*HEADER    LIGASE                                  14-MAR-02   1L7B              
*TITLE     SOLUTION NMR STRUCTURE OF BRCT DOMAIN OF T. THERMOPHILUS:             
*TITLE    2 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET WR64TT               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DNA LIGASE;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: BRCT DOMAIN;                                               
*COMPND   5 EC: 6.5.1.2;                                                         
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS;                           
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: DNLJ;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21-DE3;                                  
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET15B                                    
*KEYWDS    BRCT, DNA LIGASE, NMR, AUTOSTRUCTURE, STRUCTURAL GENOMICS,            
*KEYWDS   2 NESG                                                                 
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    G.SAHOTA, B.L.DIXON, Y.P.HUANG, J.ARAMINI, A.MONLEON,                 
*AUTHOR   2 D.BHATTACHARYA, G.V.T.SWAPNA, C.YIN, R.XIAO, S.ANDERSON,             
*AUTHOR   3 R.TEJERO, G.T.MONTELIONE                                             
*REVDAT   1   16-SEP-03 1L7B    0                                                

# created by  NOESY_Assign Version 1.0 Copyright(C) 2001

  3 LYS   
         HA      3 LYS  QB      4.60       #,i;db  c13_noesy.pks
         HA      4 GLY  HN      4.00       #,  n15_noesy.pks
         QB      4 GLY  HN      5.60       #i;db,  n15_noesy.pks
  4 GLY   
         HN      4 GLY  QA      4.60       #,i;da  n15_noesy.pks
         HN      5 GLY  HN      4.00       #,  n15_noesy.pks
         QA      5 GLY  HN      4.60       #i;da,  c13_noesy.pks
  5 GLY   
         HN      5 GLY  QA      4.60       #,i;da  n15_noesy.pks
         QA      6 GLU  HN      5.60       #i;da,  c13_noesy.pks
  6 GLU   
         HN      6 GLU  HA      4.00       #,  n15_noesy.pks
         HN      6 GLU  QG      6.00       #,m;dg  n15_noesy.pks
         HN      7 ALA  HN      3.00       #,  n15_noesy.pks
         HN      7 ALA  HA      4.00       #,  n15_noesy.pks
         HA      6 GLU  QG      6.00       #,m;dg  c13_noesy.pks
         HA      7 ALA  HN      4.00       #,  n15_noesy.pks
         HA      9 LYS  HN      4.00       #,  c13_noesy.pks
         QG      7 ALA  HA      6.00       #m;dg,  c13_noesy.pks
         QG     47 TYR  CZ      8.20       #m;dg,r;de  c13_noesy.pks
  7 ALA   
         HN      7 ALA  HA      4.00       #,  n15_noesy.pks
         HN      7 ALA  QB      4.60       #,i;Me  n15_noesy.pks
         HN      8 LEU  HN      4.00       #,  n15_noesy.pks
         HN     77 LEU  QB      5.00       #,m;one  n15_noesy.pks
         HA      7 ALA  QB      4.20       #, ;Me  c13_noesy.pks
         HA      8 LEU  HN      4.00       #,  n15_noesy.pks
         HA      9 LYS  HN      5.00       #,  c13_noesy.pks
         HA     77 LEU  QB      4.00       #,m;one  c13_noesy.pks
         HA     80 ALA  QB      5.00       #,m;Me  c13_noesy.pks
         QB      8 LEU  HN      5.00       #m;Me,  c13_noesy.pks
         QB      9 LYS  HN      6.00       #m;Me,  n15_noesy.pks
         QB     80 ALA  HN      5.00       #m;Me,  c13_noesy.pks
         QB     81 ARG  QD      7.00       #m;Me,m;dd  c13_noesy.pks
  8 LEU   
         HN      8 LEU  HA      4.00       #,  n15_noesy.pks
         HN      8 LEU  QB      4.60       #,i;one  n15_noesy.pks
         HN      8 LEU  HG      5.00       #,  n15_noesy.pks
         HN      9 LYS  HN      3.00       #,  n15_noesy.pks
         HN      9 LYS  QG      6.00       #,m;one  n15_noesy.pks
         HN     77 LEU  HB2     4.00       #,both  n15_noesy.pks
         HN     77 LEU  HB3     4.00       #,both  n15_noesy.pks
         HN     77 LEU  QQD     7.40       #,q;dMe  c13_noesy.pks
         HN     78 LEU  QB      5.00       #,m;one  n15_noesy.pks
         HA      8 LEU  QB      5.60       #,i;one  c13_noesy.pks
         HA      8 LEU  HG      5.00       #,  c13_noesy.pks
         HA      9 LYS  HN      5.00       #,  c13_noesy.pks
         HA     13 PHE  CZ      7.20       #,r;de  c13_noesy.pks
         HA     13 PHE  HZ      5.00       #,  c13_noesy.pks
         HA     33 LEU  QQD     7.40       #,q;dMe  c13_noesy.pks
