HG2  VAL  11          2HG2      VAL  11  -2.065   2.669   1.261
   95   3HG2  VAL  11          3HG2      VAL  11  -1.966   0.896   1.125
   96    H    LEU  12           H        LEU  12  -2.327   1.658   5.870
   97    HA   LEU  12           HA       LEU  12  -4.455  -0.015   7.012
   98   1HB   LEU  12          1HB       LEU  12  -1.897   1.018   8.235
   99   2HB   LEU  12          2HB       LEU  12  -3.206   0.323   9.170
  100    HG   LEU  12           HG       LEU  12  -1.702  -1.132   6.978
  101   1HD1  LEU  12          1HD1      LEU  12  -0.068  -0.971   8.577
  102   2HD1  LEU  12          2HD1      LEU  12  -1.229  -0.900   9.925
  103   3HD1  LEU  12          3HD1      LEU  12  -0.902  -2.450   9.112
  104   1HD2  LEU  12          1HD2      LEU  12  -2.999  -2.869   8.840
  105   2HD2  LEU  12          2HD2      LEU  12  -4.188  -1.687   8.240
  106   3HD2  LEU  12          3HD2      LEU  12  -3.272  -2.691   7.090
  107    H    LEU  13           H        LEU  13  -6.215   1.016   7.813
  108    HA   LEU  13           HA       LEU  13  -5.976   3.929   8.089
  109   1HB   LEU  13          1HB       LEU  13  -7.575   3.898   6.548
  110   2HB   LEU  13          2HB       LEU  13  -7.915   2.195   6.782
  111    HG   LEU  13           HG       LEU  13  -9.266   2.807   8.812
  112   1HD1  LEU  13          1HD1      LEU  13  -8.123   5.039   9.126
  113   2HD1  LEU  13          2HD1      LEU  13  -9.117   5.644   7.779
  114   3HD1  LEU  13          3HD1      LEU  13  -9.899   5.046   9.262
  115   1HD2  LEU  13          1HD2      LEU  13  -9.987   2.684   6.194
  116   2HD2  LEU  13          2HD2      LEU  13 -11.124   2.873   7.549
  117   3HD2  LEU  13          3HD2      LEU  13 -10.585   4.302   6.635
  118    H    CYS  14           H        CYS  14  -6.026   4.703  10.125
  119    HA   CYS  14           HA       CYS  14  -6.976   2.891  12.191
  120   1HB   CYS  14          1HB       CYS  14  -5.472   5.500  12.546
  121   2HB   CYS  14          2HB       CYS  14  -5.766   4.271  13.760
  122    HG   CYS  14           HG       CYS  14  -3.864   4.278  11.080
  123    H    GLN  15           H        GLN  15  -7.531   5.045  14.114
  124    HA   GLN  15           HA       GLN  15 -10.091   5.832  13.020
  125   1HB   GLN  15          1HB       GLN  15  -9.022   5.852  15.877
  126   2HB   GLN  15          2HB       GLN  15 -10.638   6.360  15.427
  127   1HG   GLN  15          1HG       GLN  15  -9.585   3.609  14.665
  128   2HG   GLN  15          2HG       GLN  15 -10.306   3.900  16.236
  129   1HE2  GLN  15          1HE2      GLN  15 -11.454   2.086  14.664
  130   2HE2  GLN  15          2HE2      GLN  15 -12.962   2.636  14.010
  131    H    ASP  16           H        ASP  16  -6.935   7.089  13.749
  132    HA   ASP  16           HA       ASP  16  -7.976   9.784  13.932
  133   1HB   ASP  16          1HB       ASP  16  -5.937   8.553  15.282
  134   2HB   ASP  16          2HB       ASP  16  -5.027   9.244  13.953
  135    H    GLY  17           H        GLY  17  -8.219   8.309  11.418
  136   1HA   GLY  17          1HA       GLY  17  -7.667   8.369   9.228
  137   2HA   GLY  17          2HA       GLY  17  -7.440  10.083   9.520
  138    H    SER  18           H        SER  18  -5.613   7.071  10.445
  139    HA   SER  18           HA       SER  18  -3.229   8.454   9.510
  140   1HB   SER  18          1HB       SER  18  -3.649   6.255  11.566
  141   2HB   SER  18          2HB       SER  18  -2.060   6.612  10.920
  142    HG   SER  18           HG       SER  18  -3.493   7.954  12.850
  143    H    PHE  19           H        PHE  19  -2.993   7.890   7.346
  144    HA   PHE  19           HA       PHE  19  -3.584   5.175   6.548
  145   1HB   PHE  19          1HB       PHE  19  -2.993   7.881   5.333
  146   2HB   PHE  19          2HB       PHE  19  -2.547   6.498   4.354
  147    HD1  PHE  19           HD1      PHE  19  -5.454   7.789   6.309
  148    HD2  PHE  19           HD2      PHE  19  -4.124   5.610   2.919
  149    HE1  PHE  19           HE1      PHE  19  -7.823   7.591   5.507
  150    HE2  PHE  19           HE2      PHE  19  -6.494   5.412   2.117
  151    HZ   PHE  19           HZ       PHE  19  -8.315   6.405   3.421
  152    H    TYR  20           H        TYR  20  -2.068   3.592   6.650
  153    HA   TYR  20           HA       TYR  20   0.743   4.433   6.420
  154   1HB   TYR  20          1HB       TYR  20  -0.821   2.880   8.326
  155   2HB   TYR  20          2HB       TYR  20   0.258   1.762   7.518
  156    HD1  TYR  20           HD1      TYR  20   2.413   1.470   8.356
  157    HD2  TYR  20           HD2      TYR  20   0.327   5.105   9.220
  158    HE1  TYR  20           HE1      TYR  20   4.306   2.201   9.887
  159    HE2  TYR  20           HE2      TYR  20   2.227   5.823  10.748
  160    HH   TYR  20           HH       TYR  20   4.004   4.575  12.116
  161    H    GLY  21           H        GLY  21   0.943   4.224   4.151
  162   1HA   GLY  21          1HA       GLY  21   0.290   1.579   3.030
  163   2HA   GLY  21          2HA       GLY  21   0.522   3.067   2.132
  164    H    GLY  22           H        GLY  22   1.906   0.162   2.526
  165   1HA   GLY  22          1HA       GLY  22   4.529   1.128   1.789
  166   2HA   GLY  22          2HA       GLY  22   4.474   0.314   3.340
  167    H    TYR  23           H        TYR  23   5.689  -0.450   0.634
  168    HA   TYR  23           HA       TYR  23   4.204  -2.948   0.201
  169   1HB   TYR  23          1HB       TYR  23   5.489  -2.865  -1.985
  170   2HB   TYR  23          2HB       TYR  23   4.534  -1.413  -1.757
  171    HD1  TYR  23           HD1      TYR  23   7.951  -2.803  -1.750
  172    HD2  TYR  23           HD2      TYR  23   5.586   0.745  -1.399
  173    HE1  TYR  23           HE1      TYR  23  10.034  -1.375  -2.048
  174    HE2  TYR  23           HE2      TYR  23   7.677   2.160  -1.699
  175    HH   TYR  23           HH       TYR  23   9.805   2.174  -2.024
  176    H    THR  24           H        THR  24   5.103  -4.848   0.835
  177    HA   THR  24           HA       THR  24   7.895  -5.303   0.745
  178    HB   THR  24           HB       THR  24   7.179  -3.806   2.948
  179    HG1  THR  24           HG1      THR  24   9.042  -6.059   2.983
  180   1HG2  THR  24          1HG2      THR  24   7.289  -5.376   4.888
  181   2HG2  THR  24          2HG2      THR  24   5.811  -5.657   3.935
  182   3HG2  THR  24          3HG2      THR  24   7.198  -6.758   3.771
  183    H    THR  25           H        THR  25   8.420  -7.496   1.840
  184    HA   THR  25           HA       THR  25   6.171  -9.255   1.173
  185    HB   THR  25           HB       THR  25   7.852 -10.844   0.590
  186    HG1  THR  25           HG1      THR  25   9.701  -9.085   2.032
  187   1HG2  THR  25          1HG2      THR  25   9.310  -8.178   0.201
  188   2HG2  THR  25          2HG2      THR  25   9.560  -9.674  -0.728
  189   3HG2  THR  25          3HG2      THR  25   8.036  -8.771  -0.891
  190    H    GLU  26           H        GLU  26   5.366 -10.813   2.561
  191    HA   GLU  26           HA       GLU  26   4.713 -11.564   4.495
  192   1HB   GLU  26          1HB       GLU  26   7.686 -11.415   5.165
  193   2HB   GLU  26          2HB       GLU  26   6.506 -12.324   6.087
  194   1HG   GLU  26          1HG       GLU  26   5.936 -13.625   3.988
  195   2HG   GLU  26          2HG       GLU  26   7.214 -12.769   3.149
  196    HA   PRO  27           HA       PRO  27   4.756  -7.496   6.510
  197   1HB   PRO  27          1HB       PRO  27   2.086  -6.955   6.300
  198   2HB   PRO  27          2HB       PRO  27   3.271  -6.391   5.140
  199   1HG   PRO  27          1HG       PRO  27   1.307  -8.583   4.866
  200   2HG   PRO  27          2HG       PRO  27   2.188  -7.734   3.611
  201   1HD   PRO  27          1HD       PRO  27   2.744 -10.360   4.623
  202   2HD   PRO  27          2HD       PRO  27   3.692  -9.466   3.452
  203    H    GLU  28           H        GLU  28   2.586 -10.203   6.865
  204    HA   GLU  28           HA       GLU  28   1.464  -9.683   9.226
  205   1HB   GLU  28          1HB       GLU  28   2.672 -12.319   8.279
  206   2HB   GLU  28          2HB       GLU  28   1.581 -12.188   9.645
  207   1HG   GLU  28          1HG       GLU  28   0.759 -10.988   6.990
  208   2HG   GLU  28          2HG       GLU  28   0.639 -12.721   7.213
  209    H    ARG  29           H        ARG  29   4.797 -11.024   8.724
  210    HA   ARG  29           HA       ARG  29   5.320 -11.146  11.471
  211   1HB   ARG  29          1HB       ARG  29   6.908 -11.408   8.925
  212   2HB   ARG  29          2HB       ARG  29   7.819 -11.097  10.391
  213   1HG   ARG  29          1HG       ARG  29   7.525 -13.228  11.128
  214   2HG   ARG  29          2HG       ARG  29   5.792 -13.142  10.889
  215   1HD   ARG  29          1HD       ARG  29   5.975 -13.808   8.568
  216   2HD   ARG  29          2HD       ARG  29   7.708 -13.546   8.551
  217    HE   ARG  29           HE       ARG  29   8.025 -15.640   9.565
  218   1HH1  ARG  29          1HH1      ARG  29   4.641 -14.711   9.821
  219   2HH1  ARG  29          2HH1      ARG  29   4.129 -16.255  10.415
  220   1HH2  ARG  29          1HH2      ARG  29   7.349 -17.679  10.347
  221   2HH2  ARG  29          2HH2      ARG  29   5.679 -17.955  10.716
  222    H    ARG  30           H        ARG  30   6.391  -8.889   8.823
  223    HA   ARG  30           HA       ARG  30   7.929  -7.240  10.285
  224   1HB   ARG  30          1HB       ARG  30   7.269  -7.218   7.736
  225   2HB   ARG  30          2HB       ARG  30   5.977  -6.139   8.224
  226   1HG   ARG  30          1HG       ARG  30   8.382  -5.197   9.487
  227   2HG   ARG  30          2HG       ARG  30   8.778  -5.528   7.812
  228   1HD   ARG  30          1HD       ARG  30   6.273  -4.245   7.657
  229   2HD   ARG  30          2HD       ARG  30   7.099  -3.384   8.941
  230    HE   ARG  30           HE       ARG  30   7.710  -3.218   6.140
  231   1HH1  ARG  30          1HH1      ARG  30   9.311  -3.347   9.271
  232   2HH1  ARG  30          2HH1      ARG  30  10.712  -2.483   8.732
  233   1HH2  ARG  30          1HH2      ARG  30   9.559  -2.078   5.430
  234   2HH2  ARG  30          2HH2      ARG  30  10.854  -1.756   6.533
  235    H    LEU  31           H        LEU  31   4.340  -7.284   9.985
  236    HA   LEU  31           HA       LEU  31   3.855  -4.870  11.304
  237   1HB   LEU  31          1HB       LEU  31   2.335  -6.426   9.887
  238   2HB   LEU  31          2HB       LEU  31   2.011  -7.236  11.406
  239    HG   LEU  31           HG       LEU  31   1.681  -4.419  11.814
  240   1HD1  LEU  31          1HD1      LEU  31   0.454  -3.613  10.112
  241   2HD1  LEU  31          2HD1      LEU  31   1.282  -4.871   9.165
  242   3HD1  LEU  31          3HD1      LEU  31  -0.350  -5.171   9.808
  243   1HD2  LEU  31          1HD2      LEU  31   0.135  -6.927  12.099
  244   2HD2  LEU  31          2HD2      LEU  31   0.394  -5.590  13.245
  245   3HD2  LEU  31          3HD2      LEU  31  -0.821  -5.433  11.954
  246    H    THR  32           H        THR  32   3.744  -8.280  12.564
  247    HA   THR  32           HA       THR  32   3.231  -7.779  15.174
  248    HB   THR  32           HB       THR  32   5.128  -9.788  13.857
  249    HG1  THR  32           HG1      THR  32   3.148 -10.993  13.910
  250   1HG2  THR  32          1HG2      THR  32   4.340 -11.157  15.964
  251   2HG2  THR  32          2HG2      THR  32   5.686 -10.011  16.169
  252   3HG2  THR  32          3HG2      THR  32   4.047  -9.560  16.694
  253    H    GLU  33           H        GLU  33   6.567  -7.843  13.743
  254    HA   GLU  33           HA       GLU  33   8.012  -7.293  15.879
  255   1HB   GLU  33          1HB       GLU  33   8.351  -7.055  13.095
  256   2HB   GLU  33          2HB       GLU  33   8.793  -5.474  13.708
  257   1HG   GLU  33          1HG       GLU  33   9.898  -7.617  15.390
  258   2HG   GLU  33          2HG       GLU  33  10.399  -7.800  13.722
  259    H    HIS  34           H        HIS  34   6.402  -4.716  13.872
  260    HA   HIS  34           HA       HIS  34   7.128  -2.546  15.305
  261   1HB   HIS  34          1HB       HIS  34   5.930  -1.775  13.592
  262   2HB   HIS  34          2HB       HIS  34   5.014  -3.262  13.449
  263    HD1  HIS  34           HD1      HIS  34   2.677  -2.298  13.218
  264    HD2  HIS  34           HD2      HIS  34   4.726  -0.823  16.569
  265    HE1  HIS  34           HE1      HIS  34   0.972  -0.964  14.567
  266    H    ASN  35           H        ASN  35   3.977  -4.298  15.813
  267    HA   ASN  35           HA       ASN  35   3.292  -3.006  18.092
  268   1HB   ASN  35          1HB       ASN  35   2.572  -5.521  16.734
  269   2HB   ASN  35          2HB       ASN  35   2.425  -5.684  18.473
  270   1HD2  ASN  35          1HD2      ASN  35   1.432  -3.862  15.646
  271   2HD2  ASN  35          2HD2      ASN  35  -0.023  -3.182  16.293
  272    H    SER  36           H        SER  36   5.807  -5.385  17.509
  273    HA   SER  36           HA       SER  36   6.017  -5.957  20.344
  274   1HB   SER  36          1HB       SER  36   6.914  -7.306  17.827
  275   2HB   SER  36          2HB       SER  36   7.982  -7.469  19.206
  276    HG   SER  36           HG       SER  36   6.344  -9.172  19.058
  277    H    GLY  37           H        GLY  37   6.686  -3.310  19.062
  278   1HA   GLY  37          1HA       GLY  37   8.413  -1.986  20.169
  279   2HA   GLY  37          2HA       GLY  37   9.565  -3.238  19.747
  280    H    THR  38           H        THR  38   9.554  -0.337  19.014
  281    HA   THR  38           HA       THR  38   9.988  -0.723  16.174
  282    HB   THR  38           HB       THR  38   7.890   1.157  17.361
  283    HG1  THR  38           HG1      THR  38   6.647  -0.344  16.295
  284   1HG2  THR  38          1HG2      THR  38   9.617   1.972  15.362
  285   2HG2  THR  38          2HG2      THR  38   8.380   1.113  14.415
  286   3HG2  THR  38          3HG2      THR  38   7.913   2.475  15.461
  287    H    GLY  39           H        GLY  39   9.755   1.864  18.714
  288   1HA   GLY  39          1HA       GLY  39  12.274   2.388  19.285
  289   2HA   GLY  39          2HA       GLY  39  12.215   3.033  17.656
  290    H    ALA  40           H        ALA  40  11.686   3.724  20.950
  291    HA   ALA  40           HA       ALA  40  10.964   5.526  22.013
  292   1HB   ALA  40          1HB       ALA  40  11.946   7.175  20.799
  293   2HB   ALA  40          2HB       ALA  40  11.403   6.491  19.247
  294   3HB   ALA  40          3HB       ALA  40  10.293   7.491  20.216
  295    H    LYS  41           H        LYS  41   9.070   5.037  23.022
  296    HA   LYS  41           HA       LYS  41   6.803   4.080  21.895
  297   1HB   LYS  41          1HB       LYS  41   5.689   4.659  23.933
  298   2HB   LYS  41          2HB       LYS  41   7.335   4.206  24.323
  299   1HG   LYS  41          1HG       LYS  41   7.015   7.101  23.746
  300   2HG   LYS  41          2HG       LYS  41   6.082   6.558  25.127
  301   1HD   LYS  41          1HD       LYS  41   8.260   5.389  25.936
  302   2HD   LYS  41          2HD       LYS  41   9.090   6.330  24.712
  303   1HE   LYS  41          1HE       LYS  41   7.518   8.260  25.978
  304   2HE   LYS  41          2HE       LYS  41   7.950   7.203  27.307
  305   1HZ   LYS  41          1HZ       LYS  41   9.576   9.010  25.900
  306   2HZ   LYS  41          2HZ       LYS  41   9.892   8.211  27.289
  307   3HZ   LYS  41          3HZ       LYS  41  10.236   7.516  25.852
  308    H    TYR  42           H        TYR  42   4.720   5.015  21.320
  309    HA   TYR  42           HA       TYR  42   4.608   7.852  20.864
  310   1HB   TYR  42          1HB       TYR  42   5.703   6.089  18.913
  311   2HB   TYR  42          2HB       TYR  42   4.035   6.257  18.408
  312    HD1  TYR  42           HD1      TYR  42   3.121   8.559  17.895
  313    HD2  TYR  42           HD2      TYR  42   7.285   7.845  18.575
  314    HE1  TYR  42           HE1      TYR  42   3.689  10.773  16.784
  315    HE2  TYR  42           HE2      TYR  42   7.838  10.062  17.459
  316    HH   TYR  42           HH       TYR  42   5.317  12.318  16.582
  317    H    THR  43           H        THR  43   2.443   8.489  19.928
  318    HA   THR  43           HA       THR  43   0.224   8.434  20.093
  319    HB   THR  43           HB       THR  43   0.861   5.590  19.181
  320    HG1  THR  43           HG1      THR  43   1.282   7.582  17.862
  321   1HG2  THR  43          1HG2      THR  43  -1.846   7.008  19.050
  322   2HG2  THR  43          2HG2      THR  43  -1.470   5.351  18.521
  323   3HG2  THR  43          3HG2      THR  43  -1.472   5.752  20.256
  324    H    ARG  44           H        ARG  44   0.187   8.972  22.323
  325    HA   ARG  44           HA       ARG  44  -0.010   6.729  24.114
  326   1HB   ARG  44          1HB       ARG  44   1.120   9.213  24.413
  327   2HB   ARG  44          2HB       ARG  44  -0.456   9.525  25.110
  328   1HG   ARG  44          1HG       ARG  44   0.245   7.050  26.225
  329   2HG   ARG  44          2HG       ARG  44   1.776   7.901  26.168
  330   1HD   ARG  44          1HD       ARG  44   1.144   9.415  27.779
  331   2HD   ARG  44          2HD       ARG  44  -0.472   9.592  27.121
  332    HE   ARG  44           HE       ARG  44  -1.217   8.012  28.665
  333   1HH1  ARG  44          1HH1      ARG  44   2.242   7.567  28.187
  334   2HH1  ARG  44          2HH1      ARG  44   2.380   6.338  29.401
  335   1HH2  ARG  44          1HH2      ARG  44  -1.035   6.392  30.264
  336   2HH2  ARG  44          2HH2      ARG  44   0.503   5.664  30.591
  337    H    LEU  45           H        LEU  45  -1.949   9.440  22.756
  338    HA   LEU  45           HA       LEU  45  -4.168   9.350  24.325
  339   1HB   LEU  45          1HB       LEU  45  -5.362   9.936  22.101
  340   2HB   LEU  45          2HB       LEU  45  -4.190  11.036  22.801
  341    HG   LEU  45           HG       LEU  45  -2.839   9.224  21.009
  342   1HD1  LEU  45          1HD1      LEU  45  -5.389   9.410  20.150
  343   2HD1  LEU  45          2HD1      LEU  45  -4.699  10.861  19.382
  344   3HD1  LEU  45          3HD1      LEU  45  -3.985   9.261  19.066
  345   1HD2  LEU  45          1HD2      LEU  45  -1.977  11.225  20.056
  346   2HD2  LEU  45          2HD2      LEU  45  -3.329  12.192  20.691
  347   3HD2  LEU  45          3HD2      LEU  45  -2.128  11.502  21.807
  348    H    ALA  46           H        ALA  46  -3.854   7.528  21.191
  349    HA   ALA  46           HA       ALA  46  -5.515   5.447  22.441
  350   1HB   ALA  46          1HB       ALA  46  -5.968   5.209  19.736
  351   2HB   ALA  46          2HB       ALA  46  -7.027   6.080  20.872
  352   3HB   ALA  46          3HB       ALA  46  -5.814   6.971  19.924
  353    H    LYS  47           H        LYS  47  -3.315   4.634  23.124
  354    HA   LYS  47           HA       LYS  47  -1.244   4.001  21.544
  355   1HB   LYS  47          1HB       LYS  47  -2.509   2.595  23.879
  356   2HB   LYS  47          2HB       LYS  47  -1.149   1.854  23.059
  357   1HG   LYS  47          1HG       LYS  47   0.332   3.600  23.626
  358   2HG   LYS  47          2HG       LYS  47  -0.955   4.773  23.824
  359   1HD   LYS  47          1HD       LYS  47  -1.159   2.475  25.691
  360   2HD   LYS  47          2HD       LYS  47   0.311   3.404  25.894
  361   1HE   LYS  47          1HE       LYS  47  -1.116   5.515  25.986
  362   2HE   LYS  47          2HE       LYS  47  -2.541   4.496  25.960
  363   1HZ   LYS  47          1HZ       LYS  47  -2.234   3.953  28.074
  364   2HZ   LYS  47          2HZ       LYS  47  -0.627   3.701  27.915
  365   3HZ   LYS  47          3HZ       LYS  47  -1.198   5.212  28.162
  366    H    ARG  48           H        ARG  48  -4.025   1.721  22.111
  367    HA   ARG  48           HA       ARG  48  -3.196   0.070  20.020
  368   1HB   ARG  48          1HB       ARG  48  -5.419   0.211  21.959
  369   2HB   ARG  48          2HB       ARG  48  -5.948  -0.420  20.412
  370   1HG   ARG  48          1HG       ARG  48  -4.950  -2.412  20.828
  371   2HG   ARG  48          2HG       ARG  48  -3.399  -1.631  21.064
  372   1HD   ARG  48          1HD       ARG  48  -3.541  -2.178  23.266
  373   2HD   ARG  48          2HD       ARG  48  -4.840  -1.011  23.415
  374    HE   ARG  48           HE       ARG  48  -6.085  -3.286  22.387
  375   1HH1  ARG  48          1HH1      ARG  48  -4.141  -2.575  25.232
  376   2HH1  ARG  48          2HH1      ARG  48  -4.895  -3.790  26.209
  377   1HH2  ARG  48          1HH2      ARG  48  -7.080  -4.891  23.675
  378   2HH2  ARG  48          2HH2      ARG  48  -6.577  -5.117  25.317
  379    H    ARG  49           H        ARG  49  -3.566   0.244  17.821
  380    HA   ARG  49           HA       ARG  49  -5.665   2.109  17.044
  381   1HB   ARG  49          1HB       ARG  49  -4.290   2.822  15.151
  382   2HB   ARG  49          2HB       ARG  49  -3.327   2.971  16.608
  383   1HG   ARG  49          1HG       ARG  49  -2.450   0.580  16.077
  384   2HG   ARG  49          2HG       ARG  49  -3.172   0.787  14.493
  385   1HD   ARG  49          1HD       ARG  49  -0.917   1.512  14.210
  386   2HD   ARG  49          2HD       ARG  49  -1.835   3.000  14.327
  387    HE   ARG  49           HE       ARG  49  -1.152   2.498  16.957
  388   1HH1  ARG  49          1HH1      ARG  49   0.701   2.705  13.974
  389   2HH1  ARG  49          2HH1      ARG  49   2.143   3.262  14.757
  390   1HH2  ARG  49          1HH2      ARG  49   0.749   3.232  17.991
  391   2HH2  ARG  49          2HH2      ARG  49   2.170   3.563  17.057
  392    HA   PRO  50           HA       PRO  50  -7.025  -1.522  14.955
  393   1HB   PRO  50          1HB       PRO  50  -9.410  -0.544  14.047
  394   2HB   PRO  50          2HB       PRO  50  -9.199  -1.222  15.650
  395   1HG   PRO  50          1HG       PRO  50  -9.461   1.614  14.855
  396   2HG   PRO  50          2HG       PRO  50  -9.676   0.893  16.438
  397   1HD   PRO  50          1HD       PRO  50  -7.407   2.395  15.529
  398   2HD   PRO  50          2HD       PRO  50  -7.574   1.575  17.069
  399    H    VAL  51           H        VAL  51  -5.415  -1.747  13.411
  400    HA   VAL  51           HA       VAL  51  -5.559  -0.005  11.134
  401    HB   VAL  51           HB       VAL  51  -3.680  -1.356  10.333
  402   1HG1  VAL  51          1HG1      VAL  51  -3.601   0.487  12.247
  403   2HG1  VAL  51          2HG1      VAL  51  -3.026  -0.891  13.216
  404   3HG1  VAL  51          3HG1      VAL  51  -2.144  -0.406  11.748
  405   1HG2  VAL  51          1HG2      VAL  51  -3.566  -3.507  10.935
  406   2HG2  VAL  51          2HG2      VAL  51  -2.970  -2.951  12.517
  407   3HG2  VAL  51          3HG2      VAL  51  -4.706  -3.262  12.281
  408    H    ILE  52           H        ILE  52  -7.041  -0.245   9.549
  409    HA   ILE  52           HA       ILE  52  -8.021  -2.969   9.064
  410    HB   ILE  52           HB       ILE  52 -10.056  -2.001   8.286
  411   1HG1  ILE  52          1HG1      ILE  52  -9.239   0.795   8.966
  412   2HG1  ILE  52          2HG1      ILE  52  -8.700   0.127   7.437
  413   1HG2  ILE  52          1HG2      ILE  52 -10.737  -0.692  10.390
  414   2HG2  ILE  52          2HG2      ILE  52 -10.150  -2.361  10.592
  415   3HG2  ILE  52          3HG2      ILE  52  -9.073  -0.991  10.950
  416   1HD1  ILE  52          1HD1      ILE  52 -11.308  -0.658   7.356
  417   2HD1  ILE  52          2HD1      ILE  52 -11.464   0.813   8.343
  418   3HD1  ILE  52          3HD1      ILE  52 -10.743   0.905   6.719
  419    H    MET  53           H        MET  53  -8.182  -3.725   6.892
  420    HA   MET  53           HA       MET  53  -6.266  -2.401   5.186
  421   1HB   MET  53          1HB       MET  53  -6.879  -5.088   5.798
  422   2HB   MET  53          2HB       MET  53  -7.565  -4.885   4.198
  423   1HG   MET  53          1HG       MET  53  -5.486  -4.485   3.195
  424   2HG   MET  53          2HG       MET  53  -4.787  -3.807   4.651
  425   1HE   MET  53          1HE       MET  53  -3.133  -4.714   5.663
  426   2HE   MET  53          2HE       MET  53  -4.014  -5.660   6.887
  427   3HE   MET  53          3HE       MET  53  -2.714  -6.422   5.942
  428    H    ILE  54           H        ILE  54  -6.981  -0.929   3.710
  429    HA   ILE  54           HA       ILE  54  -9.619  -1.438   2.519
  430    HB   ILE  54           HB       ILE  54  -9.403   1.203   2.234
  431   1HG1  ILE  54          1HG1      ILE  54  -8.581   2.132   4.438
  432   2HG1  ILE  54          2HG1      ILE  54  -7.834   0.579   4.749
  433   1HG2  ILE  54          1HG2      ILE  54 -11.269  -0.105   3.224
  434   2HG2  ILE  54          2HG2      ILE  54 -10.403  -0.102   4.778
  435   3HG2  ILE  54          3HG2      ILE  54 -10.950   1.432   4.062
  436   1HD1  ILE  54          1HD1      ILE  54  -6.194   0.881   3.151
  437   2HD1  ILE  54          2HD1      ILE  54  -7.271   1.795   2.068
  438   3HD1  ILE  54          3HD1      ILE  54  -6.542   2.596   3.481
  439    H    HIS  55           H        HIS  55  -6.435  -1.797   1.979
  440    HA   HIS  55           HA       HIS  55  -6.792  -1.237  -0.848
  441   1HB   HIS  55          1HB       HIS  55  -4.622  -0.101   0.901
  442   2HB   HIS  55          2HB       HIS  55  -4.310  -0.431  -0.791
  443    HD1  HIS  55           HD1      HIS  55  -6.388   0.689  -2.426
  444    HD2  HIS  55           HD2      HIS  55  -5.495   2.448   1.275
  445    HE1  HIS  55           HE1      HIS  55  -7.287   3.073  -2.532
  446    H    THR  56           H        THR  56  -5.298  -2.511  -2.218
  447    HA   THR  56           HA       THR  56  -3.684  -4.513  -0.946
  448    HB   THR  56           HB       THR  56  -5.118  -6.384  -2.020
  449    HG1  THR  56           HG1      THR  56  -6.993  -4.133  -1.864
  450   1HG2  THR  56          1HG2      THR  56  -6.714  -4.815   0.047
  451   2HG2  THR  56          2HG2      THR  56  -6.590  -6.581  -0.144
  452   3HG2  THR  56          3HG2      THR  56  -5.213  -5.656   0.504
  453    H    GLU  57           H        GLU  57  -1.895  -4.345  -2.138
  454    HA   GLU  57           HA       GLU  57  -2.285  -4.501  -5.012
  455   1HB   GLU  57          1HB       GLU  57  -1.524  -2.141  -3.732
  456   2HB   GLU  57          2HB       GLU  57   0.013  -2.821  -4.227
  457   1HG   GLU  57          1HG       GLU  57  -0.381  -2.375  -6.426
  458   2HG   GLU  57          2HG       GLU  57  -1.984  -3.079  -6.364
  459    H    LYS  58           H        LYS  58  -0.479  -5.492  -6.171
  460    HA   LYS  58           HA       LYS  58   1.577  -6.654  -4.463
  461   1HB   LYS  58          1HB       LYS  58  -0.103  -8.368  -4.472
  462   2HB   LYS  58          2HB       LYS  58  -0.336  -8.229  -6.203
  463   1HG   LYS  58          1HG       LYS  58   2.370  -8.713  -6.116
  464   2HG   LYS  58          2HG       LYS  58   1.854  -9.583  -4.684
  465   1HD   LYS  58          1HD       LYS  58   1.472 -11.274  -6.200
  466   2HD   LYS  58          2HD       LYS  58  -0.065 -10.456  -6.392
  467   1HE   LYS  58          1HE       LYS  58   0.554 -10.519  -8.622
  468   2HE   LYS  58          2HE       LYS  58   1.335  -9.011  -8.190
  469   1HZ   LYS  58          1HZ       LYS  58   3.307  -9.928  -8.491
  470   2HZ   LYS  58          2HZ       LYS  58   2.960 -11.253  -7.602
  471   3HZ   LYS  58          3HZ       LYS  58   2.558 -11.201  -9.185
  472    H    PHE  59           H        PHE  59   3.548  -6.350  -5.355
  473    HA   PHE  59           HA       PHE  59   3.616  -5.982  -8.268
  474   1HB   PHE  59          1HB       PHE  59   5.173  -4.596  -6.001
  475   2HB   PHE  59          2HB       PHE  59   5.496  -4.329  -7.703
  476    HD1  PHE  59           HD1      PHE  59   4.218  -2.711  -5.091
  477    HD2  PHE  59           HD2      PHE  59   2.936  -3.977  -8.932
  478    HE1  PHE  59           HE1      PHE  59   2.511  -0.871  -5.127
  479    HE2  PHE  59           HE2      PHE  59   1.228  -2.136  -8.969
  480    HZ   PHE  59           HZ       PHE  59   1.037  -0.606  -7.065
  481    H    GLU  60           H        GLU  60   5.117  -7.201  -9.358
  482    HA   GLU  60           HA       GLU  60   6.954  -8.696  -7.658
  483   1HB   GLU  60          1HB       GLU  60   6.880 -10.486  -9.303
  484   2HB   GLU  60          2HB       GLU  60   5.234 -10.052  -8.884
  485   1HG   GLU  60          1HG       GLU  60   5.835  -8.331 -11.025
  486   2HG   GLU  60          2HG       GLU  60   6.624  -9.830 -11.477
  487    H    THR  61           H        THR  61   6.572  -6.510 -10.405
  488    HA   THR  61           HA       THR  61   9.376  -6.834 -11.154
  489    HB   THR  61           HB       THR  61   8.629  -5.276 -13.028
  490    HG1  THR  61           HG1      THR  61   6.455  -4.603 -12.907
  491   1HG2  THR  61          1HG2      THR  61   6.459  -7.039 -13.467
  492   2HG2  THR  61          2HG2      THR  61   8.124  -7.261 -14.054
  493   3HG2  THR  61          3HG2      THR  61   7.619  -7.993 -12.513
  494    H    ARG  62           H        ARG  62  10.932  -5.209 -11.023
  495    HA   ARG  62           HA       ARG  62  10.574  -3.536  -8.800
  496   1HB   ARG  62          1HB       ARG  62  12.768  -4.589  -9.613
  497   2HB   ARG  62          2HB       ARG  62  12.789  -3.405 -10.905
  498   1HG   ARG  62          1HG       ARG  62  13.972  -2.136  -9.408
  499   2HG   ARG  62          2HG       ARG  62  12.391  -1.743  -8.764
  500   1HD   ARG  62          1HD       ARG  62  13.331  -2.501  -6.796
  501   2HD   ARG  62          2HD       ARG  62  12.808  -4.058  -7.405
  502    HE   ARG  62           HE       ARG  62  15.045  -4.646  -7.785
  503   1HH1  ARG  62          1HH1      ARG  62  14.821  -1.166  -7.310
  504   2HH1  ARG  62          2HH1      ARG  62  16.536  -0.934  -7.257
  505   1HH2  ARG  62          1HH2      ARG  62  17.309  -4.341  -7.712
  506   2HH2  ARG  62          2HH2      ARG  62  17.961  -2.752  -7.486
  507    H    SER  63           H        SER  63  10.456  -3.135 -12.357
  508    HA   SER  63           HA       SER  63  10.677  -0.426 -12.525
  509   1HB   SER  63          1HB       SER  63   9.064  -2.426 -14.153
  510   2HB   SER  63          2HB       SER  63   9.143  -0.731 -14.596
  511    HG   SER  63           HG       SER  63  11.384  -0.890 -14.918
  512    H    GLU  64           H        GLU  64   7.733  -2.466 -11.958
  513    HA   GLU  64           HA       GLU  64   6.005  -0.260 -11.868
  514   1HB   GLU  64          1HB       GLU  64   5.835  -3.184 -11.170
  515   2HB   GLU  64          2HB       GLU  64   4.581  -2.125 -10.554
  516   1HG   GLU  64          1HG       GLU  64   5.400  -2.209 -13.495
  517   2HG   GLU  64          2HG       GLU  64   4.100  -3.182 -12.835
  518    H    ALA  65           H        ALA  65   7.731  -2.212  -9.367
  519    HA   ALA  65           HA       ALA  65   6.599  -1.256  -7.095
  520   1HB   ALA  65          1HB       ALA  65   8.187  -2.855  -6.667
  521   2HB   ALA  65          2HB       ALA  65   9.304  -2.233  -7.905
  522   3HB   ALA  65          3HB       ALA  65   9.182  -1.420  -6.327
  523    H    THR  66           H        THR  66   9.534   0.185  -8.698
  524    HA   THR  66           HA       THR  66   9.574   2.475  -7.105
  525    HB   THR  66           HB       THR  66  11.460   1.603  -8.507
  526    HG1  THR  66           HG1      THR  66  10.384   4.215  -9.309
  527   1HG2  THR  66          1HG2      THR  66  11.372   2.434 -10.967
  528   2HG2  THR  66          2HG2      THR  66  10.451   0.954 -10.604
  529   3HG2  THR  66          3HG2      THR  66   9.607   2.515 -10.757
  530    H    LYS  67           H        LYS  67   7.621   1.634  -9.942
  531    HA   LYS  67           HA       LYS  67   6.864   4.273 -10.562
  532   1HB   LYS  67          1HB       LYS  67   6.548   1.765 -11.692
  533   2HB   LYS  67          2HB       LYS  67   4.916   2.173 -11.200
  534   1HG   LYS  67          1HG       LYS  67   4.716   3.675 -12.888
  535   2HG   LYS  67          2HG       LYS  67   6.155   4.527 -12.364
  536   1HD   LYS  67          1HD       LYS  67   7.242   2.244 -13.516
  537   2HD   LYS  67          2HD       LYS  67   5.836   2.515 -14.526
  538   1HE   LYS  67          1HE       LYS  67   6.553   4.780 -15.066
  539   2HE   LYS  67          2HE       LYS  67   7.816   4.737 -13.851
  540   1HZ   LYS  67          1HZ       LYS  67   7.695   3.095 -16.285
  541   2HZ   LYS  67          2HZ       LYS  67   8.747   4.305 -15.973
  542   3HZ   LYS  67          3HZ       LYS  67   8.825   2.916 -15.118
  543    H    ALA  68           H        ALA  68   5.495   1.714  -8.422
  544    HA   ALA  68           HA       ALA  68   3.142   3.019  -7.769
  545   1HB   ALA  68          1HB       ALA  68   3.076   0.902  -6.947
  546   2HB   ALA  68          2HB       ALA  68   4.837   0.839  -6.696
  547   3HB   ALA  68          3HB       ALA  68   3.795   1.635  -5.492
  548    H    GLU  69           H        GLU  69   6.489   3.370  -6.517
  549    HA   GLU  69           HA       GLU  69   5.776   4.964  -4.344
  550   1HB   GLU  69          1HB       GLU  69   8.079   3.750  -5.204
  551   2HB   GLU  69          2HB       GLU  69   8.443   5.416  -5.606
  552   1HG   GLU  69          1HG       GLU  69   7.213   5.127  -2.929
  553   2HG   GLU  69          2HG       GLU  69   8.720   4.245  -3.080
  554    H    ALA  70           H        ALA  70   7.266   5.873  -7.543
  555    HA   ALA  70           HA       ALA  70   7.240   8.565  -7.287
  556   1HB   ALA  70          1HB       ALA  70   7.701   8.542  -9.522
  557   2HB   ALA  70          2HB       ALA  70   7.789   6.783  -9.268
  558   3HB   ALA  70          3HB       ALA  70   6.298   7.516  -9.907
  559    H    ALA  71           H        ALA  71   4.483   6.407  -8.156
  560    HA   ALA  71           HA       ALA  71   2.680   8.513  -8.655
  561   1HB   ALA  71          1HB       ALA  71   1.936   6.550  -9.582
  562   2HB   ALA  71          2HB       ALA  71   2.595   5.552  -8.265
  563   3HB   ALA  71          3HB       ALA  71   1.072   6.441  -8.029
  564    H    PHE  72           H        PHE  72   3.389   6.460  -5.757
  565    HA   PHE  72           HA       PHE  72   1.434   7.359  -4.094
  566   1HB   PHE  72          1HB       PHE  72   3.651   5.743  -3.962
  567   2HB   PHE  72          2HB       PHE  72   4.290   7.128  -3.097
  568    HD1  PHE  72           HD1      PHE  72   0.929   5.489  -3.095
  569    HD2  PHE  72           HD2      PHE  72   4.325   6.670  -0.842
  570    HE1  PHE  72           HE1      PHE  72  -0.188   4.692  -0.994
  571    HE2  PHE  72           HE2      PHE  72   3.209   5.873   1.260
  572    HZ   PHE  72           HZ       PHE  72   0.965   4.893   1.159
  573    H    LYS  73           H        LYS  73   4.139   9.155  -5.409
  574    HA   LYS  73           HA       LYS  73   3.955  11.173  -3.328
  575   1HB   LYS  73          1HB       LYS  73   6.149  10.330  -4.295
  576   2HB   LYS  73          2HB       LYS  73   5.731  11.160  -5.780
  577   1HG   LYS  73          1HG       LYS  73   5.252  13.101  -3.809
  578   2HG   LYS  73          2HG       LYS  73   6.678  12.275  -3.215
  579   1HD   LYS  73          1HD       LYS  73   7.298  12.547  -5.901
  580   2HD   LYS  73          2HD       LYS  73   6.352  13.995  -5.623
  581   1HE   LYS  73          1HE       LYS  73   7.827  14.450  -3.573
  582   2HE   LYS  73          2HE       LYS  73   8.844  13.122  -4.092
  583   1HZ   LYS  73          1HZ       LYS  73   8.479  15.715  -5.307
  584   2HZ   LYS  73          2HZ       LYS  73   9.831  14.810  -5.171
  585   3HZ   LYS  73          3HZ       LYS  73   8.729  14.463  -6.324
  586    H    LYS  74           H        LYS  74   2.885  10.462  -6.626
  587    HA   LYS  74           HA       LYS  74   1.972  13.211  -6.944
  588   1HB   LYS  74          1HB       LYS  74   1.978  12.849  -9.190
  589   2HB   LYS  74          2HB       LYS  74   3.191  11.672  -8.726
  590   1HG   LYS  74          1HG       LYS  74   1.004  10.100  -8.441
  591   2HG   LYS  74          2HG       LYS  74   0.348  11.226  -9.612
  592   1HD   LYS  74          1HD       LYS  74   3.064   9.926 -10.049
  593   2HD   LYS  74          2HD       LYS  74   1.586   9.093 -10.492
  594   1HE   LYS  74          1HE       LYS  74   2.126  10.206 -12.494
  595   2HE   LYS  74          2HE       LYS  74   0.979  11.316 -11.769
  596   1HZ   LYS  74          1HZ       LYS  74   2.638  12.750 -11.187
  597   2HZ   LYS  74          2HZ       LYS  74   3.813  11.616 -11.172
  598   3HZ   LYS  74          3HZ       LYS  74   3.232  12.171 -12.595
  599    H    LEU  75           H        LEU  75   0.892  11.224  -4.912
  600    HA   LEU  75           HA       LEU  75  -1.892  11.536  -5.727
  601   1HB   LEU  75          1HB       LEU  75  -0.744   8.964  -4.634
  602   2HB   LEU  75          2HB       LEU  75  -2.437   9.289  -4.950
  603    HG   LEU  75           HG       LEU  75  -0.317   9.344  -7.111
  604   1HD1  LEU  75          1HD1      LEU  75  -1.354   7.075  -7.726
  605   2HD1  LEU  75          2HD1      LEU  75  -0.197   7.130  -6.372
  606   3HD1  LEU  75          3HD1      LEU  75  -1.945   7.041  -6.047
  607   1HD2  LEU  75          1HD2      LEU  75  -2.361  10.583  -7.627
  608   2HD2  LEU  75          2HD2      LEU  75  -2.213   9.125  -8.637
  609   3HD2  LEU  75          3HD2      LEU  75  -3.338   9.142  -7.257
  610    H    THR  76           H        THR  76  -3.359  11.102  -3.717
  611    HA   THR  76           HA       THR  76  -1.997  11.697  -1.218
  612    HB   THR  76           HB       THR  76  -2.595  13.870  -2.586
  613    HG1  THR  76           HG1      THR  76  -2.259  14.371  -0.453
  614   1HG2  THR  76          1HG2      THR  76  -5.092  12.807  -2.803
  615   2HG2  THR  76          2HG2      THR  76  -5.262  13.600  -1.219
  616   3HG2  THR  76          3HG2      THR  76  -4.823  14.559  -2.651
  617    H    ARG  77           H        ARG  77  -3.930  12.026   0.530
  618    HA   ARG  77           HA       ARG  77  -4.904   9.644   1.040
  619   1HB   ARG  77          1HB       ARG  77  -5.246  12.134   2.141
  620   2HB   ARG  77          2HB       ARG  77  -6.875  11.850   1.560
  621   1HG   ARG  77          1HG       ARG  77  -6.463   9.440   2.715
  622   2HG   ARG  77          2HG       ARG  77  -5.323  10.365   3.671
  623   1HD   ARG  77          1HD       ARG  77  -7.616  12.004   3.601
  624   2HD   ARG  77          2HD       ARG  77  -8.270  10.386   3.753
  625    HE   ARG  77           HE       ARG  77  -7.381  10.247   5.917
  626   1HH1  ARG  77          1HH1      ARG  77  -5.860  12.921   4.209
  627   2HH1  ARG  77          2HH1      ARG  77  -5.038  13.517   5.612
  628   1HH2  ARG  77          1HH2      ARG  77  -6.297  11.033   7.769
  629   2HH2  ARG  77          2HH2      ARG  77  -5.288  12.436   7.650
  630    H    LYS  78           H        LYS  78  -6.098  11.871  -1.433
  631    HA   LYS  78           HA       LYS  78  -8.475  10.231  -1.848
  632   1HB   LYS  78          1HB       LYS  78  -7.970  12.997  -2.000
  633   2HB   LYS  78          2HB       LYS  78  -8.177  12.475  -3.660
  634   1HG   LYS  78          1HG       LYS  78 -10.111  11.645  -1.457
  635   2HG   LYS  78          2HG       LYS  78 -10.319  13.131  -2.360
  636   1HD   LYS  78          1HD       LYS  78  -9.869  11.210  -4.364
  637   2HD   LYS  78          2HD       LYS  78 -10.845  10.350  -3.190
  638   1HE   LYS  78          1HE       LYS  78 -12.696  11.440  -3.917
  639   2HE   LYS  78          2HE       LYS  78 -11.987  12.974  -3.454
  640   1HZ   LYS  78          1HZ       LYS  78 -11.045  13.213  -5.556
  641   2HZ   LYS  78          2HZ       LYS  78 -11.296  11.655  -5.976
  642   3HZ   LYS  78          3HZ       LYS  78 -12.560  12.681  -5.853
  643    H    GLN  79           H        GLN  79  -6.167  11.883  -4.107
  644    HA   GLN  79           HA       GLN  79  -6.482  10.448  -6.258
  645   1HB   GLN  79          1HB       GLN  79  -4.323  11.970  -5.127
  646   2HB   GLN  79          2HB       GLN  79  -3.620  10.553  -5.884
  647   1HG   GLN  79          1HG       GLN  79  -3.723  12.032  -7.699
  648   2HG   GLN  79          2HG       GLN  79  -5.215  11.138  -7.907
  649   1HE2  GLN  79          1HE2      GLN  79  -6.977  12.259  -8.200
  650   2HE2  GLN  79          2HE2      GLN  79  -7.274  13.897  -7.723
  651    H    LYS  80           H        LYS  80  -4.825   9.284  -3.301
  652    HA   LYS  80           HA       LYS  80  -3.836   6.908  -4.451
  653   1HB   LYS  80          1HB       LYS  80  -4.201   7.992  -1.682
  654   2HB   LYS  80          2HB       LYS  80  -3.896   6.276  -1.872
  655   1HG   LYS  80          1HG       LYS  80  -1.715   6.614  -2.445
  656   2HG   LYS  80          2HG       LYS  80  -2.120   7.884  -3.583
  657   1HD   LYS  80          1HD       LYS  80  -2.174   9.565  -1.846
  658   2HD   LYS  80          2HD       LYS  80  -2.168   8.360  -0.574
  659   1HE   LYS  80          1HE       LYS  80   0.144   8.065  -2.383
  660   2HE   LYS  80          2HE       LYS  80   0.087   9.653  -1.643
  661   1HZ   LYS  80          1HZ       LYS  80  -0.503   7.616   0.223
  662   2HZ   LYS  80          2HZ       LYS  80   0.955   7.372  -0.471
  663   3HZ   LYS  80          3HZ       LYS  80   0.639   8.781   0.292
  664    H    GLU  81           H        GLU  81  -6.602   7.403  -2.139
  665    HA   GLU  81           HA       GLU  81  -7.648   4.992  -2.119
  666   1HB   GLU  81          1HB       GLU  81  -8.529   7.454  -1.354
  667   2HB   GLU  81          2HB       GLU  81  -9.659   7.143  -2.656
  668   1HG   GLU  81          1HG       GLU  81 -10.856   5.978  -1.102
  669   2HG   GLU  81          2HG       GLU  81  -9.676   4.706  -1.346
  670    H    GLN  82           H        GLN  82  -7.722   7.243  -4.890
  671    HA   GLN  82           HA       GLN  82  -9.517   5.556  -6.338
  672   1HB   GLN  82          1HB       GLN  82  -9.091   8.205  -6.451
  673   2HB   GLN  82          2HB       GLN  82  -7.917   7.736  -7.664
  674   1HG   GLN  82          1HG       GLN  82  -9.645   7.682  -9.142
  675   2HG   GLN  82          2HG       GLN  82 -10.152   6.201  -8.354
  676   1HE2  GLN  82          1HE2      GLN  82 -11.182   6.797  -6.047
  677   2HE2  GLN  82          2HE2      GLN  82 -12.510   7.906  -6.136
  678    H    TYR  83           H        TYR  83  -6.028   6.533  -6.536
  679    HA   TYR  83           HA       TYR  83  -5.186   5.258  -8.726
  680   1HB   TYR  83          1HB       TYR  83  -3.623   6.418  -7.282
  681   2HB   TYR  83          2HB       TYR  83  -4.156   5.539  -5.863
  682    HD1  TYR  83           HD1      TYR  83  -2.092   4.709  -5.051
  683    HD2  TYR  83           HD2      TYR  83  -3.177   4.047  -9.136
  684    HE1  TYR  83           HE1      TYR  83  -0.137   3.105  -5.319
  685    HE2  TYR  83           HE2      TYR  83  -1.219   2.445  -9.390
  686    HH   TYR  83           HH       TYR  83   1.203   2.158  -6.933
  687    H    LEU  84           H        LEU  84  -6.174   3.708  -5.648
  688    HA   LEU  84           HA       LEU  84  -5.344   1.117  -6.644
  689   1HB   LEU  84          1HB       LEU  84  -6.670   1.936  -4.056
  690   2HB   LEU  84          2HB       LEU  84  -6.105   0.324  -4.445
  691    HG   LEU  84           HG       LEU  84  -3.836   1.817  -4.863
  692   1HD1  LEU  84          1HD1      LEU  84  -3.795   3.722  -3.724
  693   2HD1  LEU  84          2HD1      LEU  84  -5.545   3.542  -3.456
  694   3HD1  LEU  84          3HD1      LEU  84  -4.392   2.921  -2.250
  695   1HD2  LEU  84          1HD2      LEU  84  -3.104   0.201  -3.538
  696   2HD2  LEU  84          2HD2      LEU  84  -3.850   0.996  -2.132
  697   3HD2  LEU  84          3HD2      LEU  84  -4.779  -0.189  -3.079
  698    H    LYS  85           H        LYS  85  -8.300   3.056  -6.051
  699    HA   LYS  85           HA       LYS  85 -10.168   1.050  -6.387
  700   1HB   LYS  85          1HB       LYS  85 -10.380   3.562  -5.691
  701   2HB   LYS  85          2HB       LYS  85 -10.615   3.848  -7.404
  702   1HG   LYS  85          1HG       LYS  85 -12.743   3.064  -7.318
  703   2HG   LYS  85          2HG       LYS  85 -12.221   1.562  -6.581
  704   1HD   LYS  85          1HD       LYS  85 -13.227   2.245  -4.665
  705   2HD   LYS  85          2HD       LYS  85 -11.965   3.450  -4.503
  706   1HE   LYS  85          1HE       LYS  85 -13.287   5.138  -5.620
  707   2HE   LYS  85          2HE       LYS  85 -14.438   3.955  -6.208
  708   1HZ   LYS  85          1HZ       LYS  85 -14.881   5.348  -4.070
  709   2HZ   LYS  85          2HZ       LYS  85 -15.420   3.811  -4.198
  710   3HZ   LYS  85          3HZ       LYS  85 -14.065   4.133  -3.344
  711    H    THR  86           H        THR  86  -8.849   3.331  -8.893
  712    HA   THR  86           HA       THR  86 -10.121   2.304 -11.078
  713    HB   THR  86           HB       THR  86  -8.532   4.334 -10.815
  714    HG1  THR  86           HG1      THR  86  -9.101   3.978 -12.946
  715   1HG2  THR  86          1HG2      THR  86  -6.513   2.122 -11.468
  716   2HG2  THR  86          2HG2      THR  86  -6.190   3.869 -11.594
  717   3HG2  THR  86          3HG2      THR  86  -6.505   3.133 -10.004
  718    H    PHE  87           H        PHE  87  -7.406   0.891  -9.261
  719    HA   PHE  87           HA       PHE  87  -6.968  -1.097 -11.292
  720   1HB   PHE  87          1HB       PHE  87  -5.061  -0.354  -9.978
  721   2HB   PHE  87          2HB       PHE  87  -5.971  -0.419  -8.481
  722    HD1  PHE  87           HD1      PHE  87  -5.099  -2.830 -11.209
  723    HD2  PHE  87           HD2      PHE  87  -5.296  -2.071  -7.039
  724    HE1  PHE  87           HE1      PHE  87  -4.181  -5.119 -10.749
  725    HE2  PHE  87           HE2      PHE  87  -4.378  -4.361  -6.578
  726    HZ   PHE  87           HZ       PHE  87  -3.831  -5.859  -8.440
  727    H    HIS  88           H        HIS  88  -8.406  -0.900  -7.978
  728    HA   HIS  88           HA       HIS  88  -8.922  -3.624  -7.738
  729   1HB   HIS  88          1HB       HIS  88  -8.931  -2.233  -5.805
  730   2HB   HIS  88          2HB       HIS  88 -10.151  -1.169  -6.476
  731    HD1  HIS  88           HD1      HIS  88  -9.764  -4.024  -4.264
  732    HD2  HIS  88           HD2      HIS  88 -12.781  -2.577  -6.794
  733    HE1  HIS  88           HE1      HIS  88 -11.927  -5.156  -3.520
  734    H    LEU  89           H        LEU  89 -10.887  -0.894  -9.058
  735    HA   LEU  89           HA       LEU  89 -13.253  -2.178  -9.450
  736   1HB   LEU  89          1HB       LEU  89 -11.851  -0.127 -11.160
  737   2HB   LEU  89          2HB       LEU  89 -13.514  -0.618 -11.403
  738    HG   LEU  89           HG       LEU  89 -12.650   0.396  -8.709
  739   1HD1  LEU  89          1HD1      LEU  89 -12.247   1.898 -11.030
  740   2HD1  LEU  89          2HD1      LEU  89 -13.780   2.499 -10.355
  741   3HD1  LEU  89          3HD1      LEU  89 -12.309   2.495  -9.353
  742   1HD2  LEU  89          1HD2      LEU  89 -15.055  -0.528  -9.766
  743   2HD2  LEU  89          2HD2      LEU  89 -14.823   0.361  -8.241
  744   3HD2  LEU  89          3HD2      LEU  89 -15.234   1.243  -9.733
  745    H    GLU  90           H        GLU  90 -10.640  -1.897 -11.967
  746    HA   GLU  90           HA       GLU  90 -11.714  -3.552 -13.782
  747   1HB   GLU  90          1HB       GLU  90  -9.320  -2.250 -13.502
  748   2HB   GLU  90          2HB       GLU  90  -8.780  -3.911 -13.357
  749   1HG   GLU  90          1HG       GLU  90  -9.856  -4.495 -15.505
  750   2HG   GLU  90          2HG       GLU  90 -10.539  -2.885 -15.635
  751    H    HIS  91           H        HIS  91 -11.361  -5.844 -14.362
  752    HA   HIS  91           HA       HIS  91 -10.145  -7.637 -12.616
  753   1HB   HIS  91          1HB       HIS  91 -11.968  -8.680 -11.500
  754   2HB   HIS  91          2HB       HIS  91 -12.036  -6.967 -11.138
  755    HD1  HIS  91           HD1      HIS  91 -13.704  -5.645 -13.111
  756    HD2  HIS  91           HD2      HIS  91 -14.453  -9.634 -12.048
  757    HE1  HIS  91           HE1      HIS  91 -16.131  -6.111 -13.747
  758    H    HIS  92           H        HIS  92 -10.211  -9.810 -13.466
  759    HA   HIS  92           HA       HIS  92 -10.424 -11.344 -15.022
  760   1HB   HIS  92          1HB       HIS  92 -12.964 -10.284 -14.872
  761   2HB   HIS  92          2HB       HIS  92 -12.610 -10.143 -16.583
  762    HD1  HIS  92           HD1      HIS  92 -14.653 -12.007 -16.615
  763    HD2  HIS  92           HD2      HIS  92 -10.900 -13.276 -15.237
  764    HE1  HIS  92           HE1      HIS  92 -14.673 -14.555 -16.732
  765    H    HIS  93           H        HIS  93  -8.575 -11.225 -16.222
  766    HA   HIS  93           HA       HIS  93  -8.661 -10.223 -18.794
  767   1HB   HIS  93          1HB       HIS  93  -8.073  -8.201 -16.823
  768   2HB   HIS  93          2HB       HIS  93  -6.665  -8.457 -17.834
  769    HD1  HIS  93           HD1      HIS  93  -8.759  -5.941 -17.804
  770    HD2  HIS  93           HD2      HIS  93  -8.417  -8.967 -20.689
  771    HE1  HIS  93           HE1      HIS  93  -9.734  -4.987 -19.961
  772    H    HIS  94           H        HIS  94  -6.245 -10.290 -16.070
  773    HA   HIS  94           HA       HIS  94  -4.885 -12.408 -17.555
  774   1HB   HIS  94          1HB       HIS  94  -3.933  -9.811 -17.360
  775   2HB   HIS  94          2HB       HIS  94  -3.090 -10.634 -16.063
  776    HD1  HIS  94           HD1      HIS  94  -2.655  -9.842 -19.493
  777    HD2  HIS  94           HD2      HIS  94  -1.957 -13.288 -17.203
  778    HE1  HIS  94           HE1      HIS  94  -0.981 -11.250 -20.809
  779    H    HIS  95           H        HIS  95  -5.855 -13.972 -16.169
  780    HA   HIS  95           HA       HIS  95  -4.439 -14.301 -13.726
  781   1HB   HIS  95          1HB       HIS  95  -6.441 -12.665 -13.288
  782   2HB   HIS  95          2HB       HIS  95  -7.418 -14.118 -13.370
  783    HD1  HIS  95           HD1      HIS  95  -8.038 -14.155 -10.877
  784    HD2  HIS  95           HD2      HIS  95  -3.902 -14.166 -11.576
  785    HE1  HIS  95           HE1      HIS  95  -6.934 -14.656  -8.631
  786    H    HIS  96           H        HIS  96  -5.015 -16.445 -12.697
  787    HA   HIS  96           HA       HIS  96  -5.978 -18.234 -14.803
  788   1HB   HIS  96          1HB       HIS  96  -3.548 -18.269 -13.685
  789   2HB   HIS  96          2HB       HIS  96  -4.383 -19.240 -12.490
  790    HD1  HIS  96           HD1      HIS  96  -2.282 -19.884 -15.114
  791    HD2  HIS  96           HD2      HIS  96  -6.192 -21.189 -14.337
  792    HE1  HIS  96           HE1      HIS  96  -2.601 -22.028 -16.462
  Start of MODEL    8
    1   1H    MET   1          1H        MET   1   0.402 -14.918  -2.733
    2    HA   MET   1           HA       MET   1   1.316 -13.062  -1.648
    3   1HB   MET   1          1HB       MET   1  -0.240 -14.870   0.281
    4   2HB   MET   1          2HB       MET   1   0.030 -13.164   0.573
    5   1HG   MET   1          1HG       MET   1  -1.066 -12.730  -1.730
    6   2HG   MET   1          2HG       MET   1  -1.547 -14.415  -1.719
    7   1HE   MET   1          1HE       MET   1  -2.974 -10.802  -0.005
    8   2HE   MET   1          2HE       MET   1  -2.556 -11.399  -1.628
    9   3HE   MET   1          3HE       MET   1  -4.209 -11.605  -1.002
   10    H    GLU   2           H        GLU   2   1.858 -12.537   0.999
   11    HA   GLU   2           HA       GLU   2   3.405 -12.560   2.520
   12   1HB   GLU   2          1HB       GLU   2   3.664 -15.498   1.765
   13   2HB   GLU   2          2HB       GLU   2   4.557 -14.779   3.090
   14   1HG   GLU   2          1HG       GLU   2   2.750 -15.203   4.400
   15   2HG   GLU   2          2HG       GLU   2   1.933 -13.905   3.553
   16    H    ASN   3           H        ASN   3   5.957 -13.145   2.865
   17    HA   ASN   3           HA       ASN   3   7.261 -11.759   0.898
   18   1HB   ASN   3          1HB       ASN   3   9.258 -12.237   2.128
   19   2HB   ASN   3          2HB       ASN   3   7.994 -12.312   3.338
   20   1HD2  ASN   3          1HD2      ASN   3   6.954 -14.498   3.615
   21   2HD2  ASN   3          2HD2      ASN   3   7.993 -15.884   3.650
   22    H    LYS   4           H        LYS   4   9.680 -13.566   0.642
   23    HA   LYS   4           HA       LYS   4  10.519 -15.110  -0.695
   24   1HB   LYS   4          1HB       LYS   4   9.364 -16.820   0.420
   25   2HB   LYS   4          2HB       LYS   4   7.807 -16.334  -0.221
   26   1HG   LYS   4          1HG       LYS   4   9.610 -16.910  -2.430
   27   2HG   LYS   4          2HG       LYS   4   9.623 -18.258  -1.312
   28   1HD   LYS   4          1HD       LYS   4   7.447 -18.838  -1.770
   29   2HD   LYS   4          2HD       LYS   4   6.907 -17.172  -1.841
   30   1HE   LYS   4          1HE       LYS   4   6.678 -17.867  -4.084
   31   2HE   LYS   4          2HE       LYS   4   8.230 -17.052  -4.105
   32   1HZ   LYS   4          1HZ       LYS   4   9.298 -18.970  -4.419
   33   2HZ   LYS   4          2HZ       LYS   4   8.328 -19.842  -3.436
   34   3HZ   LYS   4          3HZ       LYS   4   7.858 -19.517  -4.965
   35    H    LYS   5           H        LYS   5  10.422 -12.998  -2.050
   36    HA   LYS   5           HA       LYS   5  10.274 -12.121  -4.071
   37   1HB   LYS   5          1HB       LYS   5   9.553 -14.967  -4.690
   38   2HB   LYS   5          2HB       LYS   5   9.348 -13.751  -5.934
   39   1HG   LYS   5          1HG       LYS   5  11.948 -13.999  -4.367
   40   2HG   LYS   5          2HG       LYS   5  11.647 -14.964  -5.800
   41   1HD   LYS   5          1HD       LYS   5  11.647 -13.095  -7.235
   42   2HD   LYS   5          2HD       LYS   5  11.197 -11.980  -5.961
   43   1HE   LYS   5          1HE       LYS   5  13.382 -11.748  -5.188
   44   2HE   LYS   5          2HE       LYS   5  13.830 -13.385  -5.626
   45   1HZ   LYS   5          1HZ       LYS   5  14.351 -11.127  -7.048
   46   2HZ   LYS   5          2HZ       LYS   5  14.563 -12.664  -7.561
   47   3HZ   LYS   5          3HZ       LYS   5  13.179 -11.870  -7.910
   48    H    SER   6           H        SER   6   8.761 -10.953  -5.401
   49    HA   SER   6           HA       SER   6   6.821 -10.131  -5.985
   50   1HB   SER   6          1HB       SER   6   5.301 -12.122  -4.270
   51   2HB   SER   6          2HB       SER   6   4.743 -11.285  -5.703
   52    HG   SER   6           HG       SER   6   6.153 -13.667  -5.483
   53    H    HIS   7           H        HIS   7   7.111  -8.157  -4.902
   54    HA   HIS   7           HA       HIS   7   6.643  -8.039  -2.072
   55   1HB   HIS   7          1HB       HIS   7   7.022  -5.621  -3.805
   56   2HB   HIS   7          2HB       HIS   7   7.543  -5.901  -2.156
   57    HD1  HIS   7           HD1      HIS   7   8.506  -6.628  -5.737
   58    HD2  HIS   7           HD2      HIS   7  10.042  -7.169  -1.872
   59    HE1  HIS   7           HE1      HIS   7  10.938  -7.342  -6.028
   60    H    TYR   8           H        TYR   8   4.785  -7.391  -1.051
   61    HA   TYR   8           HA       TYR   8   2.574  -6.612  -2.823
   62   1HB   TYR   8          1HB       TYR   8   2.944  -8.098  -0.174
   63   2HB   TYR   8          2HB       TYR   8   1.389  -7.369  -0.518
   64    HD1  TYR   8           HD1      TYR   8  -0.217  -8.784  -1.393
   65    HD2  TYR   8           HD2      TYR   8   3.894  -9.514  -2.329
   66    HE1  TYR   8           HE1      TYR   8  -0.878 -10.843  -2.730
   67    HE2  TYR   8           HE2      TYR   8   3.218 -11.571  -3.662
   68    HH   TYR   8           HH       TYR   8   1.538 -13.043  -3.967
   69    H    PHE   9           H        PHE   9   1.537  -4.674  -2.531
   70    HA   PHE   9           HA       PHE   9   2.595  -3.008  -0.374
   71   1HB   PHE   9          1HB       PHE   9   2.616  -2.468  -2.965
   72   2HB   PHE   9          2HB       PHE   9   0.887  -2.231  -2.800
   73    HD1  PHE   9           HD1      PHE   9   0.412  -0.710  -0.503
   74    HD2  PHE   9           HD2      PHE   9   3.778  -0.495  -3.077
   75    HE1  PHE   9           HE1      PHE   9   0.805   1.664   0.212
   76    HE2  PHE   9           HE2      PHE   9   4.171   1.880  -2.364
   77    HZ   PHE   9           HZ       PHE   9   2.680   2.931  -0.727
   78    H    TYR  10           H        TYR  10   1.335  -2.704   1.397
   79    HA   TYR  10           HA       TYR  10  -1.574  -2.904   1.000
   80   1HB   TYR  10          1HB       TYR  10  -1.600  -4.013   3.167
   81   2HB   TYR  10          2HB       TYR  10  -0.238  -4.730   2.330
   82    HD1  TYR  10           HD1      TYR  10  -1.272  -2.531   5.076
   83    HD2  TYR  10           HD2      TYR  10   2.072  -4.188   2.986
   84    HE1  TYR  10           HE1      TYR  10   0.263  -1.861   6.989
   85    HE2  TYR  10           HE2      TYR  10   3.598  -3.514   4.906
   86    HH   TYR  10           HH       TYR  10   2.491  -1.444   7.443
   87    H    VAL  11           H        VAL  11  -2.855  -1.276   1.844
   88    HA   VAL  11           HA       VAL  11  -1.377   0.891   3.168
   89    HB   VAL  11           HB       VAL  11  -3.918   1.062   1.542
   90   1HG1  VAL  11          1HG1      VAL  11  -3.485   3.472   1.544
   91   2HG1  VAL  11          2HG1      VAL  11  -3.621   2.854   3.208
   92   3HG1  VAL  11          3HG1      VAL  11  -2.019   3.222   2.522
   93   1HG2  VAL  11          1HG2      VAL  11  -1.539   2.288   0.370
   94   2HG2  VAL  11          2HG2      VAL  11  -1.379   0.524   0.547
   95   3HG2  VAL  11          3HG2      VAL  11  -2.749   1.207  -0.363
   96    H    LEU  12           H        LEU  12  -1.618   0.167   5.314
   97    HA   LEU  12           HA       LEU  12  -4.237  -0.585   6.234
   98   1HB   LEU  12          1HB       LEU  12  -3.161  -1.531   7.926
   99   2HB   LEU  12          2HB       LEU  12  -1.727  -1.290   6.946
  100    HG   LEU  12           HG       LEU  12  -1.210  -0.587   9.155
  101   1HD1  LEU  12          1HD1      LEU  12  -0.016   1.058   8.271
  102   2HD1  LEU  12          2HD1      LEU  12  -1.198   1.258   6.956
  103   3HD1  LEU  12          3HD1      LEU  12  -1.404   2.151   8.481
  104   1HD2  LEU  12          1HD2      LEU  12  -2.721   0.174  10.588
  105   2HD2  LEU  12          2HD2      LEU  12  -2.979   1.630   9.597
  106   3HD2  LEU  12          3HD2      LEU  12  -3.935   0.160   9.286
  107    H    LEU  13           H        LEU  13  -5.564   0.592   7.677
  108    HA   LEU  13           HA       LEU  13  -4.868   3.443   7.806
  109   1HB   LEU  13          1HB       LEU  13  -6.701   3.353   6.417
  110   2HB   LEU  13          2HB       LEU  13  -7.426   2.002   7.264
  111    HG   LEU  13           HG       LEU  13  -7.190   4.638   8.676
  112   1HD1  LEU  13          1HD1      LEU  13  -9.306   3.975   6.612
  113   2HD1  LEU  13          2HD1      LEU  13  -9.370   5.337   7.755
  114   3HD1  LEU  13          3HD1      LEU  13  -8.092   5.272   6.519
  115   1HD2  LEU  13          1HD2      LEU  13  -9.529   2.764   8.784
  116   2HD2  LEU  13          2HD2      LEU  13  -8.024   2.358   9.644
  117   3HD2  LEU  13          3HD2      LEU  13  -8.889   3.866  10.027
  118    H    CYS  14           H        CYS  14  -4.995   4.503   9.785
  119    HA   CYS  14           HA       CYS  14  -5.187   2.702  12.052
  120   1HB   CYS  14          1HB       CYS  14  -3.768   5.223  11.475
  121   2HB   CYS  14          2HB       CYS  14  -4.473   5.155  13.077
  122    HG   CYS  14           HG       CYS  14  -2.492   4.100  13.891
  123    H    GLN  15           H        GLN  15  -6.394   3.588  14.039
  124    HA   GLN  15           HA       GLN  15  -9.010   4.058  13.380
  125   1HB   GLN  15          1HB       GLN  15  -8.125   3.149  15.564
  126   2HB   GLN  15          2HB       GLN  15  -7.629   4.770  16.006
  127   1HG   GLN  15          1HG       GLN  15  -9.762   4.520  17.030
  128   2HG   GLN  15          2HG       GLN  15 -10.088   5.480  15.601
  129   1HE2  GLN  15          1HE2      GLN  15 -10.971   2.821  17.369
  130   2HE2  GLN  15          2HE2      GLN  15 -11.912   1.952  16.204
  131    H    ASP  16           H        ASP  16  -6.446   6.374  14.477
  132    HA   ASP  16           HA       ASP  16  -7.994   8.597  14.665
  133   1HB   ASP  16          1HB       ASP  16  -5.203   7.950  14.537
  134   2HB   ASP  16          2HB       ASP  16  -5.458   9.263  13.405
  135    H    GLY  17           H        GLY  17  -6.812   6.817  11.830
  136   1HA   GLY  17          1HA       GLY  17  -7.934   7.021   9.756
  137   2HA   GLY  17          2HA       GLY  17  -8.215   8.723  10.074
  138    H    SER  18           H        SER  18  -5.225   6.664  10.312
  139    HA   SER  18           HA       SER  18  -3.912   8.693   8.702
  140   1HB   SER  18          1HB       SER  18  -3.165   7.424  11.083
  141   2HB   SER  18          2HB       SER  18  -2.204   6.592   9.875
  142    HG   SER  18           HG       SER  18  -2.313   9.426   9.682
  143    H    PHE  19           H        PHE  19  -3.669   8.229   6.549
  144    HA   PHE  19           HA       PHE  19  -3.966   5.490   5.688
  145   1HB   PHE  19          1HB       PHE  19  -3.808   8.293   4.511
  146   2HB   PHE  19          2HB       PHE  19  -3.482   6.947   3.435
  147    HD1  PHE  19           HD1      PHE  19  -5.915   9.129   4.123
  148    HD2  PHE  19           HD2      PHE  19  -5.374   4.921   4.096
  149    HE1  PHE  19           HE1      PHE  19  -8.380   8.815   3.767
  150    HE2  PHE  19           HE2      PHE  19  -7.839   4.606   3.739
  151    HZ   PHE  19           HZ       PHE  19  -9.313   6.557   3.580
  152    H    TYR  20           H        TYR  20  -2.164   4.217   5.939
  153    HA   TYR  20           HA       TYR  20   0.296   5.244   4.719
  154   1HB   TYR  20          1HB       TYR  20   0.068   5.283   7.364
  155   2HB   TYR  20          2HB       TYR  20   0.093   3.533   7.262
  156    HD1  TYR  20           HD1      TYR  20   2.084   6.530   6.210
  157    HD2  TYR  20           HD2      TYR  20   2.138   2.405   7.346
  158    HE1  TYR  20           HE1      TYR  20   4.626   6.558   6.222
  159    HE2  TYR  20           HE2      TYR  20   4.679   2.448   7.354
  160    HH   TYR  20           HH       TYR  20   6.433   5.417   7.099
  161    H    GLY  21           H        GLY  21   1.628   3.644   3.736
  162   1HA   GLY  21          1HA       GLY  21   1.016   0.861   3.939
  163   2HA   GLY  21          2HA       GLY  21   0.371   1.558   2.466
  164    H    GLY  22           H        GLY  22   2.284  -0.378   2.164
  165   1HA   GLY  22          1HA       GLY  22   4.276   0.919   0.656
  166   2HA   GLY  22          2HA       GLY  22   4.957   0.445   2.200
  167    H    TYR  23           H        TYR  23   5.893  -0.689  -0.206
  168    HA   TYR  23           HA       TYR  23   4.647  -3.343  -0.263
  169   1HB   TYR  23          1HB       TYR  23   5.665  -3.436  -2.468
  170   2HB   TYR  23          2HB       TYR  23   5.111  -1.779  -2.329
  171    HD1  TYR  23           HD1      TYR  23   8.021  -3.973  -2.552
  172    HD2  TYR  23           HD2      TYR  23   6.734   0.058  -1.928
  173    HE1  TYR  23           HE1      TYR  23  10.378  -3.140  -3.020
  174    HE2  TYR  23           HE2      TYR  23   9.094   0.877  -2.398
  175    HH   TYR  23           HH       TYR  23  11.746  -1.233  -2.498
  176    H    THR  24           H        THR  24   5.727  -5.160   0.421
  177    HA   THR  24           HA       THR  24   8.549  -5.278   0.602
  178    HB   THR  24           HB       THR  24   7.628  -3.744   2.610
  179    HG1  THR  24           HG1      THR  24   9.725  -4.244   3.097
  180   1HG2  THR  24          1HG2      THR  24   7.200  -5.031   4.626
  181   2HG2  THR  24          2HG2      THR  24   6.055  -5.631   3.404
  182   3HG2  THR  24          3HG2      THR  24   7.523  -6.566   3.785
  183    H    THR  25           H        THR  25   9.085  -7.318   2.173
  184    HA   THR  25           HA       THR  25   7.116  -9.358   1.372
  185    HB   THR  25           HB       THR  25   8.881 -10.642   0.586
  186    HG1  THR  25           HG1      THR  25  10.432  -9.228   2.642
  187   1HG2  THR  25          1HG2      THR  25  10.592  -9.364  -0.463
  188   2HG2  THR  25          2HG2      THR  25   9.267  -8.185  -0.313
  189   3HG2  THR  25          3HG2      THR  25  10.618  -8.159   0.847
  190    H    GLU  26           H        GLU  26   6.232 -10.637   2.896
  191    HA   GLU  26           HA       GLU  26   5.855 -11.572   4.824
  192   1HB   GLU  26          1HB       GLU  26   8.754 -11.204   4.919
  193   2HB   GLU  26          2HB       GLU  26   8.065 -11.068   6.524
  194   1HG   GLU  26          1HG       GLU  26   6.802 -13.283   5.115
  195   2HG   GLU  26          2HG       GLU  26   8.544 -13.457   5.030
  196    HA   PRO  27           HA       PRO  27   4.967  -7.421   6.473
  197   1HB   PRO  27          1HB       PRO  27   2.279  -7.375   5.978
  198   2HB   PRO  27          2HB       PRO  27   3.465  -6.675   4.895
  199   1HG   PRO  27          1HG       PRO  27   1.945  -9.194   4.602
  200   2HG   PRO  27          2HG       PRO  27   2.793  -8.274   3.373
  201   1HD   PRO  27          1HD       PRO  27   3.683 -10.698   4.623
  202   2HD   PRO  27          2HD       PRO  27   4.580  -9.717   3.482
  203    H    GLU  28           H        GLU  28   3.498 -10.520   6.880
  204    HA   GLU  28           HA       GLU  28   2.032  -9.991   9.126
  205   1HB   GLU  28          1HB       GLU  28   3.499 -12.480   8.184
  206   2HB   GLU  28          2HB       GLU  28   2.536 -12.490   9.648
  207   1HG   GLU  28          1HG       GLU  28   1.148 -11.260   7.330
  208   2HG   GLU  28          2HG       GLU  28   1.562 -12.945   7.082
  209    H    ARG  29           H        ARG  29   5.511 -10.962   8.824
  210    HA   ARG  29           HA       ARG  29   5.879 -10.908  11.614
  211   1HB   ARG  29          1HB       ARG  29   7.552 -11.344   9.178
  212   2HB   ARG  29          2HB       ARG  29   8.427 -10.694  10.550
  213   1HG   ARG  29          1HG       ARG  29   8.586 -13.039  10.859
  214   2HG   ARG  29          2HG       ARG  29   7.297 -12.572  11.952
  215   1HD   ARG  29          1HD       ARG  29   6.036 -13.054   9.436
  216   2HD   ARG  29          2HD       ARG  29   7.183 -14.362   9.649
  217    HE   ARG  29           HE       ARG  29   5.584 -13.789  12.046
  218   1HH1  ARG  29          1HH1      ARG  29   5.773 -15.632   9.054
  219   2HH1  ARG  29          2HH1      ARG  29   4.674 -16.859   9.591
  220   1HH2  ARG  29          1HH2      ARG  29   4.135 -15.406  12.756
  221   2HH2  ARG  29          2HH2      ARG  29   3.737 -16.730  11.711
  222    H    ARG  30           H        ARG  30   6.781  -8.734   8.848
  223    HA   ARG  30           HA       ARG  30   8.176  -6.886  10.262
  224   1HB   ARG  30          1HB       ARG  30   7.930  -6.956   7.762
  225   2HB   ARG  30          2HB       ARG  30   6.281  -6.386   7.911
  226   1HG   ARG  30          1HG       ARG  30   8.024  -4.616   9.416
  227   2HG   ARG  30          2HG       ARG  30   8.677  -4.818   7.801
  228   1HD   ARG  30          1HD       ARG  30   6.020  -4.483   7.193
  229   2HD   ARG  30          2HD       ARG  30   6.111  -3.538   8.666
  230    HE   ARG  30           HE       ARG  30   7.391  -2.911   6.103
  231   1HH1  ARG  30          1HH1      ARG  30   7.440  -2.334   9.575
  232   2HH1  ARG  30          2HH1      ARG  30   8.265  -0.818   9.441
  233   1HH2  ARG  30          1HH2      ARG  30   8.480  -0.909   5.925
  234   2HH2  ARG  30          2HH2      ARG  30   8.861  -0.001   7.351
  235    H    LEU  31           H        LEU  31   4.650  -7.378   9.960
  236    HA   LEU  31           HA       LEU  31   3.952  -4.863  11.094
  237   1HB   LEU  31          1HB       LEU  31   2.384  -5.830   9.659
  238   2HB   LEU  31          2HB       LEU  31   2.490  -7.399  10.430
  239    HG   LEU  31           HG       LEU  31   1.334  -6.529  12.415
  240   1HD1  LEU  31          1HD1      LEU  31   0.715  -3.970  10.969
  241   2HD1  LEU  31          2HD1      LEU  31   0.620  -4.351  12.706
  242   3HD1  LEU  31          3HD1      LEU  31   2.206  -4.121  11.932
  243   1HD2  LEU  31          1HD2      LEU  31   0.062  -7.548  10.563
  244   2HD2  LEU  31          2HD2      LEU  31  -0.878  -6.321  11.446
  245   3HD2  LEU  31          3HD2      LEU  31  -0.177  -5.932   9.856
  246    H    THR  32           H        THR  32   3.716  -8.269  12.357
  247    HA   THR  32           HA       THR  32   3.066  -7.649  14.942
  248    HB   THR  32           HB       THR  32   4.676  -9.890  13.642
  249    HG1  THR  32           HG1      THR  32   2.588 -10.852  13.897
  250   1HG2  THR  32          1HG2      THR  32   3.859 -11.066  15.900
  251   2HG2  THR  32          2HG2      THR  32   5.422 -10.218  15.858
  252   3HG2  THR  32          3HG2      THR  32   3.994  -9.418  16.558
  253    H    GLU  33           H        GLU  33   6.423  -8.059  13.628
  254    HA   GLU  33           HA       GLU  33   7.832  -7.653  15.836
  255   1HB   GLU  33          1HB       GLU  33   8.225  -7.036  12.966
  256   2HB   GLU  33          2HB       GLU  33   9.243  -6.084  14.028
  257   1HG   GLU  33          1HG       GLU  33   9.269  -8.781  15.028
  258   2HG   GLU  33          2HG       GLU  33   9.514  -8.873  13.295
  259    H    HIS  34           H        HIS  34   6.747  -4.924  13.678
  260    HA   HIS  34           HA       HIS  34   7.607  -2.841  15.136
  261   1HB   HIS  34          1HB       HIS  34   6.557  -2.567  12.992
  262   2HB   HIS  34          2HB       HIS  34   5.023  -3.162  13.595
  263    HD1  HIS  34           HD1      HIS  34   3.381  -1.346  14.047
  264    HD2  HIS  34           HD2      HIS  34   7.333  -0.058  14.613
  265    HE1  HIS  34           HE1      HIS  34   3.245   1.121  14.680
  266    H    ASN  35           H        ASN  35   4.389  -4.480  15.560
  267    HA   ASN  35           HA       ASN  35   3.501  -3.000  17.636
  268   1HB   ASN  35          1HB       ASN  35   2.861  -5.522  16.407
  269   2HB   ASN  35          2HB       ASN  35   2.882  -5.806  18.137
  270   1HD2  ASN  35          1HD2      ASN  35   1.245  -4.427  15.485
  271   2HD2  ASN  35          2HD2      ASN  35  -0.100  -3.720  16.315
  272    H    SER  36           H        SER  36   5.454  -6.076  17.721
  273    HA   SER  36           HA       SER  36   5.878  -5.687  20.545
  274   1HB   SER  36          1HB       SER  36   5.658  -7.944  18.851
  275   2HB   SER  36          2HB       SER  36   7.339  -7.920  19.342
  276    HG   SER  36           HG       SER  36   5.190  -8.719  20.782
  277    H    GLY  37           H        GLY  37   7.008  -3.619  19.008
  278   1HA   GLY  37          1HA       GLY  37   9.830  -4.275  18.612
  279   2HA   GLY  37          2HA       GLY  37   9.004  -2.794  18.169
  280    H    THR  38           H        THR  38   9.605  -1.042  19.354
  281    HA   THR  38           HA       THR  38  11.105  -1.309  21.727
  282    HB   THR  38           HB       THR  38  11.207   0.573  20.019
  283    HG1  THR  38           HG1      THR  38  11.411   2.127  21.812
  284   1HG2  THR  38          1HG2      THR  38   9.434   2.438  20.916
  285   2HG2  THR  38          2HG2      THR  38   9.091   1.407  19.506
  286   3HG2  THR  38          3HG2      THR  38   8.430   0.982  21.102
  287    H    GLY  39           H        GLY  39  10.521  -0.210  23.833
  288   1HA   GLY  39          1HA       GLY  39   7.663  -0.415  24.458
  289   2HA   GLY  39          2HA       GLY  39   8.776  -1.455  25.321
  290    H    ALA  40           H        ALA  40   7.630   1.856  24.847
  291    HA   ALA  40           HA       ALA  40   9.054   2.601  27.292
  292   1HB   ALA  40          1HB       ALA  40  10.480   3.584  25.703
  293   2HB   ALA  40          2HB       ALA  40   9.140   3.974  24.599
  294   3HB   ALA  40          3HB       ALA  40   9.352   4.902  26.102
  295    H    LYS  41           H        LYS  41   6.593   3.528  24.790
  296    HA   LYS  41           HA       LYS  41   5.189   5.308  26.373
  297   1HB   LYS  41          1HB       LYS  41   5.048   4.481  23.799
  298   2HB   LYS  41          2HB       LYS  41   3.654   3.643  24.448
  299   1HG   LYS  41          1HG       LYS  41   3.369   6.145  25.608
  300   2HG   LYS  41          2HG       LYS  41   4.100   6.562  24.070
  301   1HD   LYS  41          1HD       LYS  41   2.191   4.671  23.319
  302   2HD   LYS  41          2HD       LYS  41   1.391   5.497  24.642
  303   1HE   LYS  41          1HE       LYS  41   2.632   7.539  23.069
  304   2HE   LYS  41          2HE       LYS  41   1.877   6.441  21.931
  305   1HZ   LYS  41          1HZ       LYS  41   0.172   7.819  22.491
  306   2HZ   LYS  41          2HZ       LYS  41  -0.087   6.615  23.564
  307   3HZ   LYS  41          3HZ       LYS  41   0.633   8.000  24.048
  308    H    TYR  42           H        TYR  42   2.579   4.578  26.682
  309    HA   TYR  42           HA       TYR  42   2.581   3.227  29.085
  310   1HB   TYR  42          1HB       TYR  42   0.505   3.641  26.848
  311   2HB   TYR  42          2HB       TYR  42   0.054   3.025  28.426
  312    HD1  TYR  42           HD1      TYR  42   0.548   5.953  26.455
  313    HD2  TYR  42           HD2      TYR  42   0.643   4.516  30.483
  314    HE1  TYR  42           HE1      TYR  42   0.290   8.331  27.317
  315    HE2  TYR  42           HE2      TYR  42   0.385   6.900  31.332
  316    HH   TYR  42           HH       TYR  42  -0.681   9.072  30.295
  317    H    THR  43           H        THR  43   0.614   1.284  29.095
  318    HA   THR  43           HA       THR  43   0.715  -0.699  27.204
  319    HB   THR  43           HB       THR  43   3.072  -1.010  27.426
  320    HG1  THR  43           HG1      THR  43   1.897  -3.003  27.789
  321   1HG2  THR  43          1HG2      THR  43   4.177  -0.196  29.251
  322   2HG2  THR  43          2HG2      THR  43   2.635   0.035  30.112
  323   3HG2  THR  43          3HG2      THR  43   3.484  -1.527  30.210
  324    H    ARG  44           H        ARG  44   0.649   0.204  30.651
  325    HA   ARG  44           HA       ARG  44  -0.588  -2.044  31.595
  326   1HB   ARG  44          1HB       ARG  44  -1.428  -0.532  33.436
  327   2HB   ARG  44          2HB       ARG  44   0.278  -0.314  33.098
  328   1HG   ARG  44          1HG       ARG  44  -0.035   1.861  32.521
  329   2HG   ARG  44          2HG       ARG  44  -1.290   1.437  31.374
  330   1HD   ARG  44          1HD       ARG  44  -2.571   1.062  33.832
  331   2HD   ARG  44          2HD       ARG  44  -1.544   2.445  34.149
  332    HE   ARG  44           HE       ARG  44  -3.912   2.444  32.525
  333   1HH1  ARG  44          1HH1      ARG  44  -0.666   3.801  32.606
  334   2HH1  ARG  44          2HH1      ARG  44  -1.093   5.204  31.685
  335   1HH2  ARG  44          1HH2      ARG  44  -4.476   4.296  31.309
  336   2HH2  ARG  44          2HH2      ARG  44  -3.273   5.489  30.942
  337    H    LEU  45           H        LEU  45  -1.761   0.443  29.455
  338    HA   LEU  45           HA       LEU  45  -4.521  -0.450  29.916
  339   1HB   LEU  45          1HB       LEU  45  -5.304   1.637  29.422
  340   2HB   LEU  45          2HB       LEU  45  -3.833   2.000  30.302
  341    HG   LEU  45           HG       LEU  45  -3.976   3.497  28.454
  342   1HD1  LEU  45          1HD1      LEU  45  -1.747   2.362  29.025
  343   2HD1  LEU  45          2HD1      LEU  45  -1.971   1.454  27.510
  344   3HD1  LEU  45          3HD1      LEU  45  -1.869   3.230  27.477
  345   1HD2  LEU  45          1HD2      LEU  45  -5.386   1.550  27.162
  346   2HD2  LEU  45          2HD2      LEU  45  -4.757   3.033  26.402
  347   3HD2  LEU  45          3HD2      LEU  45  -3.838   1.513  26.281
  348    H    ALA  46           H        ALA  46  -1.777  -0.584  27.857
  349    HA   ALA  46           HA       ALA  46  -1.466  -1.175  25.733
  350   1HB   ALA  46          1HB       ALA  46  -3.573  -2.978  26.856
  351   2HB   ALA  46          2HB       ALA  46  -3.259  -3.084  25.107
  352   3HB   ALA  46          3HB       ALA  46  -1.937  -3.360  26.267
  353    H    LYS  47           H        LYS  47  -1.847   0.738  24.572
  354    HA   LYS  47           HA       LYS  47  -4.378   1.760  24.037
  355   1HB   LYS  47          1HB       LYS  47  -1.959   2.759  23.792
  356   2HB   LYS  47          2HB       LYS  47  -2.064   2.139  22.157
  357   1HG   LYS  47          1HG       LYS  47  -3.647   3.683  21.524
  358   2HG   LYS  47          2HG       LYS  47  -4.502   3.591  23.052
  359   1HD   LYS  47          1HD       LYS  47  -2.291   4.816  23.969
  360   2HD   LYS  47          2HD       LYS  47  -2.142   5.313  22.296
  361   1HE   LYS  47          1HE       LYS  47  -3.625   6.975  22.740
  362   2HE   LYS  47          2HE       LYS  47  -4.867   5.747  22.886
  363   1HZ   LYS  47          1HZ       LYS  47  -3.364   5.833  25.238
  364   2HZ   LYS  47          2HZ       LYS  47  -3.861   7.346  24.879
  365   3HZ   LYS  47          3HZ       LYS  47  -4.956   6.143  25.034
  366    H    ARG  48           H        ARG  48  -2.183  -0.054  21.770
  367    HA   ARG  48           HA       ARG  48  -2.601  -1.378  20.116
  368   1HB   ARG  48          1HB       ARG  48  -4.857  -1.948  21.966
  369   2HB   ARG  48          2HB       ARG  48  -5.195  -2.395  20.305
  370   1HG   ARG  48          1HG       ARG  48  -3.639  -4.092  20.298
  371   2HG   ARG  48          2HG       ARG  48  -2.480  -3.179  21.245
  372   1HD   ARG  48          1HD       ARG  48  -3.052  -4.521  22.996
  373   2HD   ARG  48          2HD       ARG  48  -4.547  -3.609  23.080
  374    HE   ARG  48           HE       ARG  48  -4.961  -5.554  21.086
  375   1HH1  ARG  48          1HH1      ARG  48  -4.216  -5.524  24.524
  376   2HH1  ARG  48          2HH1      ARG  48  -4.998  -7.037  24.837
  377   1HH2  ARG  48          1HH2      ARG  48  -5.994  -7.550  21.498
  378   2HH2  ARG  48          2HH2      ARG  48  -6.016  -8.197  23.105
  379    H    ARG  49           H        ARG  49  -2.924  -0.634  18.041
  380    HA   ARG  49           HA       ARG  49  -5.307   0.991  17.637
  381   1HB   ARG  49          1HB       ARG  49  -3.986   2.069  15.752
  382   2HB   ARG  49          2HB       ARG  49  -3.312   2.358  17.344
  383   1HG   ARG  49          1HG       ARG  49  -2.244  -0.121  16.196
  384   2HG   ARG  49          2HG       ARG  49  -1.980   1.231  15.111
  385   1HD   ARG  49          1HD       ARG  49  -0.626   2.388  16.646
  386   2HD   ARG  49          2HD       ARG  49  -1.379   1.643  18.041
  387    HE   ARG  49           HE       ARG  49  -0.134  -0.460  16.640
  388   1HH1  ARG  49          1HH1      ARG  49   0.864   2.521  18.219
  389   2HH1  ARG  49          2HH1      ARG  49   2.440   1.929  18.626
  390   1HH2  ARG  49          1HH2      ARG  49   1.945  -1.242  17.176
  391   2HH2  ARG  49          2HH2      ARG  49   3.059  -0.226  18.029
  392    HA   PRO  50           HA       PRO  50  -6.366  -2.084  14.707
  393   1HB   PRO  50          1HB       PRO  50  -8.534  -0.873  13.567
  394   2HB   PRO  50          2HB       PRO  50  -8.615  -1.761  15.075
  395   1HG   PRO  50          1HG       PRO  50  -8.653   1.163  14.642
  396   2HG   PRO  50          2HG       PRO  50  -9.151   0.257  16.057
  397   1HD   PRO  50          1HD       PRO  50  -6.718   1.741  15.739
  398   2HD   PRO  50          2HD       PRO  50  -7.164   0.740  17.107
  399    H    VAL  51           H        VAL  51  -6.076  -2.738  12.577
  400    HA   VAL  51           HA       VAL  51  -5.218  -0.529  10.847
  401    HB   VAL  51           HB       VAL  51  -3.345  -1.773  10.097
  402   1HG1  VAL  51          1HG1      VAL  51  -1.975  -1.456  11.899
  403   2HG1  VAL  51          2HG1      VAL  51  -3.434  -0.654  12.528
  404   3HG1  VAL  51          3HG1      VAL  51  -3.055  -2.323  13.017
  405   1HG2  VAL  51          1HG2      VAL  51  -4.723  -4.047  11.414
  406   2HG2  VAL  51          2HG2      VAL  51  -3.720  -4.003   9.943
  407   3HG2  VAL  51          3HG2      VAL  51  -2.949  -4.030  11.546
  408    H    ILE  52           H        ILE  52  -6.722  -0.421   9.260
  409    HA   ILE  52           HA       ILE  52  -7.816  -2.972   8.308
  410    HB   ILE  52           HB       ILE  52  -9.778  -1.830   7.692
  411   1HG1  ILE  52          1HG1      ILE  52  -8.554   0.824   8.470
  412   2HG1  ILE  52          2HG1      ILE  52  -8.527   0.215   6.828
  413   1HG2  ILE  52          1HG2      ILE  52  -9.681  -0.327  10.146
  414   2HG2  ILE  52          2HG2      ILE  52 -10.531  -1.848   9.777
  415   3HG2  ILE  52          3HG2      ILE  52  -8.846  -1.886  10.350
  416   1HD1  ILE  52          1HD1      ILE  52 -11.001   0.063   6.810
  417   2HD1  ILE  52          2HD1      ILE  52 -11.051   0.626   8.498
  418   3HD1  ILE  52          3HD1      ILE  52 -10.474   1.715   7.215
  419    H    MET  53           H        MET  53  -7.753  -3.477   6.105
  420    HA   MET  53           HA       MET  53  -5.993  -1.712   4.593
  421   1HB   MET  53          1HB       MET  53  -6.293  -4.660   4.899
  422   2HB   MET  53          2HB       MET  53  -6.161  -4.162   3.223
  423   1HG   MET  53          1HG       MET  53  -4.031  -3.065   3.617
  424   2HG   MET  53          2HG       MET  53  -4.212  -3.183   5.356
  425   1HE   MET  53          1HE       MET  53  -1.936  -5.925   5.942
  426   2HE   MET  53          2HE       MET  53  -2.421  -4.224   6.147
  427   3HE   MET  53          3HE       MET  53  -3.470  -5.528   6.754
  428    H    ILE  54           H        ILE  54  -6.984  -0.483   3.058
  429    HA   ILE  54           HA       ILE  54  -9.499  -1.513   1.959
  430    HB   ILE  54           HB       ILE  54 -10.216   0.662   1.669
  431   1HG1  ILE  54          1HG1      ILE  54  -8.194   1.485   0.508
  432   2HG1  ILE  54          2HG1      ILE  54  -8.849   2.642   1.648
  433   1HG2  ILE  54          1HG2      ILE  54  -8.607   0.456   4.216
  434   2HG2  ILE  54          2HG2      ILE  54  -9.657   1.850   3.858
  435   3HG2  ILE  54          3HG2      ILE  54 -10.354   0.215   3.972
  436   1HD1  ILE  54          1HD1      ILE  54  -7.141   1.480   3.340
  437   2HD1  ILE  54          2HD1      ILE  54  -6.318   1.014   1.832
  438   3HD1  ILE  54          3HD1      ILE  54  -6.586   2.733   2.205
  439    H    HIS  55           H        HIS  55  -6.159  -1.075   1.321
  440    HA   HIS  55           HA       HIS  55  -6.725  -1.204  -1.553
  441   1HB   HIS  55          1HB       HIS  55  -4.375   0.062  -0.120
  442   2HB   HIS  55          2HB       HIS  55  -4.443  -0.201  -1.851
  443    HD1  HIS  55           HD1      HIS  55  -6.679   1.002  -3.043
  444    HD2  HIS  55           HD2      HIS  55  -5.356   2.494   0.648
  445    HE1  HIS  55           HE1      HIS  55  -7.668   3.343  -2.823
  446    H    THR  56           H        THR  56  -5.279  -2.599  -2.821
  447    HA   THR  56           HA       THR  56  -3.484  -4.340  -1.424
  448    HB   THR  56           HB       THR  56  -4.926  -6.395  -2.163
  449    HG1  THR  56           HG1      THR  56  -6.770  -4.110  -2.103
  450   1HG2  THR  56          1HG2      THR  56  -6.380  -4.735  -0.082
  451   2HG2  THR  56          2HG2      THR  56  -6.055  -6.485  -0.085
  452   3HG2  THR  56          3HG2      THR  56  -4.743  -5.337   0.271
  453    H    GLU  57           H        GLU  57  -1.808  -4.209  -2.782
  454    HA   GLU  57           HA       GLU  57  -2.435  -4.716  -5.582
  455   1HB   GLU  57          1HB       GLU  57  -0.812  -2.499  -4.363
  456   2HB   GLU  57          2HB       GLU  57  -0.234  -3.181  -5.870
  457   1HG   GLU  57          1HG       GLU  57  -3.025  -2.855  -6.253
  458   2HG   GLU  57          2HG       GLU  57  -2.521  -1.409  -5.399
  459    H    LYS  58           H        LYS  58  -0.680  -5.786  -6.804
  460    HA   LYS  58           HA       LYS  58   1.287  -7.062  -5.039
  461   1HB   LYS  58          1HB       LYS  58  -0.197  -8.475  -7.270
  462   2HB   LYS  58          2HB       LYS  58   0.941  -9.177  -6.139
  463   1HG   LYS  58          1HG       LYS  58  -0.573  -9.134  -4.358
  464   2HG   LYS  58          2HG       LYS  58  -1.432  -7.736  -4.974
  465   1HD   LYS  58          1HD       LYS  58  -1.676  -9.945  -6.863
  466   2HD   LYS  58          2HD       LYS  58  -2.148 -10.484  -5.263
  467   1HE   LYS  58          1HE       LYS  58  -3.783  -8.675  -5.056
  468   2HE   LYS  58          2HE       LYS  58  -3.207  -7.915  -6.526
  469   1HZ   LYS  58          1HZ       LYS  58  -4.446 -10.576  -6.378
  470   2HZ   LYS  58          2HZ       LYS  58  -5.177  -9.217  -6.912
  471   3HZ   LYS  58          3HZ       LYS  58  -3.923  -9.852  -7.745
  472    H    PHE  59           H        PHE  59   3.364  -6.900  -5.737
  473    HA   PHE  59           HA       PHE  59   3.727  -6.156  -8.554
  474   1HB   PHE  59          1HB       PHE  59   4.991  -5.128  -5.951
  475   2HB   PHE  59          2HB       PHE  59   5.742  -4.829  -7.505
  476    HD1  PHE  59           HD1      PHE  59   4.246  -3.059  -5.213
  477    HD2  PHE  59           HD2      PHE  59   3.424  -4.222  -9.209
  478    HE1  PHE  59           HE1      PHE  59   2.816  -1.019  -5.513
  479    HE2  PHE  59           HE2      PHE  59   1.994  -2.183  -9.510
  480    HZ   PHE  59           HZ       PHE  59   1.705  -0.605  -7.658
  481    H    GLU  60           H        GLU  60   5.026  -7.551  -9.644
  482    HA   GLU  60           HA       GLU  60   6.462  -9.487  -8.079
  483   1HB   GLU  60          1HB       GLU  60   6.924 -10.480 -10.402
  484   2HB   GLU  60          2HB       GLU  60   5.248 -10.437  -9.895
  485   1HG   GLU  60          1HG       GLU  60   4.730  -8.591 -11.315
  486   2HG   GLU  60          2HG       GLU  60   6.413  -8.131 -11.487
  487    H    THR  61           H        THR  61   7.041  -6.416  -9.458
  488    HA   THR  61           HA       THR  61   9.939  -6.942  -9.426
  489    HB   THR  61           HB       THR  61  10.096  -5.316 -11.328
  490    HG1  THR  61           HG1      THR  61   8.061  -4.216 -10.719
  491   1HG2  THR  61          1HG2      THR  61   8.226  -6.739 -12.826
  492   2HG2  THR  61          2HG2      THR  61   9.905  -7.262 -12.546
  493   3HG2  THR  61          3HG2      THR  61   8.595  -7.877 -11.510
  494    H    ARG  62           H        ARG  62  11.232  -4.892  -9.071
  495    HA   ARG  62           HA       ARG  62  10.033  -3.612  -6.819
  496   1HB   ARG  62          1HB       ARG  62  12.507  -4.453  -7.076
  497   2HB   ARG  62          2HB       ARG  62  12.775  -2.979  -7.986
  498   1HG   ARG  62          1HG       ARG  62  11.360  -2.189  -5.636
  499   2HG   ARG  62          2HG       ARG  62  12.570  -3.338  -5.098
  500   1HD   ARG  62          1HD       ARG  62  13.532  -1.316  -7.081
  501   2HD   ARG  62          2HD       ARG  62  13.071  -0.667  -5.521
  502    HE   ARG  62           HE       ARG  62  14.688  -2.998  -5.102
  503   1HH1  ARG  62          1HH1      ARG  62  14.962   0.322  -6.236
  504   2HH1  ARG  62          2HH1      ARG  62  16.623   0.479  -5.771
  505   1HH2  ARG  62          1HH2      ARG  62  16.879  -2.792  -4.489
  506   2HH2  ARG  62          2HH2      ARG  62  17.722  -1.306  -4.771
  507    H    SER  63           H        SER  63  11.319  -2.753 -10.087
  508    HA   SER  63           HA       SER  63  11.281  -0.094 -10.021
  509   1HB   SER  63          1HB       SER  63  10.480  -2.067 -12.164
  510   2HB   SER  63          2HB       SER  63  10.314  -0.353 -12.487
  511    HG   SER  63           HG       SER  63  12.622  -1.925 -12.317
  512    H    GLU  64           H        GLU  64   8.411  -2.249 -10.545
  513    HA   GLU  64           HA       GLU  64   6.604  -0.167 -10.880
  514   1HB   GLU  64          1HB       GLU  64   6.542  -2.951 -11.015
  515   2HB   GLU  64          2HB       GLU  64   5.507  -2.618  -9.640
  516   1HG   GLU  64          1HG       GLU  64   3.850  -2.149 -11.120
  517   2HG   GLU  64          2HG       GLU  64   4.723  -0.685 -11.525
  518    H    ALA  65           H        ALA  65   7.455  -2.171  -7.973
  519    HA   ALA  65           HA       ALA  65   5.708  -1.125  -6.171
  520   1HB   ALA  65          1HB       ALA  65   7.689  -1.560  -4.530
  521   2HB   ALA  65          2HB       ALA  65   7.050  -2.926  -5.475
  522   3HB   ALA  65          3HB       ALA  65   8.557  -2.124  -5.977
  523    H    THR  66           H        THR  66   9.078   0.104  -6.797
  524    HA   THR  66           HA       THR  66   8.752   2.402  -5.219
  525    HB   THR  66           HB       THR  66  10.934   1.367  -5.900
  526    HG1  THR  66           HG1      THR  66  10.431   4.034  -7.019
  527   1HG2  THR  66          1HG2      THR  66  10.382   0.844  -8.294
  528   2HG2  THR  66          2HG2      THR  66  10.244   2.587  -8.627
  529   3HG2  THR  66          3HG2      THR  66  11.816   1.890  -8.171
  530    H    LYS  67           H        LYS  67   8.074   1.735  -8.674
  531    HA   LYS  67           HA       LYS  67   7.723   4.345  -9.499
  532   1HB   LYS  67          1HB       LYS  67   7.854   2.443 -11.019
  533   2HB   LYS  67          2HB       LYS  67   6.338   1.808 -10.413
  534   1HG   LYS  67          1HG       LYS  67   5.106   3.747 -11.253
  535   2HG   LYS  67          2HG       LYS  67   6.592   4.580 -11.664
  536   1HD   LYS  67          1HD       LYS  67   6.068   3.717 -13.754
  537   2HD   LYS  67          2HD       LYS  67   7.031   2.388 -13.142
  538   1HE   LYS  67          1HE       LYS  67   5.237   1.048 -13.537
  539   2HE   LYS  67          2HE       LYS  67   4.471   1.809 -12.155
  540   1HZ   LYS  67          1HZ       LYS  67   3.394   3.319 -13.536
  541   2HZ   LYS  67          2HZ       LYS  67   4.341   3.002 -14.827
  542   3HZ   LYS  67          3HZ       LYS  67   3.250   1.896 -14.323
  543    H    ALA  68           H        ALA  68   5.339   2.037  -8.042
  544    HA   ALA  68           HA       ALA  68   3.137   3.692  -8.157
  545   1HB   ALA  68          1HB       ALA  68   4.004   1.514  -6.229
  546   2HB   ALA  68          2HB       ALA  68   2.408   2.296  -6.133
  547   3HB   ALA  68          3HB       ALA  68   2.870   1.391  -7.595
  548    H    GLU  69           H        GLU  69   5.763   3.459  -5.687
  549    HA   GLU  69           HA       GLU  69   4.657   5.148  -3.845
  550   1HB   GLU  69          1HB       GLU  69   7.380   4.165  -4.515
  551   2HB   GLU  69          2HB       GLU  69   7.361   5.671  -3.621
  552   1HG   GLU  69          1HG       GLU  69   6.013   4.679  -1.836
  553   2HG   GLU  69          2HG       GLU  69   5.765   3.215  -2.767
  554    H    ALA  70           H        ALA  70   6.989   5.953  -6.519
  555    HA   ALA  70           HA       ALA  70   7.309   8.589  -6.172
  556   1HB   ALA  70          1HB       ALA  70   6.905   8.408  -8.910
  557   2HB   ALA  70          2HB       ALA  70   8.416   8.007  -8.057
  558   3HB   ALA  70          3HB       ALA  70   7.248   6.723  -8.450
  559    H    ALA  71           H        ALA  71   4.599   7.198  -8.168
  560    HA   ALA  71           HA       ALA  71   3.242   9.591  -8.469
  561   1HB   ALA  71          1HB       ALA  71   1.281   7.635  -8.493
  562   2HB   ALA  71          2HB       ALA  71   2.305   8.088  -9.876
  563   3HB   ALA  71          3HB       ALA  71   2.760   6.709  -8.847
  564    H    PHE  72           H        PHE  72   2.755   6.943  -6.029
  565    HA   PHE  72           HA       PHE  72   0.671   7.923  -4.650
  566   1HB   PHE  72          1HB       PHE  72   3.021   6.220  -4.245
  567   2HB   PHE  72          2HB       PHE  72   2.724   7.111  -2.765
  568    HD1  PHE  72           HD1      PHE  72   1.852   5.534  -1.296
  569    HD2  PHE  72           HD2      PHE  72   0.266   5.775  -5.223
  570    HE1  PHE  72           HE1      PHE  72   0.057   3.897  -0.670
  571    HE2  PHE  72           HE2      PHE  72  -1.530   4.137  -4.599
  572    HZ   PHE  72           HZ       PHE  72  -1.613   3.218  -2.330
  573    H    LYS  73           H        LYS  73   4.145   8.839  -4.104
  574    HA   LYS  73           HA       LYS  73   3.796  10.545  -2.009
  575   1HB   LYS  73          1HB       LYS  73   5.731  10.651  -4.335
  576   2HB   LYS  73          2HB       LYS  73   5.844  11.718  -2.950
  577   1HG   LYS  73          1HG       LYS  73   6.213   9.889  -1.428
  578   2HG   LYS  73          2HG       LYS  73   5.679   8.699  -2.600
  579   1HD   LYS  73          1HD       LYS  73   7.743   8.559  -3.559
  580   2HD   LYS  73          2HD       LYS  73   7.913  10.302  -3.644
  581   1HE   LYS  73          1HE       LYS  73   8.080   9.355  -0.866
  582   2HE   LYS  73          2HE       LYS  73   9.269   8.559  -1.878
  583   1HZ   LYS  73          1HZ       LYS  73   9.495  11.030  -0.852
  584   2HZ   LYS  73          2HZ       LYS  73  10.394  10.436  -2.079
  585   3HZ   LYS  73          3HZ       LYS  73   9.075  11.344  -2.399
  586    H    LYS  74           H        LYS  74   3.142  11.092  -5.492
  587    HA   LYS  74           HA       LYS  74   2.536  13.865  -5.036
  588   1HB   LYS  74          1HB       LYS  74   2.921  12.074  -7.326
  589   2HB   LYS  74          2HB       LYS  74   1.591  13.190  -7.553
  590   1HG   LYS  74          1HG       LYS  74   3.239  14.645  -8.206
  591   2HG   LYS  74          2HG       LYS  74   3.439  14.902  -6.485
  592   1HD   LYS  74          1HD       LYS  74   5.625  14.345  -6.945
  593   2HD   LYS  74          2HD       LYS  74   5.022  12.712  -6.747
  594   1HE   LYS  74          1HE       LYS  74   4.640  13.815  -9.485
  595   2HE   LYS  74          2HE       LYS  74   6.319  13.659  -9.009
  596   1HZ   LYS  74          1HZ       LYS  74   4.678  11.406  -8.349
  597   2HZ   LYS  74          2HZ       LYS  74   4.849  11.668  -9.952
  598   3HZ   LYS  74          3HZ       LYS  74   6.169  11.451  -9.015
  599    H    LEU  75           H        LEU  75   0.874  10.748  -5.056
  600    HA   LEU  75           HA       LEU  75  -1.725  11.945  -5.311
  601   1HB   LEU  75          1HB       LEU  75  -0.915   9.135  -4.552
  602   2HB   LEU  75          2HB       LEU  75  -2.532   9.670  -4.965
  603    HG   LEU  75           HG       LEU  75  -0.188   9.818  -6.876
  604   1HD1  LEU  75          1HD1      LEU  75  -2.146   7.797  -7.542
  605   2HD1  LEU  75          2HD1      LEU  75  -0.379   7.662  -7.369
  606   3HD1  LEU  75          3HD1      LEU  75  -1.429   7.487  -5.942
  607   1HD2  LEU  75          1HD2      LEU  75  -2.249  11.320  -7.175
  608   2HD2  LEU  75          2HD2      LEU  75  -1.724  10.335  -8.561
  609   3HD2  LEU  75          3HD2      LEU  75  -3.119   9.821  -7.581
  610    H    THR  76           H        THR  76  -3.369  11.938  -3.631
  611    HA   THR  76           HA       THR  76  -2.164  12.069  -0.945
  612    HB   THR  76           HB       THR  76  -2.880  14.274  -1.938
  613    HG1  THR  76           HG1      THR  76  -4.042  14.742   0.018
  614   1HG2  THR  76          1HG2      THR  76  -4.931  14.548  -2.914
  615   2HG2  THR  76          2HG2      THR  76  -5.142  12.783  -2.825
  616   3HG2  THR  76          3HG2      THR  76  -5.740  13.818  -1.508
  617    H    ARG  77           H        ARG  77  -4.474  12.201   0.578
  618    HA   ARG  77           HA       ARG  77  -5.061   9.517   0.770
  619   1HB   ARG  77          1HB       ARG  77  -6.589  10.162   2.535
  620   2HB   ARG  77          2HB       ARG  77  -5.260  11.304   2.590
  621   1HG   ARG  77          1HG       ARG  77  -7.065  12.467   0.764
  622   2HG   ARG  77          2HG       ARG  77  -8.105  11.781   1.997
  623   1HD   ARG  77          1HD       ARG  77  -5.727  13.199   3.088
  624   2HD   ARG  77          2HD       ARG  77  -6.819  14.235   2.190
  625    HE   ARG  77           HE       ARG  77  -8.338  12.553   3.965
  626   1HH1  ARG  77          1HH1      ARG  77  -6.194  15.343   3.996
  627   2HH1  ARG  77          2HH1      ARG  77  -6.868  16.007   5.447
  628   1HH2  ARG  77          1HH2      ARG  77  -9.228  13.428   5.881
  629   2HH2  ARG  77          2HH2      ARG  77  -8.607  14.909   6.526
  630    H    LYS  78           H        LYS  78  -6.182  11.851  -1.466
  631    HA   LYS  78           HA       LYS  78  -8.735  10.477  -1.846
  632   1HB   LYS  78          1HB       LYS  78  -7.797  13.220  -2.171
  633   2HB   LYS  78          2HB       LYS  78  -8.590  12.631  -3.618
  634   1HG   LYS  78          1HG       LYS  78  -9.848  12.163  -0.894
  635   2HG   LYS  78          2HG       LYS  78 -10.041  13.709  -1.697
  636   1HD   LYS  78          1HD       LYS  78 -10.975  12.542  -3.710
  637   2HD   LYS  78          2HD       LYS  78 -10.792  10.999  -2.897
  638   1HE   LYS  78          1HE       LYS  78 -12.246  12.097  -0.988
  639   2HE   LYS  78          2HE       LYS  78 -12.681  13.277  -2.209
  640   1HZ   LYS  78          1HZ       LYS  78 -12.999  10.369  -2.506
  641   2HZ   LYS  78          2HZ       LYS  78 -14.201  11.416  -2.149
  642   3HZ   LYS  78          3HZ       LYS  78 -13.453  11.494  -3.599
  643    H    GLN  79           H        GLN  79  -6.359  12.019  -4.109
  644    HA   GLN  79           HA       GLN  79  -6.864  10.687  -6.298
  645   1HB   GLN  79          1HB       GLN  79  -4.611  12.078  -5.247
  646   2HB   GLN  79          2HB       GLN  79  -3.974  10.610  -5.959
  647   1HG   GLN  79          1HG       GLN  79  -4.689  11.167  -8.116
  648   2HG   GLN  79          2HG       GLN  79  -6.039  12.125  -7.541
  649   1HE2  GLN  79          1HE2      GLN  79  -5.526  13.867  -8.819
  650   2HE2  GLN  79          2HE2      GLN  79  -4.189  14.924  -8.512
  651    H    LYS  80           H        LYS  80  -5.028   9.345  -3.504
  652    HA   LYS  80           HA       LYS  80  -4.314   6.940  -4.758
  653   1HB   LYS  80          1HB       LYS  80  -4.479   7.908  -1.917
  654   2HB   LYS  80          2HB       LYS  80  -4.189   6.211  -2.238
  655   1HG   LYS  80          1HG       LYS  80  -2.051   6.589  -2.951
  656   2HG   LYS  80          2HG       LYS  80  -2.524   7.960  -3.934
  657   1HD   LYS  80          1HD       LYS  80  -2.173   9.500  -2.224
  658   2HD   LYS  80          2HD       LYS  80  -2.605   8.366  -0.962
  659   1HE   LYS  80          1HE       LYS  80  -0.181   7.529  -2.427
  660   2HE   LYS  80          2HE       LYS  80   0.002   9.110  -1.694
  661   1HZ   LYS  80          1HZ       LYS  80   0.272   6.791  -0.405
  662   2HZ   LYS  80          2HZ       LYS  80  -0.022   8.222   0.324
  663   3HZ   LYS  80          3HZ       LYS  80  -1.254   7.198   0.010
  664    H    GLU  81           H        GLU  81  -6.896   7.552  -2.268
  665    HA   GLU  81           HA       GLU  81  -8.090   5.205  -2.241
  666   1HB   GLU  81          1HB       GLU  81  -8.884   7.106  -0.928
  667   2HB   GLU  81          2HB       GLU  81  -9.441   7.934  -2.369
  668   1HG   GLU  81          1HG       GLU  81 -11.446   6.987  -1.666
  669   2HG   GLU  81          2HG       GLU  81 -10.878   5.715  -2.730
  670    H    GLN  82           H        GLN  82  -8.786   7.768  -4.722
  671    HA   GLN  82           HA       GLN  82 -10.534   6.101  -6.148
  672   1HB   GLN  82          1HB       GLN  82  -9.434   8.819  -6.372
  673   2HB   GLN  82          2HB       GLN  82  -9.609   8.057  -7.940
  674   1HG   GLN  82          1HG       GLN  82 -11.814   8.258  -5.834
  675   2HG   GLN  82          2HG       GLN  82 -11.678   9.284  -7.248
  676   1HE2  GLN  82          1HE2      GLN  82 -13.552   7.074  -6.176
  677   2HE2  GLN  82          2HE2      GLN  82 -13.865   6.069  -7.551
  678    H    TYR  83           H        TYR  83  -7.143   7.243  -6.808
  679    HA   TYR  83           HA       TYR  83  -6.542   6.101  -9.112
  680   1HB   TYR  83          1HB       TYR  83  -4.839   7.200  -7.775
  681   2HB   TYR  83          2HB       TYR  83  -5.165   6.187  -6.383
  682    HD1  TYR  83           HD1      TYR  83  -3.168   5.110  -5.849
  683    HD2  TYR  83           HD2      TYR  83  -4.414   5.258  -9.939
  684    HE1  TYR  83           HE1      TYR  83  -1.232   3.597  -6.502
  685    HE2  TYR  83           HE2      TYR  83  -2.473   3.746 -10.577
  686    HH   TYR  83           HH       TYR  83   0.010   3.356  -9.269
  687    H    LEU  84           H        LEU  84  -6.501   4.272  -5.969
  688    HA   LEU  84           HA       LEU  84  -5.944   1.814  -7.249
  689   1HB   LEU  84          1HB       LEU  84  -6.933   2.533  -4.491
  690   2HB   LEU  84          2HB       LEU  84  -6.599   0.887  -4.994
  691    HG   LEU  84           HG       LEU  84  -4.276   2.282  -5.674
  692   1HD1  LEU  84          1HD1      LEU  84  -3.987   4.034  -4.348
  693   2HD1  LEU  84          2HD1      LEU  84  -5.636   3.814  -3.713
  694   3HD1  LEU  84          3HD1      LEU  84  -4.261   3.021  -2.909
  695   1HD2  LEU  84          1HD2      LEU  84  -5.126   0.166  -3.872
  696   2HD2  LEU  84          2HD2      LEU  84  -3.626   0.336  -4.815
  697   3HD2  LEU  84          3HD2      LEU  84  -3.760   1.095  -3.210
  698    H    LYS  85           H        LYS  85  -8.936   3.466  -6.110
  699    HA   LYS  85           HA       LYS  85 -10.716   1.413  -6.424
  700   1HB   LYS  85          1HB       LYS  85 -10.909   3.974  -5.673
  701   2HB   LYS  85          2HB       LYS  85 -11.531   4.149  -7.303
  702   1HG   LYS  85          1HG       LYS  85 -12.728   1.783  -6.170
  703   2HG   LYS  85          2HG       LYS  85 -12.865   3.063  -4.979
  704   1HD   LYS  85          1HD       LYS  85 -14.095   4.478  -6.454
  705   2HD   LYS  85          2HD       LYS  85 -13.576   3.605  -7.881
  706   1HE   LYS  85          1HE       LYS  85 -15.313   2.144  -7.729
  707   2HE   LYS  85          2HE       LYS  85 -14.971   1.803  -6.044
  708   1HZ   LYS  85          1HZ       LYS  85 -17.125   2.859  -6.417
  709   2HZ   LYS  85          2HZ       LYS  85 -16.176   3.735  -5.418
  710   3HZ   LYS  85          3HZ       LYS  85 -16.385   4.206  -6.966
  711    H    THR  86           H        THR  86  -9.539   3.756  -8.927
  712    HA   THR  86           HA       THR  86 -11.036   2.986 -11.052
  713    HB   THR  86           HB       THR  86  -8.959   4.679 -10.643
  714    HG1  THR  86           HG1      THR  86 -10.464   4.664 -12.452
  715   1HG2  THR  86          1HG2      THR  86  -7.385   2.549 -10.838
  716   2HG2  THR  86          2HG2      THR  86  -7.764   2.662 -12.574
  717   3HG2  THR  86          3HG2      THR  86  -6.966   4.021 -11.748
  718    H    PHE  87           H        PHE  87  -8.286   1.211  -9.599
  719    HA   PHE  87           HA       PHE  87  -8.397  -0.759 -11.701
  720   1HB   PHE  87          1HB       PHE  87  -6.213  -0.338 -10.798
  721   2HB   PHE  87          2HB       PHE  87  -6.825  -0.150  -9.167
  722    HD1  PHE  87           HD1      PHE  87  -5.598  -2.493 -11.653
  723    HD2  PHE  87           HD2      PHE  87  -7.365  -2.144  -7.809
  724    HE1  PHE  87           HE1      PHE  87  -4.943  -4.861 -11.135
  725    HE2  PHE  87           HE2      PHE  87  -6.710  -4.512  -7.293
  726    HZ   PHE  87           HZ       PHE  87  -5.507  -5.841  -8.962
  727    H    HIS  88           H        HIS  88  -9.695  -0.222  -8.451
  728    HA   HIS  88           HA       HIS  88 -10.178  -2.898  -7.806
  729   1HB   HIS  88          1HB       HIS  88 -10.164  -1.016  -6.201
  730   2HB   HIS  88          2HB       HIS  88 -11.642  -0.399  -6.911
  731    HD1  HIS  88           HD1      HIS  88 -10.703  -2.076  -4.014
  732    HD2  HIS  88           HD2      HIS  88 -13.633  -2.879  -6.907
  733    HE1  HIS  88           HE1      HIS  88 -12.415  -3.600  -2.894
  734    H    LEU  89           H        LEU  89 -11.963  -0.464  -9.728
  735    HA   LEU  89           HA       LEU  89 -14.431  -1.556  -9.874
  736   1HB   LEU  89          1HB       LEU  89 -12.704  -0.018 -11.735
  737   2HB   LEU  89          2HB       LEU  89 -14.131  -0.770 -12.418
  738    HG   LEU  89           HG       LEU  89 -14.656   1.491 -11.830
  739   1HD1  LEU  89          1HD1      LEU  89 -16.304  -0.418 -11.342
  740   2HD1  LEU  89          2HD1      LEU  89 -15.933  -0.123  -9.626
  741   3HD1  LEU  89          3HD1      LEU  89 -16.633   1.177 -10.624
  742   1HD2  LEU  89          1HD2      LEU  89 -13.761   0.863  -9.003
  743   2HD2  LEU  89          2HD2      LEU  89 -12.865   1.848 -10.184
  744   3HD2  LEU  89          3HD2      LEU  89 -14.448   2.399  -9.584
  745    H    GLU  90           H        GLU  90 -11.742  -2.355 -12.193
  746    HA   GLU  90           HA       GLU  90 -13.174  -4.582 -13.151
  747   1HB   GLU  90          1HB       GLU  90 -10.820  -3.098 -13.862
  748   2HB   GLU  90          2HB       GLU  90 -10.354  -4.783 -13.744
  749   1HG   GLU  90          1HG       GLU  90 -12.666  -5.122 -15.111
  750   2HG   GLU  90          2HG       GLU  90 -12.321  -3.479 -15.615
  751    H    HIS  91           H        HIS  91 -11.859  -6.828 -13.257
  752    HA   HIS  91           HA       HIS  91 -10.557  -7.350 -10.724
  753   1HB   HIS  91          1HB       HIS  91 -12.059  -9.373 -10.399
  754   2HB   HIS  91          2HB       HIS  91 -12.738  -7.805 -10.012
  755    HD1  HIS  91           HD1      HIS  91 -15.107  -9.036 -10.348
  756    HD2  HIS  91           HD2      HIS  91 -12.780  -8.556 -13.804
  757    HE1  HIS  91           HE1      HIS  91 -16.676  -9.414 -12.324
  758    H    HIS  92           H        HIS  92  -8.771  -7.431 -12.351
  759    HA   HIS  92           HA       HIS  92  -8.888  -9.544 -14.273
  760   1HB   HIS  92          1HB       HIS  92  -7.690  -7.634 -14.944
  761   2HB   HIS  92          2HB       HIS  92  -6.811  -7.531 -13.432
  762    HD1  HIS  92           HD1      HIS  92  -4.466  -8.378 -13.528
  763    HD2  HIS  92           HD2      HIS  92  -6.906 -10.170 -16.431
  764    HE1  HIS  92           HE1      HIS  92  -2.943  -9.887 -14.911
  765    H    HIS  93           H        HIS  93  -7.463 -11.427 -14.298
  766    HA   HIS  93           HA       HIS  93  -6.693 -12.202 -11.578
  767   1HB   HIS  93          1HB       HIS  93  -8.673 -13.362 -12.945
  768   2HB   HIS  93          2HB       HIS  93  -7.341 -14.258 -13.650
  769    HD1  HIS  93           HD1      HIS  93  -8.253 -16.431 -12.459
  770    HD2  HIS  93           HD2      HIS  93  -6.981 -13.393  -9.862
  771    HE1  HIS  93           HE1      HIS  93  -8.043 -17.502 -10.153
  772    H    HIS  94           H        HIS  94  -4.986 -14.124 -11.722
  773    HA   HIS  94           HA       HIS  94  -3.327 -14.296 -13.931
  774   1HB   HIS  94          1HB       HIS  94  -3.006 -11.828 -12.673
  775   2HB   HIS  94          2HB       HIS  94  -1.684 -12.790 -12.045
  776    HD1  HIS  94           HD1      HIS  94  -1.103 -10.416 -13.925
  777    HD2  HIS  94           HD2      HIS  94  -1.597 -14.370 -15.235
  778    HE1  HIS  94           HE1      HIS  94   0.087 -10.577 -16.176
  779    H    HIS  95           H        HIS  95  -2.278 -16.211 -13.665
  780    HA   HIS  95           HA       HIS  95  -2.145 -17.224 -10.940
  781   1HB   HIS  95          1HB       HIS  95  -3.338 -18.531 -12.687
  782   2HB   HIS  95          2HB       HIS  95  -1.837 -18.681 -13.579
  783    HD1  HIS  95           HD1      HIS  95  -3.344 -19.689 -10.217
  784    HD2  HIS  95           HD2      HIS  95  -0.226 -20.783 -12.803
  785    HE1  HIS  95           HE1      HIS  95  -2.352 -21.841  -9.270
  786    H    HIS  96           H        HIS  96  -0.117 -17.247 -13.964
  787    HA   HIS  96           HA       HIS  96   2.193 -16.898 -12.200
  788   1HB   HIS  96          1HB       HIS  96   1.622 -19.038 -14.129
  789   2HB   HIS  96          2HB       HIS  96   3.177 -18.275 -14.386
  790    HD1  HIS  96           HD1      HIS  96   2.475 -21.235 -13.149
  791    HD2  HIS  96           HD2      HIS  96   3.899 -17.856 -11.112
  792    HE1  HIS  96           HE1      HIS  96   3.619 -22.102 -11.040
  Start of MODEL    9
    1   1H    MET   1          1H        MET   1  -2.397 -10.269   2.763
    2    HA   MET   1           HA       MET   1  -4.610 -12.020   3.401
    3   1HB   MET   1          1HB       MET   1  -3.959 -10.924   0.737
    4   2HB   MET   1          2HB       MET   1  -3.882 -12.675   0.727
    5   1HG   MET   1          1HG       MET   1  -6.158 -12.926   1.197
    6   2HG   MET   1          2HG       MET   1  -6.253 -11.425   2.096
    7   1HE   MET   1          1HE       MET   1  -5.416  -8.897  -0.237
    8   2HE   MET   1          2HE       MET   1  -7.174  -8.804   0.022
    9   3HE   MET   1          3HE       MET   1  -6.104  -9.319   1.348
   10    H    GLU   2           H        GLU   2  -1.591 -11.951   1.358
   11    HA   GLU   2           HA       GLU   2  -0.092 -13.466   3.081
   12   1HB   GLU   2          1HB       GLU   2  -0.096 -15.671   1.744
   13   2HB   GLU   2          2HB       GLU   2  -1.461 -15.383   2.805
   14   1HG   GLU   2          1HG       GLU   2  -2.586 -14.305   0.674
   15   2HG   GLU   2          2HG       GLU   2  -1.348 -15.163  -0.220
   16    H    ASN   3           H        ASN   3   1.759 -12.409   2.468
   17    HA   ASN   3           HA       ASN   3   2.473 -12.677  -0.334
   18   1HB   ASN   3          1HB       ASN   3   3.187 -10.168   1.231
   19   2HB   ASN   3          2HB       ASN   3   3.161 -10.388  -0.507
   20   1HD2  ASN   3          1HD2      ASN   3   1.051 -10.521   2.350
   21   2HD2  ASN   3          2HD2      ASN   3  -0.364  -9.842   1.616
   22    H    LYS   4           H        LYS   4   4.183 -14.160  -0.052
   23    HA   LYS   4           HA       LYS   4   6.236 -13.378   1.898
   24   1HB   LYS   4          1HB       LYS   4   6.668 -15.749   2.307
   25   2HB   LYS   4          2HB       LYS   4   5.024 -15.317   2.734
   26   1HG   LYS   4          1HG       LYS   4   4.090 -16.533   0.983
   27   2HG   LYS   4          2HG       LYS   4   5.460 -16.272  -0.080
   28   1HD   LYS   4          1HD       LYS   4   6.781 -17.957   1.028
   29   2HD   LYS   4          2HD       LYS   4   5.692 -18.023   2.400
   30   1HE   LYS   4          1HE       LYS   4   4.951 -19.903   1.252
   31   2HE   LYS   4          2HE       LYS   4   3.894 -18.705   0.533
   32   1HZ   LYS   4          1HZ       LYS   4   5.259 -20.235  -0.966
   33   2HZ   LYS   4          2HZ       LYS   4   5.139 -18.657  -1.370
   34   3HZ   LYS   4          3HZ       LYS   4   6.502 -19.218  -0.664
   35    H    LYS   5           H        LYS   5   6.238 -12.301  -0.663
   36    HA   LYS   5           HA       LYS   5   8.750 -13.062  -1.573
   37   1HB   LYS   5          1HB       LYS   5   7.162 -15.051  -2.306
   38   2HB   LYS   5          2HB       LYS   5   6.732 -13.953  -3.602
   39   1HG   LYS   5          1HG       LYS   5   9.642 -14.017  -3.167
   40   2HG   LYS   5          2HG       LYS   5   9.006 -15.617  -3.499
   41   1HD   LYS   5          1HD       LYS   5   8.334 -13.184  -5.215
   42   2HD   LYS   5          2HD       LYS   5   9.698 -14.231  -5.551
   43   1HE   LYS   5          1HE       LYS   5   7.568 -16.034  -5.196
   44   2HE   LYS   5          2HE       LYS   5   6.823 -14.689  -6.039
   45   1HZ   LYS   5          1HZ       LYS   5   9.339 -15.909  -6.926
   46   2HZ   LYS   5          2HZ       LYS   5   7.878 -16.400  -7.465
   47   3HZ   LYS   5          3HZ       LYS   5   8.388 -14.877  -7.760
   48    H    SER   6           H        SER   6   9.535 -11.564  -3.118
   49    HA   SER   6           HA       SER   6   9.614  -9.694  -4.218
   50   1HB   SER   6          1HB       SER   6   7.879  -9.075  -5.703
   51   2HB   SER   6          2HB       SER   6   7.664 -10.803  -5.503
   52    HG   SER   6           HG       SER   6   6.014  -8.674  -4.681
   53    H    HIS   7           H        HIS   7   7.600  -7.508  -4.351
   54    HA   HIS   7           HA       HIS   7   7.410  -6.837  -1.510
   55   1HB   HIS   7          1HB       HIS   7   8.711  -5.312  -3.734
   56   2HB   HIS   7          2HB       HIS   7   7.874  -4.410  -2.485
   57    HD1  HIS   7           HD1      HIS   7  11.030  -6.189  -3.191
   58    HD2  HIS   7           HD2      HIS   7   8.962  -4.841   0.200
   59    HE1  HIS   7           HE1      HIS   7  12.714  -6.204  -1.275
   60    H    TYR   8           H        TYR   8   5.411  -6.134  -0.890
   61    HA   TYR   8           HA       TYR   8   3.566  -5.406  -3.065
   62   1HB   TYR   8          1HB       TYR   8   3.434  -7.112  -0.541
   63   2HB   TYR   8          2HB       TYR   8   1.965  -6.297  -1.042
   64    HD1  TYR   8           HD1      TYR   8   4.675  -8.379  -2.611
   65    HD2  TYR   8           HD2      TYR   8   0.492  -7.519  -2.345
   66    HE1  TYR   8           HE1      TYR   8   4.176 -10.267  -4.239
   67    HE2  TYR   8           HE2      TYR   8   0.007  -9.410  -3.974
   68    HH   TYR   8           HH       TYR   8   1.479 -10.543  -5.904
   69    H    PHE   9           H        PHE   9   2.659  -3.408  -2.933
   70    HA   PHE   9           HA       PHE   9   3.281  -1.831  -0.597
   71   1HB   PHE   9          1HB       PHE   9   3.258  -1.319  -3.260
   72   2HB   PHE   9          2HB       PHE   9   1.560  -0.995  -2.970
   73    HD1  PHE   9           HD1      PHE   9   0.870   1.069  -2.090
   74    HD2  PHE   9           HD2      PHE   9   4.976   0.008  -1.925
   75    HE1  PHE   9           HE1      PHE   9   1.442   3.397  -1.347
   76    HE2  PHE   9           HE2      PHE   9   5.548   2.336  -1.181
   77    HZ   PHE   9           HZ       PHE   9   3.775   4.003  -0.902
   78    H    TYR  10           H        TYR  10   1.917  -1.548   1.098
   79    HA   TYR  10           HA       TYR  10  -0.948  -1.969   0.575
   80   1HB   TYR  10          1HB       TYR  10  -0.912  -2.872   2.971
   81   2HB   TYR  10          2HB       TYR  10   0.059  -3.836   1.875
   82    HD1  TYR  10           HD1      TYR  10   0.401  -0.944   4.240
   83    HD2  TYR  10           HD2      TYR  10   2.240  -4.385   2.482
   84    HE1  TYR  10           HE1      TYR  10   2.420  -0.648   5.757
   85    HE2  TYR  10           HE2      TYR  10   4.253  -4.076   4.005
   86    HH   TYR  10           HH       TYR  10   5.062  -3.008   5.720
   87    H    VAL  11           H        VAL  11  -2.423  -0.658   1.800
   88    HA   VAL  11           HA       VAL  11  -1.116   1.733   2.904
   89    HB   VAL  11           HB       VAL  11  -3.667   1.295   1.371
   90   1HG1  VAL  11          1HG1      VAL  11  -4.374   2.613   3.253
   91   2HG1  VAL  11          2HG1      VAL  11  -2.956   3.680   3.106
   92   3HG1  VAL  11          3HG1      VAL  11  -4.216   3.696   1.848
   93   1HG2  VAL  11          1HG2      VAL  11  -1.722   1.754   0.020
   94   2HG2  VAL  11          2HG2      VAL  11  -2.755   3.204   0.033
   95   3HG2  VAL  11          3HG2      VAL  11  -1.286   3.149   1.036
   96    H    LEU  12           H        LEU  12  -0.874   1.003   5.047
   97    HA   LEU  12           HA       LEU  12  -3.091  -0.204   6.391
   98   1HB   LEU  12          1HB       LEU  12  -0.340   0.700   7.197
   99   2HB   LEU  12          2HB       LEU  12  -1.513   0.183   8.391
  100    HG   LEU  12           HG       LEU  12  -0.449  -1.490   6.099
  101   1HD1  LEU  12          1HD1      LEU  12   1.059  -2.407   7.496
  102   2HD1  LEU  12          2HD1      LEU  12   0.868  -0.878   8.386
  103   3HD1  LEU  12          3HD1      LEU  12  -0.027  -2.328   8.903
  104   1HD2  LEU  12          1HD2      LEU  12  -2.435  -2.535   6.308
  105   2HD2  LEU  12          2HD2      LEU  12  -1.672  -3.263   7.742
  106   3HD2  LEU  12          3HD2      LEU  12  -2.749  -1.858   7.924
  107    H    LEU  13           H        LEU  13  -4.785   0.820   7.308
  108    HA   LEU  13           HA       LEU  13  -4.455   3.697   7.799
  109   1HB   LEU  13          1HB       LEU  13  -6.070   3.517   6.165
  110   2HB   LEU  13          2HB       LEU  13  -6.730   2.029   6.813
  111    HG   LEU  13           HG       LEU  13  -6.994   4.635   8.311
  112   1HD1  LEU  13          1HD1      LEU  13  -8.204   3.969   5.767
  113   2HD1  LEU  13          2HD1      LEU  13  -9.440   4.155   7.034
  114   3HD1  LEU  13          3HD1      LEU  13  -8.289   5.474   6.714
  115   1HD2  LEU  13          1HD2      LEU  13  -9.189   3.314   8.951
  116   2HD2  LEU  13          2HD2      LEU  13  -8.208   1.908   8.474
  117   3HD2  LEU  13          3HD2      LEU  13  -7.640   2.991   9.765
  118    H    CYS  14           H        CYS  14  -4.936   4.539   9.822
  119    HA   CYS  14           HA       CYS  14  -5.570   2.507  11.837
  120   1HB   CYS  14          1HB       CYS  14  -4.377   4.019  13.447
  121   2HB   CYS  14          2HB       CYS  14  -3.349   3.285  12.233
  122    HG   CYS  14           HG       CYS  14  -4.838   6.216  11.874
  123    H    GLN  15           H        GLN  15  -6.409   3.970  13.950
  124    HA   GLN  15           HA       GLN  15  -8.924   4.822  13.166
  125   1HB   GLN  15          1HB       GLN  15  -7.335   5.060  15.738
  126   2HB   GLN  15          2HB       GLN  15  -8.928   5.777  15.608
  127   1HG   GLN  15          1HG       GLN  15  -8.870   3.013  14.578
  128   2HG   GLN  15          2HG       GLN  15  -8.363   3.102  16.252
  129   1HE2  GLN  15          1HE2      GLN  15 -10.715   1.876  15.299
  130   2HE2  GLN  15          2HE2      GLN  15 -12.093   2.691  15.956
  131    H    ASP  16           H        ASP  16  -5.836   6.522  13.584
  132    HA   ASP  16           HA       ASP  16  -6.809   9.078  13.880
  133   1HB   ASP  16          1HB       ASP  16  -4.373   8.121  13.990
  134   2HB   ASP  16          2HB       ASP  16  -4.330   8.385  12.259
  135    H    GLY  17           H        GLY  17  -6.930   6.859  11.213
  136   1HA   GLY  17          1HA       GLY  17  -7.913   7.070   9.184
  137   2HA   GLY  17          2HA       GLY  17  -8.253   8.755   9.525
  138    H    SER  18           H        SER  18  -4.980   7.321   9.771
  139    HA   SER  18           HA       SER  18  -4.194   9.127   7.643
  140   1HB   SER  18          1HB       SER  18  -2.797   7.884  10.003
  141   2HB   SER  18          2HB       SER  18  -1.824   8.301   8.607
  142    HG   SER  18           HG       SER  18  -2.284   9.970  10.441
  143    H    PHE  19           H        PHE  19  -2.882   8.374   5.851
  144    HA   PHE  19           HA       PHE  19  -3.263   5.525   5.352
  145   1HB   PHE  19          1HB       PHE  19  -2.558   7.995   3.661
  146   2HB   PHE  19          2HB       PHE  19  -2.605   6.380   2.981
  147    HD1  PHE  19           HD1      PHE  19  -4.379   9.242   3.028
  148    HD2  PHE  19           HD2      PHE  19  -4.955   5.132   3.907
  149    HE1  PHE  19           HE1      PHE  19  -6.838   9.496   2.597
  150    HE2  PHE  19           HE2      PHE  19  -7.416   5.384   3.477
  151    HZ   PHE  19           HZ       PHE  19  -8.328   7.563   2.827
  152    H    TYR  20           H        TYR  20  -1.566   4.285   6.033
  153    HA   TYR  20           HA       TYR  20   1.117   5.414   5.851
  154   1HB   TYR  20          1HB       TYR  20  -0.197   4.014   7.788
  155   2HB   TYR  20          2HB       TYR  20   0.328   2.639   6.837
  156    HD1  TYR  20           HD1      TYR  20   2.375   1.660   7.347
  157    HD2  TYR  20           HD2      TYR  20   1.740   5.769   8.357
  158    HE1  TYR  20           HE1      TYR  20   4.636   1.733   8.506
  159    HE2  TYR  20           HE2      TYR  20   4.004   5.828   9.513
  160    HH   TYR  20           HH       TYR  20   6.226   3.143   9.260
  161    H    GLY  21           H        GLY  21   1.974   5.228   3.814
  162   1HA   GLY  21          1HA       GLY  21   1.372   2.908   2.184
  163   2HA   GLY  21          2HA       GLY  21   2.335   4.306   1.750
  164    H    GLY  22           H        GLY  22   2.409   1.010   2.694
  165   1HA   GLY  22          1HA       GLY  22   5.299   1.204   3.308
  166   2HA   GLY  22          2HA       GLY  22   4.218   0.028   4.030
  167    H    TYR  23           H        TYR  23   6.550  -0.766   2.633
  168    HA   TYR  23           HA       TYR  23   5.312  -2.151   0.366
  169   1HB   TYR  23          1HB       TYR  23   7.492  -1.734  -0.843
  170   2HB   TYR  23          2HB       TYR  23   6.722  -0.217  -0.421
  171    HD1  TYR  23           HD1      TYR  23   9.678  -2.238  -0.091
  172    HD2  TYR  23           HD2      TYR  23   7.535   1.018   1.673
  173    HE1  TYR  23           HE1      TYR  23  11.788  -1.496   1.119
  174    HE2  TYR  23           HE2      TYR  23   9.651   1.749   2.878
  175    HH   TYR  23           HH       TYR  23  12.624   0.814   2.023
  176    H    THR  24           H        THR  24   5.162  -4.171   1.322
  177    HA   THR  24           HA       THR  24   7.568  -5.643   1.587
  178    HB   THR  24           HB       THR  24   6.888  -4.140   3.864
  179    HG1  THR  24           HG1      THR  24   8.940  -5.117   3.509
  180   1HG2  THR  24          1HG2      THR  24   6.351  -7.074   4.471
  181   2HG2  THR  24          2HG2      THR  24   6.092  -5.662   5.524
  182   3HG2  THR  24          3HG2      THR  24   5.003  -5.958   4.148
  183    H    THR  25           H        THR  25   6.909  -7.895   2.770
  184    HA   THR  25           HA       THR  25   4.201  -8.578   1.877
  185    HB   THR  25           HB       THR  25   5.055 -10.445   0.577
  186    HG1  THR  25           HG1      THR  25   6.813 -11.088   1.907
  187   1HG2  THR  25          1HG2      THR  25   5.423  -8.054  -0.434
  188   2HG2  THR  25          2HG2      THR  25   7.129  -8.279   0.026
  189   3HG2  THR  25          3HG2      THR  25   6.364  -9.393  -1.133
  190    H    GLU  26           H        GLU  26   3.091  -9.783   3.300
  191    HA   GLU  26           HA       GLU  26   2.681 -11.180   4.933
  192   1HB   GLU  26          1HB       GLU  26   5.224 -12.081   4.139
  193   2HB   GLU  26          2HB       GLU  26   5.385 -11.853   5.870
  194   1HG   GLU  26          1HG       GLU  26   4.581 -14.155   5.256
  195   2HG   GLU  26          2HG       GLU  26   3.473 -13.307   6.317
  196    HA   PRO  27           HA       PRO  27   3.777  -7.745   7.694
  197   1HB   PRO  27          1HB       PRO  27   1.259  -6.745   8.056
  198   2HB   PRO  27          2HB       PRO  27   2.372  -6.127   6.851
  199   1HG   PRO  27          1HG       PRO  27  -0.001  -7.849   6.473
  200   2HG   PRO  27          2HG       PRO  27   0.856  -6.887   5.287
  201   1HD   PRO  27          1HD       PRO  27   1.016  -9.729   5.632
  202   2HD   PRO  27          2HD       PRO  27   1.960  -8.754   4.523
  203    H    GLU  28           H        GLU  28   1.628 -10.384   7.799
  204    HA   GLU  28           HA       GLU  28   0.705 -10.212  10.346
  205   1HB   GLU  28          1HB       GLU  28   1.258 -12.407   8.410
  206   2HB   GLU  28          2HB       GLU  28   1.144 -12.918  10.082
  207   1HG   GLU  28          1HG       GLU  28  -1.052 -11.576  10.218
  208   2HG   GLU  28          2HG       GLU  28  -0.955 -11.391   8.479
  209    H    ARG  29           H        ARG  29   3.754 -11.860   9.233
  210    HA   ARG  29           HA       ARG  29   4.560 -12.288  11.901
  211   1HB   ARG  29          1HB       ARG  29   6.652 -13.151  10.873
  212   2HB   ARG  29          2HB       ARG  29   5.249 -13.793  10.041
  213   1HG   ARG  29          1HG       ARG  29   5.564 -12.399   8.147
  214   2HG   ARG  29          2HG       ARG  29   6.531 -11.238   9.034
  215   1HD   ARG  29          1HD       ARG  29   8.479 -12.515   8.873
  216   2HD   ARG  29          2HD       ARG  29   7.614 -14.039   8.861
  217    HE   ARG  29           HE       ARG  29   7.166 -12.356   6.482
  218   1HH1  ARG  29          1HH1      ARG  29   9.070 -14.938   7.927
  219   2HH1  ARG  29          2HH1      ARG  29   9.600 -15.574   6.405
  220   1HH2  ARG  29          1HH2      ARG  29   7.865 -13.192   4.473
  221   2HH2  ARG  29          2HH2      ARG  29   8.910 -14.573   4.427
  222    H    ARG  30           H        ARG  30   4.879  -9.716   9.520
  223    HA   ARG  30           HA       ARG  30   7.229  -8.599  10.541
  224   1HB   ARG  30          1HB       ARG  30   5.974  -8.192   8.258
  225   2HB   ARG  30          2HB       ARG  30   5.043  -7.005   9.150
  226   1HG   ARG  30          1HG       ARG  30   6.735  -5.501   9.017
  227   2HG   ARG  30          2HG       ARG  30   7.849  -6.624   9.769
  228   1HD   ARG  30          1HD       ARG  30   7.178  -7.184   6.901
  229   2HD   ARG  30          2HD       ARG  30   8.116  -5.734   7.195
  230    HE   ARG  30           HE       ARG  30   9.113  -8.403   7.319
  231   1HH1  ARG  30          1HH1      ARG  30   9.283  -5.407   9.155
  232   2HH1  ARG  30          2HH1      ARG  30  10.847  -5.749   9.814
  233   1HH2  ARG  30          1HH2      ARG  30  11.178  -8.855   8.188
  234   2HH2  ARG  30          2HH2      ARG  30  11.933  -7.724   9.259
  235    H    LEU  31           H        LEU  31   3.716  -8.163  11.186
  236    HA   LEU  31           HA       LEU  31   4.019  -5.887  12.825
  237   1HB   LEU  31          1HB       LEU  31   1.935  -7.409  11.719
  238   2HB   LEU  31          2HB       LEU  31   1.706  -7.498  13.455
  239    HG   LEU  31           HG       LEU  31   1.959  -4.920  13.423
  240   1HD1  LEU  31          1HD1      LEU  31   0.987  -4.053  11.161
  241   2HD1  LEU  31          2HD1      LEU  31   2.734  -4.350  11.327
  242   3HD1  LEU  31          3HD1      LEU  31   1.703  -5.541  10.499
  243   1HD2  LEU  31          1HD2      LEU  31  -0.574  -5.379  12.084
  244   2HD2  LEU  31          2HD2      LEU  31  -0.224  -6.650  13.281
  245   3HD2  LEU  31          3HD2      LEU  31  -0.235  -4.940  13.775
  246    H    THR  32           H        THR  32   3.276  -9.342  13.692
  247    HA   THR  32           HA       THR  32   3.556  -9.088  16.404
  248    HB   THR  32           HB       THR  32   2.675 -11.101  15.316
  249    HG1  THR  32           HG1      THR  32   3.884 -12.516  16.678
  250   1HG2  THR  32          1HG2      THR  32   5.497 -11.860  14.480
  251   2HG2  THR  32          2HG2      THR  32   3.949 -12.539  13.922
  252   3HG2  THR  32          3HG2      THR  32   4.467 -10.931  13.365
  253    H    GLU  33           H        GLU  33   6.096  -9.224  13.916
  254    HA   GLU  33           HA       GLU  33   8.236  -9.942  15.341
  255   1HB   GLU  33          1HB       GLU  33   8.067  -9.153  12.893
  256   2HB   GLU  33          2HB       GLU  33   8.269  -7.521  13.497
  257   1HG   GLU  33          1HG       GLU  33  10.345  -8.754  14.792
  258   2HG   GLU  33          2HG       GLU  33  10.256  -9.757  13.358
  259    H    HIS  34           H        HIS  34   7.193  -6.467  14.993
  260    HA   HIS  34           HA       HIS  34   8.848  -5.728  17.195
  261   1HB   HIS  34          1HB       HIS  34   8.178  -3.499  16.726
  262   2HB   HIS  34          2HB       HIS  34   8.425  -4.302  15.189
  263    HD1  HIS  34           HD1      HIS  34   5.812  -2.643  17.275
  264    HD2  HIS  34           HD2      HIS  34   6.022  -4.827  13.700
  265    HE1  HIS  34           HE1      HIS  34   3.580  -2.290  16.090
  266    H    ASN  35           H        ASN  35   5.293  -6.017  16.561
  267    HA   ASN  35           HA       ASN  35   4.281  -5.066  18.816
  268   1HB   ASN  35          1HB       ASN  35   3.525  -7.140  16.877
  269   2HB   ASN  35          2HB       ASN  35   2.910  -7.541  18.468
  270   1HD2  ASN  35          1HD2      ASN  35   2.101  -6.134  15.700
  271   2HD2  ASN  35          2HD2      ASN  35   0.971  -4.926  16.209
  272    H    SER  36           H        SER  36   5.308  -8.537  18.324
  273    HA   SER  36           HA       SER  36   4.904  -9.411  20.853
  274   1HB   SER  36          1HB       SER  36   5.554 -10.795  18.851
  275   2HB   SER  36          2HB       SER  36   7.201 -10.221  19.016
  276    HG   SER  36           HG       SER  36   7.519 -11.756  20.459
  277    H    GLY  37           H        GLY  37   7.878  -7.877  19.453
  278   1HA   GLY  37          1HA       GLY  37   9.355  -7.997  21.892
  279   2HA   GLY  37          2HA       GLY  37   9.757  -7.104  20.440
  280    H    THR  38           H        THR  38   8.943  -4.931  20.123
  281    HA   THR  38           HA       THR  38   8.016  -3.720  22.643
  282    HB   THR  38           HB       THR  38  10.316  -3.088  21.757
  283    HG1  THR  38           HG1      THR  38   9.252  -1.486  22.973
  284   1HG2  THR  38          1HG2      THR  38  10.618  -2.235  19.644
  285   2HG2  THR  38          2HG2      THR  38   9.050  -2.985  19.259
  286   3HG2  THR  38          3HG2      THR  38   9.124  -1.273  19.742
  287    H    GLY  39           H        GLY  39   5.901  -3.319  22.691
  288   1HA   GLY  39          1HA       GLY  39   4.496  -2.881  20.162
  289   2HA   GLY  39          2HA       GLY  39   3.789  -3.217  21.729
  290    H    ALA  40           H        ALA  40   2.463  -1.479  22.152
  291    HA   ALA  40           HA       ALA  40   3.597   1.187  21.710
  292   1HB   ALA  40          1HB       ALA  40   1.058  -0.018  21.170
  293   2HB   ALA  40          2HB       ALA  40   0.814   1.228  22.417
  294   3HB   ALA  40          3HB       ALA  40   1.572   1.659  20.866
  295    H    LYS  41           H        LYS  41   4.661   1.898  23.503
  296    HA   LYS  41           HA       LYS  41   4.457   0.942  26.026
  297   1HB   LYS  41          1HB       LYS  41   6.099   2.625  25.009
  298   2HB   LYS  41          2HB       LYS  41   4.932   3.866  25.421
  299   1HG   LYS  41          1HG       LYS  41   5.106   3.425  27.767
  300   2HG   LYS  41          2HG       LYS  41   5.846   1.857  27.510
  301   1HD   LYS  41          1HD       LYS  41   7.930   2.761  27.467
  302   2HD   LYS  41          2HD       LYS  41   7.466   3.919  26.236
  303   1HE   LYS  41          1HE       LYS  41   6.212   4.800  28.648
  304   2HE   LYS  41          2HE       LYS  41   7.844   4.345  29.095
  305   1HZ   LYS  41          1HZ       LYS  41   8.043   6.502  28.384
  306   2HZ   LYS  41          2HZ       LYS  41   8.491   5.680  27.046
  307   3HZ   LYS  41          3HZ       LYS  41   6.999   6.337  27.140
  308    H    TYR  42           H        TYR  42   3.579   2.183  28.028
  309    HA   TYR  42           HA       TYR  42   1.860   2.964  29.197
  310   1HB   TYR  42          1HB       TYR  42   1.925   4.452  26.782
  311   2HB   TYR  42          2HB       TYR  42   0.269   3.881  26.836
  312    HD1  TYR  42           HD1      TYR  42   2.730   6.124  28.337
  313    HD2  TYR  42           HD2      TYR  42  -1.242   4.574  28.681
  314    HE1  TYR  42           HE1      TYR  42   2.126   8.006  29.938
  315    HE2  TYR  42           HE2      TYR  42  -1.832   6.458  30.281
  316    HH   TYR  42           HH       TYR  42  -0.298   7.947  31.951
  317    H    THR  43           H        THR  43   0.513   1.906  25.983
  318    HA   THR  43           HA       THR  43  -1.004  -0.143  27.422
  319    HB   THR  43           HB       THR  43  -3.022   0.568  26.010
  320    HG1  THR  43           HG1      THR  43  -1.813   1.844  24.468
  321   1HG2  THR  43          1HG2      THR  43  -2.403   1.482  28.467
  322   2HG2  THR  43          2HG2      THR  43  -2.161   3.004  27.579
  323   3HG2  THR  43          3HG2      THR  43  -3.746   2.195  27.541
  324    H    ARG  44           H        ARG  44   0.386  -1.737  26.630
  325    HA   ARG  44           HA       ARG  44   0.542  -1.868  23.743
  326   1HB   ARG  44          1HB       ARG  44   2.425  -3.339  24.037
  327   2HB   ARG  44          2HB       ARG  44   2.628  -2.079  25.238
  328   1HG   ARG  44          1HG       ARG  44   1.141  -3.846  26.699
  329   2HG   ARG  44          2HG       ARG  44   1.936  -4.972  25.616
  330   1HD   ARG  44          1HD       ARG  44   3.346  -4.721  27.584
  331   2HD   ARG  44          2HD       ARG  44   4.164  -3.939  26.245
  332    HE   ARG  44           HE       ARG  44   2.603  -1.926  27.432
  333   1HH1  ARG  44          1HH1      ARG  44   5.207  -4.066  28.443
  334   2HH1  ARG  44          2HH1      ARG  44   5.828  -2.960  29.623
  335   1HH2  ARG  44          1HH2      ARG  44   3.423  -0.467  28.987
  336   2HH2  ARG  44          2HH2      ARG  44   4.807  -0.900  29.935
  337    H    LEU  45           H        LEU  45  -1.217  -3.098  26.425
  338    HA   LEU  45           HA       LEU  45  -1.820  -5.608  25.051
  339   1HB   LEU  45          1HB       LEU  45  -2.379  -6.505  27.062
  340   2HB   LEU  45          2HB       LEU  45  -1.116  -5.388  27.537
  341    HG   LEU  45           HG       LEU  45  -2.857  -5.235  29.147
  342   1HD1  LEU  45          1HD1      LEU  45  -1.776  -3.102  28.321
  343   2HD1  LEU  45          2HD1      LEU  45  -3.262  -2.813  27.384
  344   3HD1  LEU  45          3HD1      LEU  45  -3.333  -2.916  29.160
  345   1HD2  LEU  45          1HD2      LEU  45  -5.075  -5.347  28.775
  346   2HD2  LEU  45          2HD2      LEU  45  -4.998  -4.306  27.333
  347   3HD2  LEU  45          3HD2      LEU  45  -4.573  -6.030  27.209
  348    H    ALA  46           H        ALA  46  -2.839  -2.403  25.172
  349    HA   ALA  46           HA       ALA  46  -5.649  -2.822  25.283
  350   1HB   ALA  46          1HB       ALA  46  -3.974  -0.506  24.230
  351   2HB   ALA  46          2HB       ALA  46  -5.724  -0.459  24.557
  352   3HB   ALA  46          3HB       ALA  46  -4.576  -0.692  25.896
  353    H    LYS  47           H        LYS  47  -7.094  -2.196  23.367
  354    HA   LYS  47           HA       LYS  47  -6.836  -3.990  21.350
  355   1HB   LYS  47          1HB       LYS  47  -8.371  -1.475  21.757
  356   2HB   LYS  47          2HB       LYS  47  -8.278  -2.072  20.113
  357   1HG   LYS  47          1HG       LYS  47  -9.845  -3.635  20.591
  358   2HG   LYS  47          2HG       LYS  47  -8.771  -4.353  21.775
  359   1HD   LYS  47          1HD       LYS  47  -9.872  -1.951  22.935
  360   2HD   LYS  47          2HD       LYS  47 -11.198  -2.856  22.233
  361   1HE   LYS  47          1HE       LYS  47 -10.399  -4.917  23.455
  362   2HE   LYS  47          2HE       LYS  47  -9.135  -3.960  24.201
  363   1HZ   LYS  47          1HZ       LYS  47 -12.000  -3.843  24.642
  364   2HZ   LYS  47          2HZ       LYS  47 -10.783  -3.818  25.731
  365   3HZ   LYS  47          3HZ       LYS  47 -11.131  -2.479  24.863
  366    H    ARG  48           H        ARG  48  -5.602  -0.600  21.461
  367    HA   ARG  48           HA       ARG  48  -3.988   0.357  20.377
  368   1HB   ARG  48          1HB       ARG  48  -2.909  -2.044  20.573
  369   2HB   ARG  48          2HB       ARG  48  -3.285  -2.192  18.868
  370   1HG   ARG  48          1HG       ARG  48  -2.106   0.309  18.927
  371   2HG   ARG  48          2HG       ARG  48  -1.235  -0.498  20.215
  372   1HD   ARG  48          1HD       ARG  48   0.040  -1.547  18.656
  373   2HD   ARG  48          2HD       ARG  48  -1.384  -2.399  18.092
  374    HE   ARG  48           HE       ARG  48  -1.468   0.209  16.963
  375   1HH1  ARG  48          1HH1      ARG  48   0.521  -2.687  16.778
  376   2HH1  ARG  48          2HH1      ARG  48   1.029  -2.389  15.148
  377   1HH2  ARG  48          1HH2      ARG  48  -0.798   0.604  14.815
  378   2HH2  ARG  48          2HH2      ARG  48   0.274  -0.504  14.025
  379    H    ARG  49           H        ARG  49  -3.673   1.442  18.307
  380    HA   ARG  49           HA       ARG  49  -5.864   1.677  16.776
  381   1HB   ARG  49          1HB       ARG  49  -2.956   2.312  16.420
  382   2HB   ARG  49          2HB       ARG  49  -3.911   2.329  14.951
  383   1HG   ARG  49          1HG       ARG  49  -4.945   4.274  15.527
  384   2HG   ARG  49          2HG       ARG  49  -5.328   3.686  17.133
  385   1HD   ARG  49          1HD       ARG  49  -2.513   4.100  17.151
  386   2HD   ARG  49          2HD       ARG  49  -3.171   5.481  16.296
  387    HE   ARG  49           HE       ARG  49  -4.691   4.881  18.708
  388   1HH1  ARG  49          1HH1      ARG  49  -1.794   6.476  17.505
  389   2HH1  ARG  49          2HH1      ARG  49  -1.691   7.576  18.839
  390   1HH2  ARG  49          1HH2      ARG  49  -4.555   6.331  20.469
  391   2HH2  ARG  49          2HH2      ARG  49  -3.272   7.494  20.536
  392    HA   PRO  50           HA       PRO  50  -5.825  -1.873  14.224
  393   1HB   PRO  50          1HB       PRO  50  -7.721  -1.145  12.395
  394   2HB   PRO  50          2HB       PRO  50  -8.113  -1.804  13.971
  395   1HG   PRO  50          1HG       PRO  50  -8.303   0.993  13.031
  396   2HG   PRO  50          2HG       PRO  50  -9.069   0.246  14.419
  397   1HD   PRO  50          1HD       PRO  50  -6.783   1.980  14.446
  398   2HD   PRO  50          2HD       PRO  50  -7.480   1.142  15.818
  399    H    VAL  51           H        VAL  51  -5.557  -2.665  11.925
  400    HA   VAL  51           HA       VAL  51  -4.133  -0.656  10.364
  401    HB   VAL  51           HB       VAL  51  -2.350  -2.427   9.956
  402   1HG1  VAL  51          1HG1      VAL  51  -1.092  -1.786  12.022
  403   2HG1  VAL  51          2HG1      VAL  51  -1.842  -0.411  11.178
  404   3HG1  VAL  51          3HG1      VAL  51  -2.589  -1.062  12.658
  405   1HG2  VAL  51          1HG2      VAL  51  -2.061  -3.851  12.152
  406   2HG2  VAL  51          2HG2      VAL  51  -3.827  -3.654  12.265
  407   3HG2  VAL  51          3HG2      VAL  51  -3.109  -4.427  10.832
  408    H    ILE  52           H        ILE  52  -5.988  -0.696   8.976
  409    HA   ILE  52           HA       ILE  52  -6.442  -3.277   7.666
  410    HB   ILE  52           HB       ILE  52  -8.599  -2.692   7.329
  411   1HG1  ILE  52          1HG1      ILE  52  -7.860   0.250   7.417
  412   2HG1  ILE  52          2HG1      ILE  52  -8.068  -0.701   5.960
  413   1HG2  ILE  52          1HG2      ILE  52  -9.493  -2.055   9.344
  414   2HG2  ILE  52          2HG2      ILE  52  -7.830  -2.460   9.833
  415   3HG2  ILE  52          3HG2      ILE  52  -8.300  -0.760   9.597
  416   1HD1  ILE  52          1HD1      ILE  52 -10.158   0.139   7.984
  417   2HD1  ILE  52          2HD1      ILE  52 -10.181   0.308   6.212
  418   3HD1  ILE  52          3HD1      ILE  52 -10.435  -1.289   6.958
  419    H    MET  53           H        MET  53  -6.415  -3.423   5.361
  420    HA   MET  53           HA       MET  53  -5.044  -1.157   4.131
  421   1HB   MET  53          1HB       MET  53  -3.960  -2.933   2.646
  422   2HB   MET  53          2HB       MET  53  -3.497  -3.049   4.331
  423   1HG   MET  53          1HG       MET  53  -5.943  -4.600   3.687
  424   2HG   MET  53          2HG       MET  53  -4.534  -5.134   2.794
  425   1HE   MET  53          1HE       MET  53  -2.117  -4.376   4.894
  426   2HE   MET  53          2HE       MET  53  -1.971  -6.037   5.519
  427   3HE   MET  53          3HE       MET  53  -2.310  -5.762   3.794
  428    H    ILE  54           H        ILE  54  -5.944  -0.323   2.267
  429    HA   ILE  54           HA       ILE  54  -8.121  -1.903   1.082
  430    HB   ILE  54           HB       ILE  54  -9.275   0.179   0.616
  431   1HG1  ILE  54          1HG1      ILE  54  -7.036   1.510   0.617
  432   2HG1  ILE  54          2HG1      ILE  54  -8.520   2.297   1.116
  433   1HG2  ILE  54          1HG2      ILE  54  -9.992  -0.877   2.590
  434   2HG2  ILE  54          2HG2      ILE  54  -8.539  -0.378   3.490
  435   3HG2  ILE  54          3HG2      ILE  54  -9.760   0.833   3.032
  436   1HD1  ILE  54          1HD1      ILE  54  -7.028   0.898   3.294
  437   2HD1  ILE  54          2HD1      ILE  54  -6.233   2.332   2.601
  438   3HD1  ILE  54          3HD1      ILE  54  -7.858   2.471   3.313
  439    H    HIS  55           H        HIS  55  -5.006  -0.620   0.720
  440    HA   HIS  55           HA       HIS  55  -5.370  -0.514  -2.187
  441   1HB   HIS  55          1HB       HIS  55  -4.332   1.440  -0.480
  442   2HB   HIS  55          2HB       HIS  55  -2.912   0.698  -1.187
  443    HD1  HIS  55           HD1      HIS  55  -5.484   3.188  -1.866
  444    HD2  HIS  55           HD2      HIS  55  -3.030   0.687  -4.172
  445    HE1  HIS  55           HE1      HIS  55  -5.489   4.158  -4.226
  446    H    THR  56           H        THR  56  -4.974  -2.638  -2.768
  447    HA   THR  56           HA       THR  56  -2.550  -3.874  -1.667
  448    HB   THR  56           HB       THR  56  -3.709  -5.931  -2.815
  449    HG1  THR  56           HG1      THR  56  -5.840  -5.461  -3.466
  450   1HG2  THR  56          1HG2      THR  56  -4.244  -4.614  -0.282
  451   2HG2  THR  56          2HG2      THR  56  -5.772  -5.257  -0.930
  452   3HG2  THR  56          3HG2      THR  56  -4.386  -6.344  -0.673
  453    H    GLU  57           H        GLU  57  -0.726  -3.953  -2.810
  454    HA   GLU  57           HA       GLU  57  -0.993  -3.984  -5.694
  455   1HB   GLU  57          1HB       GLU  57   0.001  -1.730  -4.130
  456   2HB   GLU  57          2HB       GLU  57   1.269  -2.347  -5.170
  457   1HG   GLU  57          1HG       GLU  57  -1.543  -1.801  -6.212
  458   2HG   GLU  57          2HG       GLU  57  -0.314  -0.552  -6.170
  459    H    LYS  58           H        LYS  58   0.843  -4.964  -6.791
  460    HA   LYS  58           HA       LYS  58   2.751  -6.240  -4.962
  461   1HB   LYS  58          1HB       LYS  58   2.533  -8.336  -6.096
  462   2HB   LYS  58          2HB       LYS  58   0.936  -7.825  -5.586
  463   1HG   LYS  58          1HG       LYS  58   1.751  -6.908  -8.313
  464   2HG   LYS  58          2HG       LYS  58   1.547  -8.640  -8.140
  465   1HD   LYS  58          1HD       LYS  58  -0.742  -8.454  -7.563
  466   2HD   LYS  58          2HD       LYS  58  -0.581  -6.791  -7.032
  467   1HE   LYS  58          1HE       LYS  58  -0.315  -7.707  -9.937
  468   2HE   LYS  58          2HE       LYS  58  -1.771  -7.019  -9.246
  469   1HZ   LYS  58          1HZ       LYS  58   0.274  -5.634 -10.332
  470   2HZ   LYS  58          2HZ       LYS  58  -0.917  -5.004  -9.410
  471   3HZ   LYS  58          3HZ       LYS  58   0.509  -5.420  -8.729
  472    H    PHE  59           H        PHE  59   4.818  -6.812  -5.988
  473    HA   PHE  59           HA       PHE  59   5.343  -5.907  -8.627
  474   1HB   PHE  59          1HB       PHE  59   6.104  -4.301  -6.134
  475   2HB   PHE  59          2HB       PHE  59   7.110  -4.207  -7.566
  476    HD1  PHE  59           HD1      PHE  59   5.996  -3.461  -9.751
  477    HD2  PHE  59           HD2      PHE  59   4.188  -2.970  -5.943
  478    HE1  PHE  59           HE1      PHE  59   4.487  -1.691 -10.695
  479    HE2  PHE  59           HE2      PHE  59   2.679  -1.200  -6.888
  480    HZ   PHE  59           HZ       PHE  59   2.847  -0.582  -9.252
  481    H    GLU  60           H        GLU  60   7.150  -6.948  -9.415
  482    HA   GLU  60           HA       GLU  60   8.681  -8.393  -7.403
  483   1HB   GLU  60          1HB       GLU  60   9.092 -10.090  -9.047
  484   2HB   GLU  60          2HB       GLU  60   7.386  -9.705  -9.157
  485   1HG   GLU  60          1HG       GLU  60   8.095  -7.994 -11.012
  486   2HG   GLU  60          2HG       GLU  60   9.621  -8.857 -11.037
  487    H    THR  61           H        THR  61   8.769  -5.859  -9.774
  488    HA   THR  61           HA       THR  61  11.712  -5.947  -9.802
  489    HB   THR  61           HB       THR  61  11.450  -4.572 -11.884
  490    HG1  THR  61           HG1      THR  61   8.625  -5.216 -11.584
  491   1HG2  THR  61          1HG2      THR  61  10.326  -6.245 -13.328
  492   2HG2  THR  61          2HG2      THR  61  11.354  -7.083 -12.139
  493   3HG2  THR  61          3HG2      THR  61   9.592  -7.009 -11.897
  494    H    ARG  62           H        ARG  62  12.926  -4.116  -9.270
  495    HA   ARG  62           HA       ARG  62  11.694  -2.539  -7.307
  496   1HB   ARG  62          1HB       ARG  62  14.178  -3.283  -7.483
  497   2HB   ARG  62          2HB       ARG  62  14.384  -1.982  -8.639
  498   1HG   ARG  62          1HG       ARG  62  12.977  -1.032  -6.247
  499   2HG   ARG  62          2HG       ARG  62  14.497  -1.786  -5.813
  500   1HD   ARG  62          1HD       ARG  62  14.638   0.035  -8.176
  501   2HD   ARG  62          2HD       ARG  62  14.248   0.827  -6.663
  502    HE   ARG  62           HE       ARG  62  16.486  -1.039  -6.413
  503   1HH1  ARG  62          1HH1      ARG  62  15.578   2.242  -7.299
  504   2HH1  ARG  62          2HH1      ARG  62  17.151   2.897  -6.991
  505   1HH2  ARG  62          1HH2      ARG  62  18.562  -0.176  -6.007
  506   2HH2  ARG  62          2HH2      ARG  62  18.860   1.512  -6.251
  507    H    SER  63           H        SER  63  12.822  -2.001 -10.695
  508    HA   SER  63           HA       SER  63  12.579   0.692 -10.832
  509   1HB   SER  63          1HB       SER  63  12.344  -1.569 -12.776
  510   2HB   SER  63          2HB       SER  63  11.704  -0.031 -13.319
  511    HG   SER  63           HG       SER  63  14.145  -0.640 -13.604
  512    H    GLU  64           H        GLU  64  10.035  -1.833 -10.934
  513    HA   GLU  64           HA       GLU  64   8.025   0.085 -11.595
  514   1HB   GLU  64          1HB       GLU  64   7.962  -2.873 -10.890
  515   2HB   GLU  64          2HB       GLU  64   6.494  -1.951 -11.149
  516   1HG   GLU  64          1HG       GLU  64   7.203  -1.363 -13.434
  517   2HG   GLU  64          2HG       GLU  64   8.765  -2.118 -13.185
  518    H    ALA  65           H        ALA  65   9.021  -1.877  -8.720
  519    HA   ALA  65           HA       ALA  65   7.003  -1.101  -7.006
  520   1HB   ALA  65          1HB       ALA  65   8.653  -1.690  -5.226
  521   2HB   ALA  65          2HB       ALA  65   8.583  -2.902  -6.529
  522   3HB   ALA  65          3HB       ALA  65   9.931  -1.742  -6.465
  523    H    THR  66           H        THR  66  10.128   0.509  -7.830
  524    HA   THR  66           HA       THR  66   9.725   2.625  -5.961
  525    HB   THR  66           HB       THR  66  11.940   1.707  -6.917
  526    HG1  THR  66           HG1      THR  66  11.645   3.809  -5.819
  527   1HG2  THR  66          1HG2      THR  66  12.701   2.864  -9.010
  528   2HG2  THR  66          2HG2      THR  66  11.361   1.740  -9.342
  529   3HG2  THR  66          3HG2      THR  66  11.051   3.490  -9.247
  530    H    LYS  67           H        LYS  67   9.110   2.175  -9.478
  531    HA   LYS  67           HA       LYS  67   8.414   4.817  -9.998
  532   1HB   LYS  67          1HB       LYS  67   8.908   3.289 -11.781
  533   2HB   LYS  67          2HB       LYS  67   7.614   2.207 -11.306
  534   1HG   LYS  67          1HG       LYS  67   6.228   4.580 -11.616
  535   2HG   LYS  67          2HG       LYS  67   7.481   4.766 -12.826
  536   1HD   LYS  67          1HD       LYS  67   6.134   3.512 -14.172
  537   2HD   LYS  67          2HD       LYS  67   6.710   2.138 -13.250
  538   1HE   LYS  67          1HE       LYS  67   4.487   1.787 -12.810
  539   2HE   LYS  67          2HE       LYS  67   4.711   3.020 -11.586
  540   1HZ   LYS  67          1HZ       LYS  67   3.581   3.317 -14.259
  541   2HZ   LYS  67          2HZ       LYS  67   2.947   3.774 -12.824
  542   3HZ   LYS  67          3HZ       LYS  67   4.185   4.617 -13.476
  543    H    ALA  68           H        ALA  68   6.307   1.971  -9.184
  544    HA   ALA  68           HA       ALA  68   3.905   3.273  -9.166
  545   1HB   ALA  68          1HB       ALA  68   4.707   1.168  -7.132
  546   2HB   ALA  68          2HB       ALA  68   3.119   1.422  -7.894
  547   3HB   ALA  68          3HB       ALA  68   4.475   0.786  -8.855
  548    H    GLU  69           H        GLU  69   6.439   3.131  -6.608
  549    HA   GLU  69           HA       GLU  69   4.947   4.342  -4.632
  550   1HB   GLU  69          1HB       GLU  69   7.269   3.172  -4.527
  551   2HB   GLU  69          2HB       GLU  69   7.943   4.728  -4.974
  552   1HG   GLU  69          1HG       GLU  69   5.953   4.741  -2.726
  553   2HG   GLU  69          2HG       GLU  69   7.498   3.985  -2.389
  554    H    ALA  70           H        ALA  70   7.308   5.797  -6.986
  555    HA   ALA  70           HA       ALA  70   7.140   8.400  -6.212
  556   1HB   ALA  70          1HB       ALA  70   8.575   7.280  -8.020
  557   2HB   ALA  70          2HB       ALA  70   7.186   7.503  -9.111
  558   3HB   ALA  70          3HB       ALA  70   7.980   8.919  -8.380
  559    H    ALA  71           H        ALA  71   4.980   6.656  -8.552
  560    HA   ALA  71           HA       ALA  71   3.340   8.803  -9.138
  561   1HB   ALA  71          1HB       ALA  71   2.611   5.853  -8.945
  562   2HB   ALA  71          2HB       ALA  71   1.766   7.095  -9.898
  563   3HB   ALA  71          3HB       ALA  71   3.425   6.616 -10.331
  564    H    PHE  72           H        PHE  72   2.944   6.218  -6.612
  565    HA   PHE  72           HA       PHE  72   0.599   7.221  -5.539
  566   1HB   PHE  72          1HB       PHE  72   1.372   5.014  -4.931
  567   2HB   PHE  72          2HB       PHE  72   2.993   5.587  -4.587
  568    HD1  PHE  72           HD1      PHE  72   3.287   7.105  -2.524
  569    HD2  PHE  72           HD2      PHE  72  -0.164   4.728  -3.196
  570    HE1  PHE  72           HE1      PHE  72   2.723   7.232  -0.082
  571    HE2  PHE  72           HE2      PHE  72  -0.727   4.855  -0.753
  572    HZ   PHE  72           HZ       PHE  72   0.723   6.106   0.774
  573    H    LYS  73           H        LYS  73   3.814   8.525  -5.454
  574    HA   LYS  73           HA       LYS  73   3.391   9.923  -2.960
  575   1HB   LYS  73          1HB       LYS  73   5.614   8.927  -3.931
  576   2HB   LYS  73          2HB       LYS  73   5.680  10.421  -4.846
  577   1HG   LYS  73          1HG       LYS  73   5.363  11.688  -2.653
  578   2HG   LYS  73          2HG       LYS  73   5.508  10.159  -1.808
  579   1HD   LYS  73          1HD       LYS  73   7.733  10.096  -3.476
  580   2HD   LYS  73          2HD       LYS  73   7.611  11.806  -3.108
  581   1HE   LYS  73          1HE       LYS  73   7.317   9.868  -0.817
  582   2HE   LYS  73          2HE       LYS  73   8.919  10.084  -1.491
  583   1HZ   LYS  73          1HZ       LYS  73   7.201  12.292  -0.591
  584   2HZ   LYS  73          2HZ       LYS  73   8.410  11.637   0.293
  585   3HZ   LYS  73          3HZ       LYS  73   8.746  12.419  -1.102
  586    H    LYS  74           H        LYS  74   2.725  10.309  -6.351
  587    HA   LYS  74           HA       LYS  74   2.572  13.205  -6.090
  588   1HB   LYS  74          1HB       LYS  74   2.778  11.264  -8.322
  589   2HB   LYS  74          2HB       LYS  74   1.761  12.658  -8.629
  590   1HG   LYS  74          1HG       LYS  74   3.554  14.204  -8.179
  591   2HG   LYS  74          2HG       LYS  74   4.541  12.966  -7.429
  592   1HD   LYS  74          1HD       LYS  74   3.841  12.146 -10.138
  593   2HD   LYS  74          2HD       LYS  74   4.531  13.756 -10.172
  594   1HE   LYS  74          1HE       LYS  74   6.344  12.687  -8.525
  595   2HE   LYS  74          2HE       LYS  74   5.791  11.176  -9.217
  596   1HZ   LYS  74          1HZ       LYS  74   7.174  13.366 -10.502
  597   2HZ   LYS  74          2HZ       LYS  74   7.361  11.756 -10.704
  598   3HZ   LYS  74          3HZ       LYS  74   6.105  12.527 -11.410
  599    H    LEU  75           H        LEU  75   0.561  10.265  -6.385
  600    HA   LEU  75           HA       LEU  75  -1.859  11.568  -6.893
  601   1HB   LEU  75          1HB       LEU  75  -1.358   8.948  -5.473
  602   2HB   LEU  75          2HB       LEU  75  -2.882   9.477  -6.159
  603    HG   LEU  75           HG       LEU  75  -0.341   8.871  -7.696
  604   1HD1  LEU  75          1HD1      LEU  75  -2.865   7.369  -8.153
  605   2HD1  LEU  75          2HD1      LEU  75  -1.171   6.826  -8.207
  606   3HD1  LEU  75          3HD1      LEU  75  -1.987   7.040  -6.641
  607   1HD2  LEU  75          1HD2      LEU  75  -2.554   9.043  -9.440
  608   2HD2  LEU  75          2HD2      LEU  75  -2.596  10.500  -8.418
  609   3HD2  LEU  75          3HD2      LEU  75  -1.132  10.112  -9.353
  610    H    THR  76           H        THR  76  -3.757  11.567  -5.269
  611    HA   THR  76           HA       THR  76  -2.825  12.224  -2.570
  612    HB   THR  76           HB       THR  76  -2.917  14.347  -3.889
  613    HG1  THR  76           HG1      THR  76  -4.087  15.255  -2.182
  614   1HG2  THR  76          1HG2      THR  76  -4.612  14.756  -5.363
  615   2HG2  THR  76          2HG2      THR  76  -5.292  13.152  -5.001
  616   3HG2  THR  76          3HG2      THR  76  -5.801  14.569  -4.052
  617    H    ARG  77           H        ARG  77  -5.192  12.975  -1.419
  618    HA   ARG  77           HA       ARG  77  -6.336  10.568  -0.911
  619   1HB   ARG  77          1HB       ARG  77  -8.041  11.809   0.307
  620   2HB   ARG  77          2HB       ARG  77  -6.540  12.701   0.459
  621   1HG   ARG  77          1HG       ARG  77  -7.697  13.708  -1.912
  622   2HG   ARG  77          2HG       ARG  77  -9.060  13.502  -0.830
  623   1HD   ARG  77          1HD       ARG  77  -7.484  14.683   0.954
  624   2HD   ARG  77          2HD       ARG  77  -6.597  15.232  -0.454
  625    HE   ARG  77           HE       ARG  77  -9.450  15.691  -0.762
  626   1HH1  ARG  77          1HH1      ARG  77  -6.540  16.964   0.755
  627   2HH1  ARG  77          2HH1      ARG  77  -7.135  18.590   0.828
  628   1HH2  ARG  77          1HH2      ARG  77 -10.235  17.836  -0.667
  629   2HH2  ARG  77          2HH2      ARG  77  -9.251  19.088   0.014
  630    H    LYS  78           H        LYS  78  -6.742  12.637  -3.671
  631    HA   LYS  78           HA       LYS  78  -9.386  11.669  -4.307
  632   1HB   LYS  78          1HB       LYS  78  -7.773  13.913  -5.012
  633   2HB   LYS  78          2HB       LYS  78  -8.127  13.039  -6.488
  634   1HG   LYS  78          1HG       LYS  78 -10.239  13.831  -4.428
  635   2HG   LYS  78          2HG       LYS  78  -9.875  14.767  -5.863
  636   1HD   LYS  78          1HD       LYS  78 -10.763  13.146  -7.324
  637   2HD   LYS  78          2HD       LYS  78 -10.511  11.831  -6.192
  638   1HE   LYS  78          1HE       LYS  78 -12.304  13.700  -4.934
  639   2HE   LYS  78          2HE       LYS  78 -12.882  13.450  -6.569
  640   1HZ   LYS  78          1HZ       LYS  78 -12.635  11.540  -4.417
  641   2HZ   LYS  78          2HZ       LYS  78 -13.799  11.684  -5.552
  642   3HZ   LYS  78          3HZ       LYS  78 -12.374  10.979  -5.929
  643    H    GLN  79           H        GLN  79  -6.359  11.751  -6.301
  644    HA   GLN  79           HA       GLN  79  -7.005   9.829  -8.020
  645   1HB   GLN  79          1HB       GLN  79  -4.490  10.940  -6.958
  646   2HB   GLN  79          2HB       GLN  79  -4.295   9.306  -7.560
  647   1HG   GLN  79          1HG       GLN  79  -4.156  10.222  -9.636
  648   2HG   GLN  79          2HG       GLN  79  -5.884  10.484  -9.531
  649   1HE2  GLN  79          1HE2      GLN  79  -6.655  12.470  -9.576
  650   2HE2  GLN  79          2HE2      GLN  79  -5.743  13.937  -9.434
  651    H    LYS  80           H        LYS  80  -5.355   9.277  -4.831
  652    HA   LYS  80           HA       LYS  80  -5.158   6.534  -5.016
  653   1HB   LYS  80          1HB       LYS  80  -5.324   8.477  -2.725
  654   2HB   LYS  80          2HB       LYS  80  -5.309   6.754  -2.409
  655   1HG   LYS  80          1HG       LYS  80  -3.095   6.558  -2.938
  656   2HG   LYS  80          2HG       LYS  80  -3.267   7.520  -4.393
  657   1HD   LYS  80          1HD       LYS  80  -3.183   9.609  -3.073
  658   2HD   LYS  80          2HD       LYS  80  -3.145   8.696  -1.577
  659   1HE   LYS  80          1HE       LYS  80  -1.021   7.583  -3.015
  660   2HE   LYS  80          2HE       LYS  80  -0.954   9.271  -3.486
  661   1HZ   LYS  80          1HZ       LYS  80  -1.237   8.526  -0.675
  662   2HZ   LYS  80          2HZ       LYS  80   0.234   8.565  -1.384
  663   3HZ   LYS  80          3HZ       LYS  80  -0.673   9.921  -1.306
  664    H    GLU  81           H        GLU  81  -7.851   8.562  -3.690
  665    HA   GLU  81           HA       GLU  81  -9.425   6.432  -2.929
  666   1HB   GLU  81          1HB       GLU  81  -9.883   8.688  -2.153
  667   2HB   GLU  81          2HB       GLU  81 -10.142   9.265  -3.787
  668   1HG   GLU  81          1HG       GLU  81 -12.238   8.229  -3.981
  669   2HG   GLU  81          2HG       GLU  81 -11.849   6.973  -2.823
  670    H    GLN  82           H        GLN  82  -8.597   7.641  -6.089
  671    HA   GLN  82           HA       GLN  82 -10.950   6.806  -7.390
  672   1HB   GLN  82          1HB       GLN  82  -8.719   8.327  -8.062
  673   2HB   GLN  82          2HB       GLN  82  -8.479   6.877  -9.017
  674   1HG   GLN  82          1HG       GLN  82  -9.795   8.281 -10.417
  675   2HG   GLN  82          2HG       GLN  82 -10.945   7.129  -9.766
  676   1HE2  GLN  82          1HE2      GLN  82 -12.567   7.773  -8.473
  677   2HE2  GLN  82          2HE2      GLN  82 -12.903   9.413  -8.029
  678    H    TYR  83           H        TYR  83  -7.700   5.353  -6.798
  679    HA   TYR  83           HA       TYR  83  -8.097   3.069  -8.374
  680   1HB   TYR  83          1HB       TYR  83  -5.873   3.690  -7.612
  681   2HB   TYR  83          2HB       TYR  83  -6.425   3.950  -5.969
  682    HD1  TYR  83           HD1      TYR  83  -7.282   1.804  -4.694
  683    HD2  TYR  83           HD2      TYR  83  -4.753   1.713  -8.144
  684    HE1  TYR  83           HE1      TYR  83  -6.499  -0.533  -4.069
  685    HE2  TYR  83           HE2      TYR  83  -3.978  -0.624  -7.507
  686    HH   TYR  83           HH       TYR  83  -5.311  -2.244  -4.637
  687    H    LEU  84           H        LEU  84  -8.967   3.892  -4.995
  688    HA   LEU  84           HA       LEU  84  -9.510   1.296  -4.136
  689   1HB   LEU  84          1HB       LEU  84 -10.265   4.052  -3.288
  690   2HB   LEU  84          2HB       LEU  84 -11.159   2.705  -2.610
  691    HG   LEU  84           HG       LEU  84  -9.483   3.115  -1.048
  692   1HD1  LEU  84          1HD1      LEU  84  -8.217   1.140  -0.940
  693   2HD1  LEU  84          2HD1      LEU  84  -9.671   0.708  -1.872
  694   3HD1  LEU  84          3HD1      LEU  84  -8.126   0.994  -2.711
  695   1HD2  LEU  84          1HD2      LEU  84  -7.284   3.138  -3.108
  696   2HD2  LEU  84          2HD2      LEU  84  -8.196   4.611  -2.699
  697   3HD2  LEU  84          3HD2      LEU  84  -7.273   3.757  -1.437
  698    H    LYS  85           H        LYS  85 -11.695   3.829  -5.545
  699    HA   LYS  85           HA       LYS  85 -13.939   2.130  -5.567
  700   1HB   LYS  85          1HB       LYS  85 -13.396   4.836  -6.034
  701   2HB   LYS  85          2HB       LYS  85 -13.991   4.242  -7.571
  702   1HG   LYS  85          1HG       LYS  85 -15.825   3.044  -6.014
  703   2HG   LYS  85          2HG       LYS  85 -15.387   4.319  -4.895
  704   1HD   LYS  85          1HD       LYS  85 -17.096   5.373  -6.087
  705   2HD   LYS  85          2HD       LYS  85 -15.699   5.907  -6.999
  706   1HE   LYS  85          1HE       LYS  85 -16.258   4.657  -8.851
  707   2HE   LYS  85          2HE       LYS  85 -16.797   3.290  -7.896
  708   1HZ   LYS  85          1HZ       LYS  85 -18.476   4.770  -9.164
  709   2HZ   LYS  85          2HZ       LYS  85 -18.868   4.159  -7.701
  710   3HZ   LYS  85          3HZ       LYS  85 -18.391   5.714  -7.835
  711    H    THR  86           H        THR  86 -11.956   3.365  -8.357
  712    HA   THR  86           HA       THR  86 -12.947   1.834 -10.334
  713    HB   THR  86           HB       THR  86 -10.883   3.564 -10.082
  714    HG1  THR  86           HG1      THR  86 -10.949   1.357 -12.011
  715   1HG2  THR  86          1HG2      THR  86  -9.440   1.656  -9.053
  716   2HG2  THR  86          2HG2      THR  86  -9.499   0.907 -10.668
  717   3HG2  THR  86          3HG2      THR  86  -8.750   2.508 -10.455
  718    H    PHE  87           H        PHE  87 -10.901   0.710  -7.644
  719    HA   PHE  87           HA       PHE  87 -10.563  -1.869  -8.873
  720   1HB   PHE  87          1HB       PHE  87  -8.825  -0.805  -7.419
  721   2HB   PHE  87          2HB       PHE  87  -9.984  -0.634  -6.116
  722    HD1  PHE  87           HD1      PHE  87  -7.644  -2.843  -7.753
  723    HD2  PHE  87           HD2      PHE  87 -10.802  -2.671  -4.923
  724    HE1  PHE  87           HE1      PHE  87  -6.948  -5.075  -6.840
  725    HE2  PHE  87           HE2      PHE  87 -10.106  -4.902  -4.011
  726    HZ   PHE  87           HZ       PHE  87  -8.188  -6.078  -4.978
  727    H    HIS  88           H        HIS  88 -12.311  -0.471  -6.015
  728    HA   HIS  88           HA       HIS  88 -13.380  -2.729  -4.993
  729   1HB   HIS  88          1HB       HIS  88 -13.887   0.094  -4.877
  730   2HB   HIS  88          2HB       HIS  88 -15.425  -0.743  -4.952
  731    HD1  HIS  88           HD1      HIS  88 -16.325  -1.266  -2.693
  732    HD2  HIS  88           HD2      HIS  88 -12.132  -1.355  -2.762
  733    HE1  HIS  88           HE1      HIS  88 -15.584  -1.817  -0.315
  734    H    LEU  89           H        LEU  89 -14.240  -1.057  -8.013
  735    HA   LEU  89           HA       LEU  89 -16.693  -2.419  -8.385
  736   1HB   LEU  89          1HB       LEU  89 -14.901  -1.090 -10.420
  737   2HB   LEU  89          2HB       LEU  89 -16.586  -1.521 -10.637
  738    HG   LEU  89           HG       LEU  89 -15.738   0.392  -8.464
  739   1HD1  LEU  89          1HD1      LEU  89 -15.842   2.247  -9.875
  740   2HD1  LEU  89          2HD1      LEU  89 -14.894   1.059 -10.802
  741   3HD1  LEU  89          3HD1      LEU  89 -16.610   1.327 -11.192
  742   1HD2  LEU  89          1HD2      LEU  89 -17.978  -0.461  -8.251
  743   2HD2  LEU  89          2HD2      LEU  89 -18.053   1.237  -8.775
  744   3HD2  LEU  89          3HD2      LEU  89 -18.337  -0.070  -9.950
  745    H    GLU  90           H        GLU  90 -13.447  -2.801  -9.983
  746    HA   GLU  90           HA       GLU  90 -14.292  -5.493 -10.663
  747   1HB   GLU  90          1HB       GLU  90 -12.549  -5.460 -12.352
  748   2HB   GLU  90          2HB       GLU  90 -13.464  -3.971 -12.485
  749   1HG   GLU  90          1HG       GLU  90 -11.575  -3.110 -10.744
  750   2HG   GLU  90          2HG       GLU  90 -10.652  -4.395 -11.498
  751    H    HIS  91           H        HIS  91 -13.780  -6.971  -9.096
  752    HA   HIS  91           HA       HIS  91 -11.045  -6.852  -8.071
  753   1HB   HIS  91          1HB       HIS  91 -12.128  -6.034  -6.212
  754   2HB   HIS  91          2HB       HIS  91 -13.608  -6.913  -6.536
  755    HD1  HIS  91           HD1      HIS  91 -13.818  -9.326  -5.609
  756    HD2  HIS  91           HD2      HIS  91 -10.118  -7.511  -4.821
  757    HE1  HIS  91           HE1      HIS  91 -12.646 -10.807  -3.894
  758    H    HIS  92           H        HIS  92 -10.488  -8.452  -9.661
  759    HA   HIS  92           HA       HIS  92 -10.817 -11.068  -8.745
  760   1HB   HIS  92          1HB       HIS  92 -13.094 -10.391  -9.950
  761   2HB   HIS  92          2HB       HIS  92 -12.184 -10.792 -11.391
  762    HD1  HIS  92           HD1      HIS  92 -14.396 -12.315  -9.056
  763    HD2  HIS  92           HD2      HIS  92 -10.874 -13.558 -10.968
  764    HE1  HIS  92           HE1      HIS  92 -14.382 -14.864  -8.941
  765    H    HIS  93           H        HIS  93  -8.493 -10.654  -8.910
  766    HA   HIS  93           HA       HIS  93  -7.587 -10.847 -11.691
  767   1HB   HIS  93          1HB       HIS  93  -7.072  -8.706 -10.325
  768   2HB   HIS  93          2HB       HIS  93  -5.927  -9.701  -9.451
  769    HD1  HIS  93           HD1      HIS  93  -5.823  -7.335 -11.988
  770    HD2  HIS  93           HD2      HIS  93  -4.318 -11.242 -11.730
  771    HE1  HIS  93           HE1      HIS  93  -3.955  -7.497 -13.718
  772    H    HIS  94           H        HIS  94  -8.036 -13.218 -11.299
  773    HA   HIS  94           HA       HIS  94  -6.296 -14.502  -9.415
  774   1HB   HIS  94          1HB       HIS  94  -7.430 -16.490  -9.960
  775   2HB   HIS  94          2HB       HIS  94  -8.650 -15.230  -9.954
  776    HD1  HIS  94           HD1      HIS  94  -7.982 -18.108 -11.771
  777    HD2  HIS  94           HD2      HIS  94  -8.665 -14.141 -12.951
  778    HE1  HIS  94           HE1      HIS  94  -8.741 -18.206 -14.206
  779    H    HIS  95           H        HIS  95  -4.450 -13.229 -10.664
  780    HA   HIS  95           HA       HIS  95  -3.298 -15.208 -12.453
  781   1HB   HIS  95          1HB       HIS  95  -4.272 -12.614 -13.285
  782   2HB   HIS  95          2HB       HIS  95  -2.534 -12.696 -13.501
  783    HD1  HIS  95           HD1      HIS  95  -1.712 -13.867 -15.567
  784    HD2  HIS  95           HD2      HIS  95  -5.678 -14.867 -14.634
  785    HE1  HIS  95           HE1      HIS  95  -2.565 -15.295 -17.505
  786    H    HIS  96           H        HIS  96  -2.242 -15.628 -10.296
  787    HA   HIS  96           HA       HIS  96  -0.751 -13.795  -8.935
  788   1HB   HIS  96          1HB       HIS  96   0.379 -15.635  -7.950
  789   2HB   HIS  96          2HB       HIS  96  -1.268 -16.145  -8.266
  790    HD1  HIS  96           HD1      HIS  96  -1.638 -18.078  -9.931
  791    HD2  HIS  96           HD2      HIS  96   2.365 -16.867  -9.618
  792    HE1  HIS  96           HE1      HIS  96  -0.257 -19.854 -11.136
  Start of MODEL   10
    1   1H    MET   1          1H        MET   1  -1.113 -18.944  -1.108
    2    HA   MET   1           HA       MET   1  -1.469 -18.547   1.588
    3   1HB   MET   1          1HB       MET   1   0.651 -19.752  -0.201
    4   2HB   MET   1          2HB       MET   1   1.086 -19.503   1.479
    5   1HG   MET   1          1HG       MET   1  -1.058 -20.755   2.124
    6   2HG   MET   1          2HG       MET   1  -1.268 -21.143   0.428
    7   1HE   MET   1          1HE       MET   1  -0.471 -24.062   0.211
    8   2HE   MET   1          2HE       MET   1  -0.359 -22.596  -0.791
    9   3HE   MET   1          3HE       MET   1   1.075 -23.622  -0.551
   10    H    GLU   2           H        GLU   2   0.893 -18.097   2.899
   11    HA   GLU   2           HA       GLU   2   1.017 -15.433   3.153
   12   1HB   GLU   2          1HB       GLU   2   3.348 -17.364   3.534
   13   2HB   GLU   2          2HB       GLU   2   3.209 -15.781   4.272
   14   1HG   GLU   2          1HG       GLU   2   0.799 -17.399   4.747
   15   2HG   GLU   2          2HG       GLU   2   2.241 -18.217   5.320
   16    H    ASN   3           H        ASN   3   2.956 -13.915   2.689
   17    HA   ASN   3           HA       ASN   3   3.612 -14.273  -0.118
   18   1HB   ASN   3          1HB       ASN   3   4.052 -11.696   1.430
   19   2HB   ASN   3          2HB       ASN   3   3.735 -11.895  -0.281
   20   1HD2  ASN   3          1HD2      ASN   3   2.356 -12.132   2.950
   21   2HD2  ASN   3          2HD2      ASN   3   0.695 -11.891   2.519
   22    H    LYS   4           H        LYS   4   5.759 -14.765  -0.610
   23    HA   LYS   4           HA       LYS   4   7.829 -13.817   1.206
   24   1HB   LYS   4          1HB       LYS   4   7.384 -16.005   2.082
   25   2HB   LYS   4          2HB       LYS   4   7.373 -16.720   0.482
   26   1HG   LYS   4          1HG       LYS   4   9.662 -16.814   0.365
   27   2HG   LYS   4          2HG       LYS   4   9.865 -15.224   1.076
   28   1HD   LYS   4          1HD       LYS   4  10.691 -16.466   2.838
   29   2HD   LYS   4          2HD       LYS   4   8.998 -16.510   3.288
   30   1HE   LYS   4          1HE       LYS   4   9.073 -18.659   1.591
   31   2HE   LYS   4          2HE       LYS   4  10.725 -18.690   2.172
   32   1HZ   LYS   4          1HZ       LYS   4   8.352 -18.612   3.906
   33   2HZ   LYS   4          2HZ       LYS   4   9.223 -19.952   3.569
   34   3HZ   LYS   4          3HZ       LYS   4   9.902 -18.726   4.409
   35    H    LYS   5           H        LYS   5   6.880 -12.882  -1.379
   36    HA   LYS   5           HA       LYS   5   9.386 -12.938  -2.732
   37   1HB   LYS   5          1HB       LYS   5   7.710 -15.029  -3.409
   38   2HB   LYS   5          2HB       LYS   5   7.328 -13.830  -4.630
   39   1HG   LYS   5          1HG       LYS   5  10.240 -14.118  -4.068
   40   2HG   LYS   5          2HG       LYS   5   9.491 -15.556  -4.732
   41   1HD   LYS   5          1HD       LYS   5   9.127 -12.792  -5.971
   42   2HD   LYS   5          2HD       LYS   5  10.420 -13.876  -6.442
   43   1HE   LYS   5          1HE       LYS   5   8.386 -15.622  -6.708
   44   2HE   LYS   5          2HE       LYS   5   7.449 -14.153  -6.891
   45   1HZ   LYS   5          1HZ       LYS   5   8.313 -13.826  -8.883
   46   2HZ   LYS   5          2HZ       LYS   5   9.849 -14.092  -8.398
   47   3HZ   LYS   5          3HZ       LYS   5   8.898 -15.349  -8.822
   48    H    SER   6           H        SER   6   9.408 -11.368  -4.551
   49    HA   SER   6           HA       SER   6   9.003  -9.371  -5.304
   50   1HB   SER   6          1HB       SER   6   6.035  -9.976  -4.979
   51   2HB   SER   6          2HB       SER   6   6.766  -8.866  -6.122
   52    HG   SER   6           HG       SER   6   6.535 -10.624  -7.389
   53    H    HIS   7           H        HIS   7   7.024  -7.382  -4.814
   54    HA   HIS   7           HA       HIS   7   7.128  -7.083  -1.907
   55   1HB   HIS   7          1HB       HIS   7   7.836  -4.943  -3.935
   56   2HB   HIS   7          2HB       HIS   7   7.712  -4.704  -2.204
   57    HD1  HIS   7           HD1      HIS   7   9.996  -5.981  -4.855
   58    HD2  HIS   7           HD2      HIS   7   9.817  -5.936  -0.666
   59    HE1  HIS   7           HE1      HIS   7  12.328  -6.614  -4.033
   60    H    TYR   8           H        TYR   8   5.059  -7.024  -1.201
   61    HA   TYR   8           HA       TYR   8   2.999  -6.117  -3.037
   62   1HB   TYR   8          1HB       TYR   8   3.295  -7.588  -0.384
   63   2HB   TYR   8          2HB       TYR   8   1.743  -6.850  -0.727
   64    HD1  TYR   8           HD1      TYR   8   4.261  -9.062  -2.427
   65    HD2  TYR   8           HD2      TYR   8   0.132  -8.164  -1.758
   66    HE1  TYR   8           HE1      TYR   8   3.589 -11.098  -3.794
   67    HE2  TYR   8           HE2      TYR   8  -0.526 -10.201  -3.127
   68    HH   TYR   8           HH       TYR   8   1.325 -11.645  -5.213
   69    H    PHE   9           H        PHE   9   2.020  -4.148  -2.940
   70    HA   PHE   9           HA       PHE   9   2.893  -2.370  -0.822
   71   1HB   PHE   9          1HB       PHE   9   2.684  -2.024  -3.478
   72   2HB   PHE   9          2HB       PHE   9   0.984  -1.776  -3.134
   73    HD1  PHE   9           HD1      PHE   9   0.248   0.180  -1.848
   74    HD2  PHE   9           HD2      PHE   9   4.334  -0.379  -2.848
   75    HE1  PHE   9           HE1      PHE   9   0.710   2.586  -1.305
   76    HE2  PHE   9           HE2      PHE   9   4.796   2.028  -2.303
   77    HZ   PHE   9           HZ       PHE   9   2.978   3.481  -1.538
   78    H    TYR  10           H        TYR  10   1.707  -2.172   1.014
   79    HA   TYR  10           HA       TYR  10  -1.211  -2.339   0.730
   80   1HB   TYR  10          1HB       TYR  10  -1.063  -3.513   3.016
   81   2HB   TYR  10          2HB       TYR  10  -0.355  -4.446   1.712
   82    HD1  TYR  10           HD1      TYR  10   2.002  -4.937   1.660
   83    HD2  TYR  10           HD2      TYR  10   0.406  -2.327   4.650
   84    HE1  TYR  10           HE1      TYR  10   4.187  -5.073   2.954
   85    HE2  TYR  10           HE2      TYR  10   2.595  -2.472   5.935
   86    HH   TYR  10           HH       TYR  10   5.229  -3.082   4.938
   87    H    VAL  11           H        VAL  11  -2.226  -0.555   1.503
   88    HA   VAL  11           HA       VAL  11  -0.632   1.258   3.144
   89    HB   VAL  11           HB       VAL  11  -3.302   1.736   1.813
   90   1HG1  VAL  11          1HG1      VAL  11  -2.731   4.089   2.017
   91   2HG1  VAL  11          2HG1      VAL  11  -2.635   3.310   3.615
   92   3HG1  VAL  11          3HG1      VAL  11  -1.145   3.676   2.713
   93   1HG2  VAL  11          1HG2      VAL  11  -0.511   2.171   0.700
   94   2HG2  VAL  11          2HG2      VAL  11  -1.758   1.065   0.075
   95   3HG2  VAL  11          3HG2      VAL  11  -2.006   2.825  -0.013
   96    H    LEU  12           H        LEU  12  -1.221   1.861   5.228
   97    HA   LEU  12           HA       LEU  12  -3.462   0.320   6.338
   98   1HB   LEU  12          1HB       LEU  12  -0.727   0.928   7.300
   99   2HB   LEU  12          2HB       LEU  12  -2.003   0.994   8.500
  100    HG   LEU  12           HG       LEU  12  -1.159  -1.183   8.638
  101   1HD1  LEU  12          1HD1      LEU  12  -3.705  -0.920   8.362
  102   2HD1  LEU  12          2HD1      LEU  12  -3.467  -1.662   6.761
  103   3HD1  LEU  12          3HD1      LEU  12  -3.005  -2.551   8.232
  104   1HD2  LEU  12          1HD2      LEU  12  -0.087  -0.863   6.223
  105   2HD2  LEU  12          2HD2      LEU  12  -0.300  -2.466   6.967
  106   3HD2  LEU  12          3HD2      LEU  12  -1.469  -1.882   5.758
  107    H    LEU  13           H        LEU  13  -4.919   1.372   7.778
  108    HA   LEU  13           HA       LEU  13  -4.752   4.302   7.613
  109   1HB   LEU  13          1HB       LEU  13  -6.546   3.698   6.261
  110   2HB   LEU  13          2HB       LEU  13  -7.060   2.408   7.332
  111    HG   LEU  13           HG       LEU  13  -7.176   5.230   8.332
  112   1HD1  LEU  13          1HD1      LEU  13  -8.780   5.945   6.965
  113   2HD1  LEU  13          2HD1      LEU  13  -8.338   4.593   5.896
  114   3HD1  LEU  13          3HD1      LEU  13  -9.665   4.405   7.066
  115   1HD2  LEU  13          1HD2      LEU  13  -7.681   3.084   9.676
  116   2HD2  LEU  13          2HD2      LEU  13  -8.822   4.446   9.775
  117   3HD2  LEU  13          3HD2      LEU  13  -9.199   3.042   8.748
  118    H    CYS  14           H        CYS  14  -5.335   5.510   9.490
  119    HA   CYS  14           HA       CYS  14  -5.317   3.859  11.910
  120   1HB   CYS  14          1HB       CYS  14  -4.256   6.687  11.607
  121   2HB   CYS  14          2HB       CYS  14  -4.195   5.700  13.054
  122    HG   CYS  14           HG       CYS  14  -2.895   3.674  11.828
  123    H    GLN  15           H        GLN  15  -6.206   5.553  13.820
  124    HA   GLN  15           HA       GLN  15  -8.905   5.726  13.326
  125   1HB   GLN  15          1HB       GLN  15  -7.246   7.211  15.413
  126   2HB   GLN  15          2HB       GLN  15  -8.987   7.019  15.468
  127   1HG   GLN  15          1HG       GLN  15  -7.098   4.632  15.313
  128   2HG   GLN  15          2HG       GLN  15  -7.588   5.335  16.841
  129   1HE2  GLN  15          1HE2      GLN  15  -8.131   2.731  16.239
  130   2HE2  GLN  15          2HE2      GLN  15  -9.833   2.484  16.023
  131    H    ASP  16           H        ASP  16  -6.583   8.499  13.788
  132    HA   ASP  16           HA       ASP  16  -8.247  10.497  13.141
  133   1HB   ASP  16          1HB       ASP  16  -5.892  10.778  13.883
  134   2HB   ASP  16          2HB       ASP  16  -5.316  10.181  12.340
  135    H    GLY  17           H        GLY  17  -6.720   8.070  11.035
  136   1HA   GLY  17          1HA       GLY  17  -7.711   7.523   8.955
  137   2HA   GLY  17          2HA       GLY  17  -8.166   9.199   8.727
  138    H    SER  18           H        SER  18  -4.971   8.066   9.934
  139    HA   SER  18           HA       SER  18  -3.701   9.619   7.933
  140   1HB   SER  18          1HB       SER  18  -3.016   8.809  10.463
  141   2HB   SER  18          2HB       SER  18  -2.091   7.664   9.514
  142    HG   SER  18           HG       SER  18  -0.851   9.575   9.914
  143    H    PHE  19           H        PHE  19  -1.890   8.646   6.527
  144    HA   PHE  19           HA       PHE  19  -2.698   5.968   5.630
  145   1HB   PHE  19          1HB       PHE  19  -2.173   8.617   4.278
  146   2HB   PHE  19          2HB       PHE  19  -1.518   7.219   3.449
  147    HD1  PHE  19           HD1      PHE  19  -3.933   9.283   2.902
  148    HD2  PHE  19           HD2      PHE  19  -3.635   5.204   4.036
  149    HE1  PHE  19           HE1      PHE  19  -6.183   8.835   1.883
  150    HE2  PHE  19           HE2      PHE  19  -5.885   4.756   3.017
  151    HZ   PHE  19           HZ       PHE  19  -7.132   6.576   1.953
  152    H    TYR  20           H        TYR  20  -1.111   4.458   5.790
  153    HA   TYR  20           HA       TYR  20   1.628   5.255   5.292
  154   1HB   TYR  20          1HB       TYR  20   1.254   5.624   7.748
  155   2HB   TYR  20          2HB       TYR  20   0.493   4.053   7.891
  156    HD1  TYR  20           HD1      TYR  20   1.855   1.982   7.797
  157    HD2  TYR  20           HD2      TYR  20   3.665   5.857   7.702
  158    HE1  TYR  20           HE1      TYR  20   4.107   0.952   8.371
  159    HE2  TYR  20           HE2      TYR  20   5.911   4.814   8.276
  160    HH   TYR  20           HH       TYR  20   6.161   1.477   9.218
  161    H    GLY  21           H        GLY  21   1.953   3.843   3.607
  162   1HA   GLY  21          1HA       GLY  21   1.211   1.019   4.081
  163   2HA   GLY  21          2HA       GLY  21   1.289   1.797   2.512
  164    H    GLY  22           H        GLY  22   2.710  -0.546   2.862
  165   1HA   GLY  22          1HA       GLY  22   5.459   0.422   2.612
  166   2HA   GLY  22          2HA       GLY  22   5.138  -0.792   3.835
  167    H    TYR  23           H        TYR  23   6.899  -1.444   1.813
  168    HA   TYR  23           HA       TYR  23   5.286  -3.226   0.114
  169   1HB   TYR  23          1HB       TYR  23   7.165  -2.907  -1.517
  170   2HB   TYR  23          2HB       TYR  23   6.523  -1.343  -1.057
  171    HD1  TYR  23           HD1      TYR  23   9.440  -3.482  -1.093
  172    HD2  TYR  23           HD2      TYR  23   7.772   0.050   0.653
  173    HE1  TYR  23           HE1      TYR  23  11.761  -2.729  -0.381
  174    HE2  TYR  23           HE2      TYR  23  10.100   0.792   1.358
  175    HH   TYR  23           HH       TYR  23  12.445   0.374   0.539
  176    H    THR  24           H        THR  24   5.390  -5.236   1.018
  177    HA   THR  24           HA       THR  24   7.903  -6.541   1.169
  178    HB   THR  24           HB       THR  24   7.513  -5.000   3.372
  179    HG1  THR  24           HG1      THR  24   9.288  -6.270   3.736
  180   1HG2  THR  24          1HG2      THR  24   6.528  -7.714   4.309
  181   2HG2  THR  24          2HG2      THR  24   6.450  -6.146   5.148
  182   3HG2  THR  24          3HG2      THR  24   5.342  -6.488   3.797
  183    H    THR  25           H        THR  25   7.478  -8.793   2.435
  184    HA   THR  25           HA       THR  25   4.811  -9.690   1.568
  185    HB   THR  25           HB       THR  25   5.823 -11.600   0.517
  186    HG1  THR  25           HG1      THR  25   8.179 -10.589   1.950
  187   1HG2  THR  25          1HG2      THR  25   6.298  -9.583  -0.863
  188   2HG2  THR  25          2HG2      THR  25   7.750  -9.253   0.109
  189   3HG2  THR  25          3HG2      THR  25   7.681 -10.703  -0.920
  190    H    GLU  26           H        GLU  26   3.633 -10.727   3.060
  191    HA   GLU  26           HA       GLU  26   3.141 -11.928   4.821
  192   1HB   GLU  26          1HB       GLU  26   5.813 -12.777   4.355
  193   2HB   GLU  26          2HB       GLU  26   5.726 -12.431   6.070
  194   1HG   GLU  26          1HG       GLU  26   3.381 -13.920   4.981
  195   2HG   GLU  26          2HG       GLU  26   4.898 -14.795   4.913
  196    HA   PRO  27           HA       PRO  27   3.963  -8.148   7.202
  197   1HB   PRO  27          1HB       PRO  27   1.410  -7.174   7.249
  198   2HB   PRO  27          2HB       PRO  27   2.603  -6.680   6.062
  199   1HG   PRO  27          1HG       PRO  27   0.292  -8.493   5.724
  200   2HG   PRO  27          2HG       PRO  27   1.226  -7.662   4.495
  201   1HD   PRO  27          1HD       PRO  27   1.401 -10.437   5.200
  202   2HD   PRO  27          2HD       PRO  27   2.414  -9.581   4.054
  203    H    GLU  28           H        GLU  28   1.528 -10.602   7.451
  204    HA   GLU  28           HA       GLU  28   0.557 -10.174   9.901
  205   1HB   GLU  28          1HB       GLU  28   1.338 -12.737   8.486
  206   2HB   GLU  28          2HB       GLU  28   0.621 -12.795  10.084
  207   1HG   GLU  28          1HG       GLU  28  -0.786 -11.008   8.153
  208   2HG   GLU  28          2HG       GLU  28  -0.817 -12.708   7.730
  209    H    ARG  29           H        ARG  29   3.719 -11.751   9.103
  210    HA   ARG  29           HA       ARG  29   4.340 -12.212  11.794
  211   1HB   ARG  29          1HB       ARG  29   5.686 -12.464   9.147
  212   2HB   ARG  29          2HB       ARG  29   6.790 -12.171  10.478
  213   1HG   ARG  29          1HG       ARG  29   6.123 -14.149  11.634
  214   2HG   ARG  29          2HG       ARG  29   4.629 -14.289  10.730
  215   1HD   ARG  29          1HD       ARG  29   5.774 -15.823   9.473
  216   2HD   ARG  29          2HD       ARG  29   6.466 -14.423   8.677
  217    HE   ARG  29           HE       ARG  29   8.032 -14.892  10.991
  218   1HH1  ARG  29          1HH1      ARG  29   7.252 -16.544   7.983
  219   2HH1  ARG  29          2HH1      ARG  29   8.755 -17.401   7.914
  220   1HH2  ARG  29          1HH2      ARG  29  10.016 -16.024  10.902
  221   2HH2  ARG  29          2HH2      ARG  29  10.339 -17.103   9.586
  222    H    ARG  30           H        ARG  30   5.519  -9.799   9.335
  223    HA   ARG  30           HA       ARG  30   7.251  -8.455  10.901
  224   1HB   ARG  30          1HB       ARG  30   6.485  -8.139   8.375
  225   2HB   ARG  30          2HB       ARG  30   5.399  -6.932   9.037
  226   1HG   ARG  30          1HG       ARG  30   7.854  -6.353  10.282
  227   2HG   ARG  30          2HG       ARG  30   8.321  -6.809   8.656
  228   1HD   ARG  30          1HD       ARG  30   7.908  -4.447   8.556
  229   2HD   ARG  30          2HD       ARG  30   6.514  -5.190   7.797
  230    HE   ARG  30           HE       ARG  30   6.580  -3.967  10.516
  231   1HH1  ARG  30          1HH1      ARG  30   4.740  -5.489   7.931
  232   2HH1  ARG  30          2HH1      ARG  30   3.202  -5.027   8.580
  233   1HH2  ARG  30          1HH2      ARG  30   4.551  -3.359  11.373
  234   2HH2  ARG  30          2HH2      ARG  30   3.095  -3.808  10.551
  235    H    LEU  31           H        LEU  31   3.670  -8.151  10.710
  236    HA   LEU  31           HA       LEU  31   3.385  -5.825  12.190
  237   1HB   LEU  31          1HB       LEU  31   1.734  -7.438  10.844
  238   2HB   LEU  31          2HB       LEU  31   1.377  -8.000  12.465
  239    HG   LEU  31           HG       LEU  31   1.232  -5.088  11.649
  240   1HD1  LEU  31          1HD1      LEU  31  -0.759  -7.297  11.363
  241   2HD1  LEU  31          2HD1      LEU  31  -1.338  -5.686  11.852
  242   3HD1  LEU  31          3HD1      LEU  31  -0.448  -5.884  10.323
  243   1HD2  LEU  31          1HD2      LEU  31  -0.448  -5.977  13.856
  244   2HD2  LEU  31          2HD2      LEU  31   1.283  -6.257  14.166
  245   3HD2  LEU  31          3HD2      LEU  31   0.705  -4.623  13.761
  246    H    THR  32           H        THR  32   3.082  -9.263  13.346
  247    HA   THR  32           HA       THR  32   3.040  -8.529  16.063
  248    HB   THR  32           HB       THR  32   2.124 -10.657  15.223
  249    HG1  THR  32           HG1      THR  32   3.530 -12.027  16.704
  250   1HG2  THR  32          1HG2      THR  32   5.036 -11.205  14.447
  251   2HG2  THR  32          2HG2      THR  32   3.800 -12.480  14.591
  252   3HG2  THR  32          3HG2      THR  32   3.622 -11.203  13.363
  253    H    GLU  33           H        GLU  33   5.641  -8.802  13.736
  254    HA   GLU  33           HA       GLU  33   7.679  -9.406  15.512
  255   1HB   GLU  33          1HB       GLU  33   7.601  -9.268  12.872
  256   2HB   GLU  33          2HB       GLU  33   8.102  -7.607  13.115
  257   1HG   GLU  33          1HG       GLU  33  10.170  -8.715  12.939
  258   2HG   GLU  33          2HG       GLU  33   9.958  -8.623  14.676
  259    H    HIS  34           H        HIS  34   5.775  -6.518  15.043
  260    HA   HIS  34           HA       HIS  34   7.784  -4.889  16.376
  261   1HB   HIS  34          1HB       HIS  34   7.034  -3.558  14.712
  262   2HB   HIS  34          2HB       HIS  34   5.498  -4.389  14.578
  263    HD1  HIS  34           HD1      HIS  34   3.604  -3.680  16.360
  264    HD2  HIS  34           HD2      HIS  34   6.990  -1.210  16.192
  265    HE1  HIS  34           HE1      HIS  34   2.963  -1.507  17.534
  266    H    ASN  35           H        ASN  35   4.830  -6.689  16.917
  267    HA   ASN  35           HA       ASN  35   4.263  -5.222  19.323
  268   1HB   ASN  35          1HB       ASN  35   2.844  -7.114  17.559
  269   2HB   ASN  35          2HB       ASN  35   2.644  -7.547  19.245
  270   1HD2  ASN  35          1HD2      ASN  35   1.224  -5.973  16.850
  271   2HD2  ASN  35          2HD2      ASN  35   0.387  -4.701  17.676
  272    H    SER  36           H        SER  36   6.728  -7.095  18.679
  273    HA   SER  36           HA       SER  36   6.311  -9.222  20.550
  274   1HB   SER  36          1HB       SER  36   7.715  -9.243  18.326
  275   2HB   SER  36          2HB       SER  36   8.971  -8.491  19.291
  276    HG   SER  36           HG       SER  36   8.229 -10.487  20.813
  277    H    GLY  37           H        GLY  37   8.532  -6.362  20.186
  278   1HA   GLY  37          1HA       GLY  37   8.343  -5.395  22.738
  279   2HA   GLY  37          2HA       GLY  37   9.582  -6.630  22.836
  280    H    THR  38           H        THR  38   8.586  -3.838  20.733
  281    HA   THR  38           HA       THR  38  11.438  -3.350  20.221
  282    HB   THR  38           HB       THR  38  10.314  -1.847  18.378
  283    HG1  THR  38           HG1      THR  38   8.165  -1.944  19.256
  284   1HG2  THR  38          1HG2      THR  38  10.539  -3.603  16.904
  285   2HG2  THR  38          2HG2      THR  38  11.099  -4.521  18.323
  286   3HG2  THR  38          3HG2      THR  38   9.395  -4.619  17.813
  287    H    GLY  39           H        GLY  39  12.479  -1.653  21.074
  288   1HA   GLY  39          1HA       GLY  39  10.882   0.180  22.720
  289   2HA   GLY  39          2HA       GLY  39  12.605  -0.115  22.833
  290    H    ALA  40           H        ALA  40  11.803   2.507  22.794
  291    HA   ALA  40           HA       ALA  40  13.170   3.500  20.540
  292   1HB   ALA  40          1HB       ALA  40  10.139   3.752  20.573
  293   2HB   ALA  40          2HB       ALA  40  11.205   4.795  19.600
  294   3HB   ALA  40          3HB       ALA  40  11.158   3.043  19.298
  295    H    LYS  41           H        LYS  41  13.685   5.739  20.821
  296    HA   LYS  41           HA       LYS  41  12.948   6.707  23.489
  297   1HB   LYS  41          1HB       LYS  41  15.023   7.923  23.489
  298   2HB   LYS  41          2HB       LYS  41  15.349   6.248  23.096
  299   1HG   LYS  41          1HG       LYS  41  16.430   6.974  21.238
  300   2HG   LYS  41          2HG       LYS  41  14.873   7.448  20.589
  301   1HD   LYS  41          1HD       LYS  41  15.167   9.660  21.924
  302   2HD   LYS  41          2HD       LYS  41  16.835   9.174  22.153
  303   1HE   LYS  41          1HE       LYS  41  16.308   8.789  19.378
  304   2HE   LYS  41          2HE       LYS  41  15.568  10.324  19.786
  305   1HZ   LYS  41          1HZ       LYS  41  18.233   9.824  19.412
  306   2HZ   LYS  41          2HZ       LYS  41  17.558  11.221  19.923
  307   3HZ   LYS  41          3HZ       LYS  41  18.079  10.119  21.011
  308    H    TYR  42           H        TYR  42  12.459   7.133  20.100
  309    HA   TYR  42           HA       TYR  42  10.597   9.132  20.393
  310   1HB   TYR  42          1HB       TYR  42  13.490   9.941  20.215
  311   2HB   TYR  42          2HB       TYR  42  12.458  10.768  19.066
  312    HD1  TYR  42           HD1      TYR  42  10.028  11.405  20.388
  313    HD2  TYR  42           HD2      TYR  42  13.966  11.257  22.055
  314    HE1  TYR  42           HE1      TYR  42   9.328  13.040  22.204
  315    HE2  TYR  42           HE2      TYR  42  13.251  12.893  23.867
  316    HH   TYR  42           HH       TYR  42  11.312  14.791  23.913
  317    H    THR  43           H        THR  43   9.964   7.242  18.934
  318    HA   THR  43           HA       THR  43  10.125   8.134  16.226
  319    HB   THR  43           HB       THR  43  11.629   5.637  17.143
  320    HG1  THR  43           HG1      THR  43  12.963   7.468  16.986
  321   1HG2  THR  43          1HG2      THR  43  10.086   5.903  14.747
  322   2HG2  THR  43          2HG2      THR  43  11.778   6.212  14.288
  323   3HG2  THR  43          3HG2      THR  43  11.337   4.683  15.087
  324    H    ARG  44           H        ARG  44   9.487   5.170  18.222
  325    HA   ARG  44           HA       ARG  44   7.114   4.772  16.667
  326   1HB   ARG  44          1HB       ARG  44   8.861   3.148  18.357
  327   2HB   ARG  44          2HB       ARG  44   7.194   2.930  18.852
  328   1HG   ARG  44          1HG       ARG  44   7.543   1.291  17.147
  329   2HG   ARG  44          2HG       ARG  44   6.627   2.564  16.365
  330   1HD   ARG  44          1HD       ARG  44   8.480   3.334  15.125
  331   2HD   ARG  44          2HD       ARG  44   9.645   2.712  16.277
  332    HE   ARG  44           HE       ARG  44   8.093   0.578  15.037
  333   1HH1  ARG  44          1HH1      ARG  44  10.857   2.709  14.588
  334   2HH1  ARG  44          2HH1      ARG  44  11.659   1.645  13.481
  335   1HH2  ARG  44          1HH2      ARG  44   9.150  -0.825  13.576
  336   2HH2  ARG  44          2HH2      ARG  44  10.681  -0.379  12.900
  337    H    LEU  45           H        LEU  45   7.677   7.022  18.818
  338    HA   LEU  45           HA       LEU  45   6.277   6.732  21.092
  339   1HB   LEU  45          1HB       LEU  45   7.487   8.764  19.905
  340   2HB   LEU  45          2HB       LEU  45   5.843   9.217  19.499
  341    HG   LEU  45           HG       LEU  45   6.642  10.338  21.527
  342   1HD1  LEU  45          1HD1      LEU  45   4.743   9.524  23.080
  343   2HD1  LEU  45          2HD1      LEU  45   4.323  10.189  21.482
  344   3HD1  LEU  45          3HD1      LEU  45   4.327   8.426  21.740
  345   1HD2  LEU  45          1HD2      LEU  45   6.559   7.820  23.123
  346   2HD2  LEU  45          2HD2      LEU  45   8.013   8.149  22.151
  347   3HD2  LEU  45          3HD2      LEU  45   7.482   9.319  23.383
  348    H    ALA  46           H        ALA  46   4.781   7.931  17.997
  349    HA   ALA  46           HA       ALA  46   2.188   7.931  18.827
  350   1HB   ALA  46          1HB       ALA  46   3.032   8.796  16.666
  351   2HB   ALA  46          2HB       ALA  46   3.284   7.127  16.100
  352   3HB   ALA  46          3HB       ALA  46   1.638   7.715  16.435
  353    H    LYS  47           H        LYS  47   0.542   6.431  19.111
  354    HA   LYS  47           HA       LYS  47   1.292   3.821  19.752
  355   1HB   LYS  47          1HB       LYS  47  -1.381   5.161  19.308
  356   2HB   LYS  47          2HB       LYS  47  -1.248   3.474  19.762
  357   1HG   LYS  47          1HG       LYS  47  -0.625   3.966  21.913
  358   2HG   LYS  47          2HG       LYS  47   0.447   5.259  21.414
  359   1HD   LYS  47          1HD       LYS  47  -1.638   6.683  20.962
  360   2HD   LYS  47          2HD       LYS  47  -2.587   5.414  21.707
  361   1HE   LYS  47          1HE       LYS  47  -0.366   6.002  23.461
  362   2HE   LYS  47          2HE       LYS  47  -1.103   7.524  22.999
  363   1HZ   LYS  47          1HZ       LYS  47  -3.266   6.234  23.517
  364   2HZ   LYS  47          2HZ       LYS  47  -2.289   5.291  24.425
  365   3HZ   LYS  47          3HZ       LYS  47  -2.396   6.891  24.733
  366    H    ARG  48           H        ARG  48  -0.998   4.800  17.103
  367    HA   ARG  48           HA       ARG  48  -1.394   3.948  15.159
  368   1HB   ARG  48          1HB       ARG  48   1.207   4.513  15.013
  369   2HB   ARG  48          2HB       ARG  48   1.396   2.772  14.949
  370   1HG   ARG  48          1HG       ARG  48  -0.739   3.623  13.140
  371   2HG   ARG  48          2HG       ARG  48   0.733   4.510  12.798
  372   1HD   ARG  48          1HD       ARG  48   0.499   1.467  12.973
  373   2HD   ARG  48          2HD       ARG  48   0.635   2.393  11.493
  374    HE   ARG  48           HE       ARG  48   2.796   1.794  13.388
  375   1HH1  ARG  48          1HH1      ARG  48   1.735   3.892  10.770
  376   2HH1  ARG  48          2HH1      ARG  48   3.342   4.358  10.322
  377   1HH2  ARG  48          1HH2      ARG  48   4.916   2.407  12.798
  378   2HH2  ARG  48          2HH2      ARG  48   5.164   3.508  11.483
  379    H    ARG  49           H        ARG  49  -2.031   2.298  17.419
  380    HA   ARG  49           HA       ARG  49  -1.095  -0.315  16.986
  381   1HB   ARG  49          1HB       ARG  49  -2.675   1.081  18.935
  382   2HB   ARG  49          2HB       ARG  49  -3.655  -0.259  18.376
  383   1HG   ARG  49          1HG       ARG  49  -1.398  -1.650  18.685
  384   2HG   ARG  49          2HG       ARG  49  -0.960  -0.327  19.746
  385   1HD   ARG  49          1HD       ARG  49  -3.396  -0.742  20.768
  386   2HD   ARG  49          2HD       ARG  49  -3.211  -2.327  20.041
  387    HE   ARG  49           HE       ARG  49  -0.807  -1.801  21.441
  388   1HH1  ARG  49          1HH1      ARG  49  -4.219  -2.227  22.187
  389   2HH1  ARG  49          2HH1      ARG  49  -3.926  -2.848  23.777
  390   1HH2  ARG  49          1HH2      ARG  49  -0.418  -2.621  23.540
  391   2HH2  ARG  49          2HH2      ARG  49  -1.749  -3.074  24.551
  392    HA   PRO  50           HA       PRO  50  -5.375  -0.766  14.950
  393   1HB   PRO  50          1HB       PRO  50  -6.900   1.450  14.473
  394   2HB   PRO  50          2HB       PRO  50  -7.102   0.435  15.885
  395   1HG   PRO  50          1HG       PRO  50  -5.855   3.107  15.688
  396   2HG   PRO  50          2HG       PRO  50  -6.444   2.273  17.113
  397   1HD   PRO  50          1HD       PRO  50  -3.707   2.577  16.310
  398   2HD   PRO  50          2HD       PRO  50  -4.303   1.646  17.671
  399    H    VAL  51           H        VAL  51  -4.907  -1.487  12.979
  400    HA   VAL  51           HA       VAL  51  -4.431   0.602  11.001
  401    HB   VAL  51           HB       VAL  51  -2.527  -0.737  10.104
  402   1HG1  VAL  51          1HG1      VAL  51  -1.731   1.147  11.133
  403   2HG1  VAL  51          2HG1      VAL  51  -2.475   0.747  12.700
  404   3HG1  VAL  51          3HG1      VAL  51  -0.990  -0.086  12.182
  405   1HG2  VAL  51          1HG2      VAL  51  -2.916  -2.885  11.110
  406   2HG2  VAL  51          2HG2      VAL  51  -1.363  -2.266  11.723
  407   3HG2  VAL  51          3HG2      VAL  51  -2.817  -2.197  12.748
  408    H    ILE  52           H        ILE  52  -5.862   0.281   9.385
  409    HA   ILE  52           HA       ILE  52  -6.750  -2.486   8.950
  410    HB   ILE  52           HB       ILE  52  -8.839  -1.637   8.233
  411   1HG1  ILE  52          1HG1      ILE  52  -8.040   1.224   8.687
  412   2HG1  ILE  52          2HG1      ILE  52  -7.667   0.452   7.158
  413   1HG2  ILE  52          1HG2      ILE  52  -8.053  -0.079  10.710
  414   2HG2  ILE  52          2HG2      ILE  52  -9.686  -0.612  10.243
  415   3HG2  ILE  52          3HG2      ILE  52  -8.449  -1.815  10.679
  416   1HD1  ILE  52          1HD1      ILE  52  -9.991   1.696   7.508
  417   2HD1  ILE  52          2HD1      ILE  52  -9.916   0.184   6.573
  418   3HD1  ILE  52          3HD1      ILE  52 -10.459   0.155   8.267
  419    H    MET  53           H        MET  53  -7.129  -3.147   6.706
  420    HA   MET  53           HA       MET  53  -5.203  -1.817   4.987
  421   1HB   MET  53          1HB       MET  53  -6.150  -4.589   5.440
  422   2HB   MET  53          2HB       MET  53  -6.116  -4.187   3.735
  423   1HG   MET  53          1HG       MET  53  -3.815  -4.056   3.668
  424   2HG   MET  53          2HG       MET  53  -3.704  -3.297   5.244
  425   1HE   MET  53          1HE       MET  53  -2.517  -4.342   6.951
  426   2HE   MET  53          2HE       MET  53  -1.984  -6.040   6.967
  427   3HE   MET  53          3HE       MET  53  -1.496  -4.966   5.634
  428    H    ILE  54           H        ILE  54  -6.067  -0.285   3.649
  429    HA   ILE  54           HA       ILE  54  -8.757  -0.807   2.603
  430    HB   ILE  54           HB       ILE  54  -9.117   1.471   2.490
  431   1HG1  ILE  54          1HG1      ILE  54  -7.013   2.036   1.314
  432   2HG1  ILE  54          2HG1      ILE  54  -7.451   3.203   2.544
  433   1HG2  ILE  54          1HG2      ILE  54  -9.258   0.866   4.762
  434   2HG2  ILE  54          2HG2      ILE  54  -7.488   0.836   4.952
  435   3HG2  ILE  54          3HG2      ILE  54  -8.333   2.387   4.731
  436   1HD1  ILE  54          1HD1      ILE  54  -5.165   2.878   2.976
  437   2HD1  ILE  54          2HD1      ILE  54  -5.915   1.741   4.124
  438   3HD1  ILE  54          3HD1      ILE  54  -5.238   1.141   2.591
  439    H    HIS  55           H        HIS  55  -5.416  -0.881   1.859
  440    HA   HIS  55           HA       HIS  55  -6.103  -0.830  -0.985
  441   1HB   HIS  55          1HB       HIS  55  -3.708   0.388   0.399
  442   2HB   HIS  55          2HB       HIS  55  -3.698  -0.000  -1.310
  443    HD1  HIS  55           HD1      HIS  55  -6.310   1.007  -2.367
  444    HD2  HIS  55           HD2      HIS  55  -4.170   3.060   0.598
  445    HE1  HIS  55           HE1      HIS  55  -7.104   3.431  -2.462
  446    H    THR  56           H        THR  56  -4.835  -2.304  -2.330
  447    HA   THR  56           HA       THR  56  -3.045  -4.140  -1.044
  448    HB   THR  56           HB       THR  56  -4.611  -6.119  -1.675
  449    HG1  THR  56           HG1      THR  56  -6.427  -3.816  -1.520
  450   1HG2  THR  56          1HG2      THR  56  -4.314  -5.104   0.732
  451   2HG2  THR  56          2HG2      THR  56  -5.872  -4.301   0.420
  452   3HG2  THR  56          3HG2      THR  56  -5.770  -6.078   0.417
  453    H    GLU  57           H        GLU  57  -1.444  -4.223  -2.480
  454    HA   GLU  57           HA       GLU  57  -2.176  -4.877  -5.189
  455   1HB   GLU  57          1HB       GLU  57  -1.492  -2.215  -4.468
  456   2HB   GLU  57          2HB       GLU  57  -0.067  -2.864  -5.253
  457   1HG   GLU  57          1HG       GLU  57  -1.171  -3.217  -7.295
  458   2HG   GLU  57          2HG       GLU  57  -2.742  -3.398  -6.541
  459    H    LYS  58           H        LYS  58  -0.253  -5.658  -6.466
  460    HA   LYS  58           HA       LYS  58   2.009  -6.372  -4.758
  461   1HB   LYS  58          1HB       LYS  58   1.950  -8.681  -5.526
  462   2HB   LYS  58          2HB       LYS  58   0.474  -8.273  -4.675
  463   1HG   LYS  58          1HG       LYS  58  -0.294  -7.619  -7.210
  464   2HG   LYS  58          2HG       LYS  58   0.890  -8.853  -7.589
  465   1HD   LYS  58          1HD       LYS  58  -0.573 -10.482  -7.010
  466   2HD   LYS  58          2HD       LYS  58  -0.699  -9.827  -5.390
  467   1HE   LYS  58          1HE       LYS  58  -2.883  -9.421  -5.938
  468   2HE   LYS  58          2HE       LYS  58  -2.252  -8.022  -6.786
  469   1HZ   LYS  58          1HZ       LYS  58  -3.509  -9.190  -8.326
  470   2HZ   LYS  58          2HZ       LYS  58  -1.972  -9.576  -8.720
  471   3HZ   LYS  58          3HZ       LYS  58  -2.902 -10.647  -7.908
  472    H    PHE  59           H        PHE  59   3.971  -6.166  -5.770
  473    HA   PHE  59           HA       PHE  59   3.872  -5.772  -8.675
  474   1HB   PHE  59          1HB       PHE  59   5.653  -4.327  -6.629
  475   2HB   PHE  59          2HB       PHE  59   5.493  -3.923  -8.326
  476    HD1  PHE  59           HD1      PHE  59   2.528  -4.010  -8.623
  477    HD2  PHE  59           HD2      PHE  59   4.956  -2.385  -5.543
  478    HE1  PHE  59           HE1      PHE  59   0.714  -2.369  -8.059
  479    HE2  PHE  59           HE2      PHE  59   3.142  -0.744  -4.980
  480    HZ   PHE  59           HZ       PHE  59   1.043  -0.755  -6.245
  481    H    GLU  60           H        GLU  60   5.110  -7.263  -9.700
  482    HA   GLU  60           HA       GLU  60   6.917  -8.827  -8.181
  483   1HB   GLU  60          1HB       GLU  60   5.464  -9.618 -10.137
  484   2HB   GLU  60          2HB       GLU  60   6.578  -8.791 -11.208
  485   1HG   GLU  60          1HG       GLU  60   8.452 -10.175 -10.430
  486   2HG   GLU  60          2HG       GLU  60   7.455 -10.904  -9.186
  487    H    THR  61           H        THR  61   7.125  -6.126 -10.521
  488    HA   THR  61           HA       THR  61  10.053  -6.240 -10.345
  489    HB   THR  61           HB       THR  61   9.912  -4.745 -12.351
  490    HG1  THR  61           HG1      THR  61   7.898  -3.885 -12.789
  491   1HG2  THR  61          1HG2      THR  61   8.858  -6.297 -13.936
  492   2HG2  THR  61          2HG2      THR  61   9.713  -7.261 -12.707
  493   3HG2  THR  61          3HG2      THR  61   7.944  -7.076 -12.622
  494    H    ARG  62           H        ARG  62  11.256  -4.235  -9.999
  495    HA   ARG  62           HA       ARG  62   9.997  -2.800  -7.881
  496   1HB   ARG  62          1HB       ARG  62  12.665  -3.503  -8.593
  497   2HB   ARG  62          2HB       ARG  62  12.614  -1.754  -8.683
  498   1HG   ARG  62          1HG       ARG  62  11.212  -2.771  -6.298
  499   2HG   ARG  62          2HG       ARG  62  12.883  -3.296  -6.345
  500   1HD   ARG  62          1HD       ARG  62  12.478  -0.429  -7.065
  501   2HD   ARG  62          2HD       ARG  62  12.038  -0.828  -5.415
  502    HE   ARG  62           HE       ARG  62  14.549  -2.060  -5.932
  503   1HH1  ARG  62          1HH1      ARG  62  13.200   1.180  -5.665
  504   2HH1  ARG  62          2HH1      ARG  62  14.685   1.894  -5.133
  505   1HH2  ARG  62          1HH2      ARG  62  16.509  -1.118  -5.229
  506   2HH2  ARG  62          2HH2      ARG  62  16.580   0.577  -4.884
  507    H    SER  63           H        SER  63  11.189  -2.237 -11.229
  508    HA   SER  63           HA       SER  63  11.191   0.440 -11.367
  509   1HB   SER  63          1HB       SER  63  10.362  -1.700 -13.339
  510   2HB   SER  63          2HB       SER  63  10.217  -0.013 -13.796
  511    HG   SER  63           HG       SER  63  12.680  -0.564 -12.617
  512    H    GLU  64           H        GLU  64   8.331  -1.767 -11.553
  513    HA   GLU  64           HA       GLU  64   6.543   0.383 -11.985
  514   1HB   GLU  64          1HB       GLU  64   6.300  -2.578 -11.478
  515   2HB   GLU  64          2HB       GLU  64   4.873  -1.582 -11.265
  516   1HG   GLU  64          1HG       GLU  64   6.574  -1.431 -13.789
  517   2HG   GLU  64          2HG       GLU  64   5.273  -2.593 -13.621
  518    H    ALA  65           H        ALA  65   7.754  -1.473  -9.174
  519    HA   ALA  65           HA       ALA  65   5.854  -0.636  -7.314
  520   1HB   ALA  65          1HB       ALA  65   7.351  -1.522  -5.710
  521   2HB   ALA  65          2HB       ALA  65   7.679  -2.466  -7.185
  522   3HB   ALA  65          3HB       ALA  65   8.778  -1.150  -6.706
  523    H    THR  66           H        THR  66   9.118   0.725  -8.153
  524    HA   THR  66           HA       THR  66   8.869   2.928  -6.408
  525    HB   THR  66           HB       THR  66  10.998   1.909  -7.384
  526    HG1  THR  66           HG1      THR  66  10.413   4.718  -8.007
  527   1HG2  THR  66          1HG2      THR  66  10.672   1.676  -9.730
  528   2HG2  THR  66          2HG2      THR  66   9.834   3.241  -9.857
  529   3HG2  THR  66          3HG2      THR  66  11.597   3.193  -9.621
  530    H    LYS  67           H        LYS  67   7.728   2.297  -9.706
  531    HA   LYS  67           HA       LYS  67   7.265   5.020 -10.328
  532   1HB   LYS  67          1HB       LYS  67   7.573   3.354 -12.065
  533   2HB   LYS  67          2HB       LYS  67   6.182   2.447 -11.509
  534   1HG   LYS  67          1HG       LYS  67   4.643   4.029 -12.309
  535   2HG   LYS  67          2HG       LYS  67   5.779   5.359 -12.190
  536   1HD   LYS  67          1HD       LYS  67   6.667   3.267 -14.085
  537   2HD   LYS  67          2HD       LYS  67   5.124   3.967 -14.529
  538   1HE   LYS  67          1HE       LYS  67   6.539   6.240 -13.851
  539   2HE   LYS  67          2HE       LYS  67   7.830   5.226 -14.465
  540   1HZ   LYS  67          1HZ       LYS  67   5.640   4.997 -16.162
  541   2HZ   LYS  67          2HZ       LYS  67   5.918   6.589 -15.916
  542   3HZ   LYS  67          3HZ       LYS  67   7.111   5.630 -16.488
  543    H    ALA  68           H        ALA  68   5.360   2.383  -8.808
  544    HA   ALA  68           HA       ALA  68   2.914   3.768  -8.815
  545   1HB   ALA  68          1HB       ALA  68   3.934   1.245  -8.035
  546   2HB   ALA  68          2HB       ALA  68   3.214   1.957  -6.571
  547   3HB   ALA  68          3HB       ALA  68   2.233   1.770  -8.045
  548    H    GLU  69           H        GLU  69   5.821   3.896  -6.785
  549    HA   GLU  69           HA       GLU  69   4.528   5.178  -4.630
  550   1HB   GLU  69          1HB       GLU  69   6.872   3.880  -4.848
  551   2HB   GLU  69          2HB       GLU  69   7.480   5.501  -5.119
  552   1HG   GLU  69          1HG       GLU  69   5.677   4.826  -2.756
  553   2HG   GLU  69          2HG       GLU  69   7.421   4.667  -2.670
  554    H    ALA  70           H        ALA  70   6.688   6.299  -7.327
  555    HA   ALA  70           HA       ALA  70   6.856   8.939  -6.726
  556   1HB   ALA  70          1HB       ALA  70   6.373   8.610  -9.560
  557   2HB   ALA  70          2HB       ALA  70   7.910   8.899  -8.710
  558   3HB   ALA  70          3HB       ALA  70   7.323   7.235  -8.948
  559    H    ALA  71           H        ALA  71   4.138   7.203  -8.355
  560    HA   ALA  71           HA       ALA  71   2.630   9.513  -8.875
  561   1HB   ALA  71          1HB       ALA  71   0.790   7.495  -8.672
  562   2HB   ALA  71          2HB       ALA  71   1.797   7.794 -10.108
  563   3HB   ALA  71          3HB       ALA  71   2.289   6.567  -8.917
  564    H    PHE  72           H        PHE  72   2.511   7.073  -6.186
  565    HA   PHE  72           HA       PHE  72   0.427   8.066  -4.775
  566   1HB   PHE  72          1HB       PHE  72   2.870   6.481  -4.385
  567   2HB   PHE  72          2HB       PHE  72   2.583   7.443  -2.949
  568    HD1  PHE  72           HD1      PHE  72   1.248   4.772  -5.082
  569    HD2  PHE  72           HD2      PHE  72   0.695   7.002  -1.513
  570    HE1  PHE  72           HE1      PHE  72  -0.448   3.095  -4.297
  571    HE2  PHE  72           HE2      PHE  72  -0.999   5.325  -0.728
  572    HZ   PHE  72           HZ       PHE  72  -1.551   3.393  -2.130
  573    H    LYS  73           H        LYS  73   3.589   9.550  -5.276
  574    HA   LYS  73           HA       LYS  73   3.428  11.275  -3.013
  575   1HB   LYS  73          1HB       LYS  73   5.411  10.462  -4.775
  576   2HB   LYS  73          2HB       LYS  73   5.150  12.135  -5.223
  577   1HG   LYS  73          1HG       LYS  73   5.105  12.150  -2.393
  578   2HG   LYS  73          2HG       LYS  73   6.395  11.038  -2.802
  579   1HD   LYS  73          1HD       LYS  73   7.120  12.925  -4.521
  580   2HD   LYS  73          2HD       LYS  73   6.134  13.970  -3.520
  581   1HE   LYS  73          1HE       LYS  73   7.451  13.289  -1.504
  582   2HE   LYS  73          2HE       LYS  73   8.433  12.235  -2.499
  583   1HZ   LYS  73          1HZ       LYS  73   8.738  14.955  -2.089
  584   2HZ   LYS  73          2HZ       LYS  73   9.667  13.967  -2.999
  585   3HZ   LYS  73          3HZ       LYS  73   8.400  14.746  -3.673
  586    H    LYS  74           H        LYS  74   2.509  11.413  -6.478
  587    HA   LYS  74           HA       LYS  74   1.767  14.183  -6.258
  588   1HB   LYS  74          1HB       LYS  74   1.796  12.113  -8.430
  589   2HB   LYS  74          2HB       LYS  74   0.798  13.540  -8.629
  590   1HG   LYS  74          1HG       LYS  74   2.759  15.007  -8.252
  591   2HG   LYS  74          2HG       LYS  74   3.773  13.614  -7.935
  592   1HD   LYS  74          1HD       LYS  74   2.260  13.780 -10.554
  593   2HD   LYS  74          2HD       LYS  74   3.732  14.709 -10.354
  594   1HE   LYS  74          1HE       LYS  74   4.984  12.634  -9.771
  595   2HE   LYS  74          2HE       LYS  74   3.512  11.692  -9.912
  596   1HZ   LYS  74          1HZ       LYS  74   4.046  11.492 -12.028
  597   2HZ   LYS  74          2HZ       LYS  74   3.667  13.067 -12.243
  598   3HZ   LYS  74          3HZ       LYS  74   5.215  12.633 -11.955
  599    H    LEU  75           H        LEU  75   0.152  10.961  -6.425
  600    HA   LEU  75           HA       LEU  75  -2.452  11.855  -6.557
  601   1HB   LEU  75          1HB       LEU  75  -1.374   9.412  -5.144
  602   2HB   LEU  75          2HB       LEU  75  -3.040   9.671  -5.622
  603    HG   LEU  75           HG       LEU  75  -0.711   9.513  -7.556
  604   1HD1  LEU  75          1HD1      LEU  75  -1.561   7.413  -6.111
  605   2HD1  LEU  75          2HD1      LEU  75  -2.737   7.346  -7.446
  606   3HD1  LEU  75          3HD1      LEU  75  -0.993   7.281  -7.793
  607   1HD2  LEU  75          1HD2      LEU  75  -3.664   9.320  -8.172
  608   2HD2  LEU  75          2HD2      LEU  75  -2.746  10.842  -8.251
  609   3HD2  LEU  75          3HD2      LEU  75  -2.303   9.481  -9.308
  610    H    THR  76           H        THR  76  -4.129  11.732  -4.751
  611    HA   THR  76           HA       THR  76  -2.988  12.691  -2.218
  612    HB   THR  76           HB       THR  76  -3.662  14.710  -3.342
  613    HG1  THR  76           HG1      THR  76  -4.961  15.156  -1.605
  614   1HG2  THR  76          1HG2      THR  76  -5.876  14.973  -4.410
  615   2HG2  THR  76          2HG2      THR  76  -5.012  13.626  -5.189
  616   3HG2  THR  76          3HG2      THR  76  -6.297  13.292  -4.003
  617    H    ARG  77           H        ARG  77  -5.028  12.900  -0.589
  618    HA   ARG  77           HA       ARG  77  -5.627  10.388   0.107
  619   1HB   ARG  77          1HB       ARG  77  -6.021  12.402   1.527
  620   2HB   ARG  77          2HB       ARG  77  -7.373  12.869   0.516
  621   1HG   ARG  77          1HG       ARG  77  -7.792  10.129   1.308
  622   2HG   ARG  77          2HG       ARG  77  -7.350  11.030   2.745
  623   1HD   ARG  77          1HD       ARG  77  -9.242  12.396   2.654
  624   2HD   ARG  77          2HD       ARG  77  -9.351  12.322   0.906
  625    HE   ARG  77           HE       ARG  77 -10.646  10.365   1.077
  626   1HH1  ARG  77          1HH1      ARG  77  -9.147  11.068   4.183
  627   2HH1  ARG  77          2HH1      ARG  77 -10.059   9.869   5.039
  628   1HH2  ARG  77          1HH2      ARG  77 -11.849   8.785   2.205
  629   2HH2  ARG  77          2HH2      ARG  77 -11.605   8.561   3.906
  630    H    LYS  78           H        LYS  78  -6.971  12.225  -2.536
  631    HA   LYS  78           HA       LYS  78  -9.295  10.467  -2.714
  632   1HB   LYS  78          1HB       LYS  78  -9.048  13.171  -3.085
  633   2HB   LYS  78          2HB       LYS  78  -8.923  12.590  -4.732
  634   1HG   LYS  78          1HG       LYS  78 -11.017  11.147  -4.232
  635   2HG   LYS  78          2HG       LYS  78 -11.187  12.079  -2.758
  636   1HD   LYS  78          1HD       LYS  78 -11.296  14.186  -4.083
  637   2HD   LYS  78          2HD       LYS  78 -11.078  13.279  -5.566
  638   1HE   LYS  78          1HE       LYS  78 -13.201  12.065  -5.183
  639   2HE   LYS  78          2HE       LYS  78 -13.402  12.850  -3.629
  640   1HZ   LYS  78          1HZ       LYS  78 -13.419  14.144  -6.263
  641   2HZ   LYS  78          2HZ       LYS  78 -14.666  14.015  -5.216
  642   3HZ   LYS  78          3HZ       LYS  78 -13.395  14.977  -4.858
  643    H    GLN  79           H        GLN  79  -7.009  11.888  -5.152
  644    HA   GLN  79           HA       GLN  79  -7.308  10.144  -7.097
  645   1HB   GLN  79          1HB       GLN  79  -5.296  11.997  -6.306
  646   2HB   GLN  79          2HB       GLN  79  -4.444  10.530  -6.744
  647   1HG   GLN  79          1HG       GLN  79  -4.623  11.579  -8.829
  648   2HG   GLN  79          2HG       GLN  79  -6.030  10.535  -8.860
  649   1HE2  GLN  79          1HE2      GLN  79  -4.848  13.791  -8.389
  650   2HE2  GLN  79          2HE2      GLN  79  -6.345  14.633  -8.616
  651    H    LYS  80           H        LYS  80  -5.679   9.506  -3.995
  652    HA   LYS  80           HA       LYS  80  -4.457   7.088  -4.806
  653   1HB   LYS  80          1HB       LYS  80  -5.004   8.462  -2.191
  654   2HB   LYS  80          2HB       LYS  80  -4.482   6.788  -2.191
  655   1HG   LYS  80          1HG       LYS  80  -2.346   7.341  -2.764
  656   2HG   LYS  80          2HG       LYS  80  -2.879   8.402  -4.054
  657   1HD   LYS  80          1HD       LYS  80  -2.904  10.291  -2.697
  658   2HD   LYS  80          2HD       LYS  80  -3.325   9.389  -1.254
  659   1HE   LYS  80          1HE       LYS  80  -0.693   8.570  -2.249
  660   2HE   LYS  80          2HE       LYS  80  -0.746  10.303  -2.000
  661   1HZ   LYS  80          1HZ       LYS  80  -1.308  10.011   0.217
  662   2HZ   LYS  80          2HZ       LYS  80  -1.744   8.448   0.031
  663   3HZ   LYS  80          3HZ       LYS  80  -0.168   8.870  -0.038
  664    H    GLU  81           H        GLU  81  -7.253   7.621  -2.541
  665    HA   GLU  81           HA       GLU  81  -8.113   5.142  -2.295
  666   1HB   GLU  81          1HB       GLU  81  -9.143   7.340  -1.422
  667   2HB   GLU  81          2HB       GLU  81 -10.063   7.395  -2.911
  668   1HG   GLU  81          1HG       GLU  81 -11.602   6.110  -1.828
  669   2HG   GLU  81          2HG       GLU  81 -10.493   4.777  -2.084
  670    H    GLN  82           H        GLN  82  -8.665   7.243  -5.172
  671    HA   GLN  82           HA       GLN  82 -10.250   5.261  -6.444
  672   1HB   GLN  82          1HB       GLN  82  -9.301   8.017  -7.032
  673   2HB   GLN  82          2HB       GLN  82  -9.513   7.007  -8.448
  674   1HG   GLN  82          1HG       GLN  82 -11.618   7.531  -6.296
  675   2HG   GLN  82          2HG       GLN  82 -11.607   8.220  -7.907
  676   1HE2  GLN  82          1HE2      GLN  82 -12.646   5.703  -5.959
  677   2HE2  GLN  82          2HE2      GLN  82 -13.215   4.593  -7.161
  678    H    TYR  83           H        TYR  83  -6.949   6.675  -7.031
  679    HA   TYR  83           HA       TYR  83  -6.082   5.305  -9.132
  680   1HB   TYR  83          1HB       TYR  83  -4.599   6.785  -7.907
  681   2HB   TYR  83          2HB       TYR  83  -4.905   5.965  -6.390
  682    HD1  TYR  83           HD1      TYR  83  -3.970   4.336  -9.609
  683    HD2  TYR  83           HD2      TYR  83  -2.691   5.491  -5.693
  684    HE1  TYR  83           HE1      TYR  83  -1.835   2.987  -9.901
  685    HE2  TYR  83           HE2      TYR  83  -0.559   4.140  -5.997
  686    HH   TYR  83           HH       TYR  83   0.717   3.349  -8.575
  687    H    LEU  84           H        LEU  84  -6.597   3.932  -5.854
  688    HA   LEU  84           HA       LEU  84  -5.539   1.380  -6.733
  689   1HB   LEU  84          1HB       LEU  84  -6.563   2.430  -4.099
  690   2HB   LEU  84          2HB       LEU  84  -6.155   0.744  -4.355
  691    HG   LEU  84           HG       LEU  84  -3.906   2.141  -5.265
  692   1HD1  LEU  84          1HD1      LEU  84  -3.566   4.001  -4.092
  693   2HD1  LEU  84          2HD1      LEU  84  -5.291   3.933  -3.660
  694   3HD1  LEU  84          3HD1      LEU  84  -4.074   3.231  -2.570
  695   1HD2  LEU  84          1HD2      LEU  84  -4.640   0.304  -3.100
  696   2HD2  LEU  84          2HD2      LEU  84  -3.230   0.304  -4.187
  697   3HD2  LEU  84          3HD2      LEU  84  -3.231   1.326  -2.730
  698    H    LYS  85           H        LYS  85  -8.651   2.717  -5.414
  699    HA   LYS  85           HA       LYS  85 -10.188   0.493  -5.668
  700   1HB   LYS  85          1HB       LYS  85 -10.727   3.434  -5.829
  701   2HB   LYS  85          2HB       LYS  85 -12.020   2.329  -6.249
  702   1HG   LYS  85          1HG       LYS  85 -11.421   1.098  -4.011
  703   2HG   LYS  85          2HG       LYS  85 -10.535   2.554  -3.607
  704   1HD   LYS  85          1HD       LYS  85 -12.505   3.912  -3.643
  705   2HD   LYS  85          2HD       LYS  85 -13.421   2.719  -4.540
  706   1HE   LYS  85          1HE       LYS  85 -13.953   1.510  -2.654
  707   2HE   LYS  85          2HE       LYS  85 -12.366   1.722  -1.943
  708   1HZ   LYS  85          1HZ       LYS  85 -14.202   2.895  -0.806
  709   2HZ   LYS  85          2HZ       LYS  85 -12.957   3.865  -1.222
  710   3HZ   LYS  85          3HZ       LYS  85 -14.337   3.889  -2.094
  711    H    THR  86           H        THR  86  -9.493   2.966  -8.229
  712    HA   THR  86           HA       THR  86 -11.013   2.017 -10.257
  713    HB   THR  86           HB       THR  86  -9.123   3.938  -9.976
  714    HG1  THR  86           HG1      THR  86  -9.934   2.449 -12.374
  715   1HG2  THR  86          1HG2      THR  86  -7.109   3.498 -11.087
  716   2HG2  THR  86          2HG2      THR  86  -7.379   1.905 -10.341
  717   3HG2  THR  86          3HG2      THR  86  -7.814   2.174 -12.046
  718    H    PHE  87           H        PHE  87  -8.191   0.447  -8.811
  719    HA   PHE  87           HA       PHE  87  -8.225  -1.530 -10.954
  720   1HB   PHE  87          1HB       PHE  87  -5.999  -0.831 -10.396
  721   2HB   PHE  87          2HB       PHE  87  -6.395  -0.625  -8.700
  722    HD1  PHE  87           HD1      PHE  87  -5.613  -3.117 -11.301
  723    HD2  PHE  87           HD2      PHE  87  -6.148  -2.420  -7.150
  724    HE1  PHE  87           HE1      PHE  87  -4.617  -5.365 -10.795
  725    HE2  PHE  87           HE2      PHE  87  -5.152  -4.669  -6.644
  726    HZ   PHE  87           HZ       PHE  87  -4.399  -6.114  -8.474
  727    H    HIS  88           H        HIS  88  -8.466  -1.234  -7.350
  728    HA   HIS  88           HA       HIS  88  -8.827  -3.914  -6.822
  729   1HB   HIS  88          1HB       HIS  88  -8.354  -2.277  -5.101
  730   2HB   HIS  88          2HB       HIS  88  -9.877  -1.460  -5.391
  731    HD1  HIS  88           HD1      HIS  88  -8.771  -5.009  -4.409
  732    HD2  HIS  88           HD2      HIS  88 -11.802  -2.218  -3.620
  733    HE1  HIS  88           HE1      HIS  88 -10.267  -6.061  -2.628
  734    H    LEU  89           H        LEU  89 -11.226  -1.356  -7.686
  735    HA   LEU  89           HA       LEU  89 -13.557  -2.621  -7.282
  736   1HB   LEU  89          1HB       LEU  89 -12.545  -0.576  -9.085
  737   2HB   LEU  89          2HB       LEU  89 -13.873  -1.470  -9.797
  738    HG   LEU  89           HG       LEU  89 -15.307  -0.931  -7.892
  739   1HD1  LEU  89          1HD1      LEU  89 -14.271  -0.634  -5.929
  740   2HD1  LEU  89          2HD1      LEU  89 -12.763  -0.079  -6.694
  741   3HD1  LEU  89          3HD1      LEU  89 -14.108   1.061  -6.451
  742   1HD2  LEU  89          1HD2      LEU  89 -15.880   1.107  -8.680
  743   2HD2  LEU  89          2HD2      LEU  89 -14.226   1.752  -8.543
  744   3HD2  LEU  89          3HD2      LEU  89 -14.666   0.714  -9.921
  745    H    GLU  90           H        GLU  90 -11.856  -2.813 -10.491
  746    HA   GLU  90           HA       GLU  90 -13.363  -5.139 -11.113
  747   1HB   GLU  90          1HB       GLU  90 -12.162  -5.069 -13.255
  748   2HB   GLU  90          2HB       GLU  90 -12.733  -3.467 -12.837
  749   1HG   GLU  90          1HG       GLU  90 -10.599  -2.750 -13.143
  750   2HG   GLU  90          2HG       GLU  90 -10.207  -3.550 -11.634
  751    H    HIS  91           H        HIS  91 -12.733  -7.292 -11.012
  752    HA   HIS  91           HA       HIS  91  -9.957  -7.918 -10.625
  753   1HB   HIS  91          1HB       HIS  91 -10.576  -7.404  -8.344
  754   2HB   HIS  91          2HB       HIS  91 -11.996  -8.427  -8.446
  755    HD1  HIS  91           HD1      HIS  91 -11.248  -9.997  -6.539
  756    HD2  HIS  91           HD2      HIS  91  -8.521  -9.783  -9.720
  757    HE1  HIS  91           HE1      HIS  91  -9.564 -11.878  -6.165
  758    H    HIS  92           H        HIS  92  -9.503  -9.817 -11.662
  759    HA   HIS  92           HA       HIS  92 -11.520 -11.847 -11.823
  760   1HB   HIS  92          1HB       HIS  92 -11.625  -9.965 -13.799
  761   2HB   HIS  92          2HB       HIS  92 -10.516 -11.121 -14.509
  762    HD1  HIS  92           HD1      HIS  92 -11.459 -13.684 -14.663
  763    HD2  HIS  92           HD2      HIS  92 -14.285 -10.667 -13.953
  764    HE1  HIS  92           HE1      HIS  92 -13.737 -14.692 -15.217
  765    H    HIS  93           H        HIS  93 -10.626 -13.897 -12.649
  766    HA   HIS  93           HA       HIS  93  -7.725 -13.907 -12.302
  767   1HB   HIS  93          1HB       HIS  93  -9.693 -15.376 -11.043
  768   2HB   HIS  93          2HB       HIS  93  -9.138 -16.486 -12.281
  769    HD1  HIS  93           HD1      HIS  93  -8.274 -17.854 -10.078
  770    HD2  HIS  93           HD2      HIS  93  -6.229 -14.319 -11.035
  771    HE1  HIS  93           HE1      HIS  93  -6.054 -17.951  -8.822
  772    H    HIS  94           H        HIS  94  -6.358 -14.861 -13.848
  773    HA   HIS  94           HA       HIS  94  -7.567 -16.122 -16.134
  774   1HB   HIS  94          1HB       HIS  94  -7.789 -13.829 -16.814
  775   2HB   HIS  94          2HB       HIS  94  -6.142 -13.461 -16.341
  776    HD1  HIS  94           HD1      HIS  94  -8.147 -15.143 -19.058
  777    HD2  HIS  94           HD2      HIS  94  -4.149 -14.214 -18.194
  778    HE1  HIS  94           HE1      HIS  94  -6.837 -15.550 -21.210
  779    H    HIS  95           H        HIS  95  -5.815 -16.989 -17.639
  780    HA   HIS  95           HA       HIS  95  -3.165 -17.035 -16.595
  781   1HB   HIS  95          1HB       HIS  95  -4.495 -18.672 -15.147
  782   2HB   HIS  95          2HB       HIS  95  -4.640 -19.672 -16.579
  783    HD1  HIS  95           HD1      HIS  95  -3.167 -20.890 -14.251
  784    HD2  HIS  95           HD2      HIS  95  -1.238 -18.580 -17.172
  785    HE1  HIS  95           HE1      HIS  95  -0.706 -21.561 -14.182
  786    H    HIS  96           H        HIS  96  -2.712 -16.202 -18.700
  787    HA   HIS  96           HA       HIS  96  -2.159 -16.334 -20.818
  788   1HB   HIS  96          1HB       HIS  96  -1.580 -18.893 -19.745
  789   2HB   HIS  96          2HB       HIS  96  -2.282 -19.170 -21.328
  790    HD1  HIS  96           HD1      HIS  96  -1.117 -17.456 -23.283
  791    HD2  HIS  96           HD2      HIS  96   1.107 -18.467 -19.874
  792    HE1  HIS  96           HE1      HIS  96   1.327 -17.029 -23.874