         HA     77 LEU  HB2     5.00       #,both  c13_noesy.pks
         HA     77 LEU  HB3     5.00       #,both  c13_noesy.pks
         QB      8 LEU  HG      5.60       #i;one,  c13_noesy.pks
         HB2     9 LYS  HN      5.00       #both,  n15_noesy.pks
         HB3     9 LYS  HN      5.00       #both,  n15_noesy.pks
         QB     13 PHE  HZ      6.00       #m;one,  c13_noesy.pks
         QB     35 ALA  HN      6.00       #m;one,  n15_noesy.pks
         QB     77 LEU  HN      5.00       #m;one,  n15_noesy.pks
         QB     77 LEU  QB      6.00       #m;one,m;one  c13_noesy.pks
         QB     77 LEU  QQD     8.40       #m;one,q;dMe  c13_noesy.pks
         HG     13 PHE  CZ      7.20       #,r;de  c13_noesy.pks
         HG     33 LEU  HG      5.00       #,  c13_noesy.pks
         HG     35 ALA  HN      5.00       #,  n15_noesy.pks
         HG     35 ALA  QB      6.00       #,m;Me  c13_noesy.pks
         HG     49 VAL  QQG     7.40       #,q;dMe  c13_noesy.pks
  9 LYS   
         HN      9 LYS  HA      4.00       #,  n15_noesy.pks
         HN      9 LYS  QB      4.60       #,i;db  n15_noesy.pks
         HN      9 LYS  HG2     5.00       #,both  n15_noesy.pks
         HN      9 LYS  HG3     5.00       #,both  n15_noesy.pks
         HN      9 LYS  QD      6.00       #,m;dd  n15_noesy.pks
         HN     34 GLY  QA      6.00       #,m;one  c13_noesy.pks
         HN     35 ALA  QB      6.00       #,m;Me  n15_noesy.pks
         HN     77 LEU  QB      6.00       #,m;one  n15_noesy.pks
         HA      9 LYS  QB      4.60       #,i;db  c13_noesy.pks
         HA     10 GLY  HN      3.00       #,  n15_noesy.pks
         HA     11 LEU  HN      4.00       #,  n15_noesy.pks
         HA     33 LEU  HG      5.00       #,  c13_noesy.pks
         QB     34 GLY  QA      7.00       #m;db,m;one  c13_noesy.pks
         QB     35 ALA  HN      6.00       #m;db,  n15_noesy.pks
         QG      9 LYS  QE      7.00       #m;one,m;de  c13_noesy.pks
         HG2    10 GLY  HN      5.00       #both,  c13_noesy.pks
         HG3    10 GLY  HN      5.00       #both,  c13_noesy.pks
         QG     33 LEU  QQD     8.40       #m;one,q;dMe  c13_noesy.pks
         QG     34 GLY  QA      7.00       #m;one,m;one  c13_noesy.pks
         QG     35 ALA  HN      6.00       #m;one,  c13_noesy.pks
         QD     10 GLY  HN      6.00       #m;dd,  n15_noesy.pks
         QD     34 GLY  QA      7.00       #m;dd,m;one  c13_noesy.pks
 10 GLY   
         HN     10 GLY  HA2     4.00       #,both  n15_noesy.pks
         HN     10 GLY  HA1     4.00       #,both  n15_noesy.pks
         HN     11 LEU  HN      4.00       #,  n15_noesy.pks
         HA2    11 LEU  HN      4.00       #both,  n15_noesy.pks
         HA1    11 LEU  HN      4.00       #both,  n15_noesy.pks
         QA     35 ALA  QB      7.00       #m;one,m;Me  c13_noesy.pks
 11 LEU   
         HN     11 LEU  HA      4.00       #,  n15_noesy.pks
         HN     11 LEU  HB2     4.00       #,both  n15_noesy.pks
         HN     11 LEU  HB3     4.00       #,both  n15_noesy.pks
         HN     35 ALA  HA      4.00       #,  n15_noesy.pks
         HN     36 LYS  QB      5.00       #,m;one  n15_noesy.pks
         HA     11 LEU  HB2     4.00       #,both  c13_noesy.pks
         HA     11 LEU  HB3     4.00       #,both  c13_noesy.pks
         HA     12 THR  HN      3.00       #,  n15_noesy.pks
         HA     13 PHE  CZ      7.20       #,r;de  c13_noesy.pks
         HA     46 SER  HB2     5.00       #,both  c13_noesy.pks
         HA     46 SER  HB3     5.00       #,both  c13_noesy.pks
         QB     12 THR  HN      4.60       #i;one,  n15_noesy.pks
         QB     13 PHE  CG      8.20       #m;one,r;dd  c13_noesy.pks
         QB     13 PHE  CZ      8.20       #m;one,r;de  c13_noesy.pks
         HB2    46 SER  QB      6.00       #both,m;one  c13_noesy.pks
         HB3    46 SER  QB      6.00       #both,m;one  c13_noesy.pks
         QB     46 SER  QB      6.00       #m;one,m;one  c13_noesy.pks
         QB     47 TYR  QB      6.00       #m;one,m;one  c13_noesy.pks
         QB     47 TYR  CG      8.20       #m;one,r;dd  c13_noesy.pks
         QB     47 TYR  CZ      8.20       #m;one,r;de  c13_noesy.pks
 12 THR   
         HN     12 THR  HB      4.00       #,  n15_noesy.pks
         HN     46 SER  QB      5.00       #,m;one  n15_noesy.pks
         HN     47 TYR  HN      5.00       #,  n15_noesy.pks
         HA     12 THR  HB      4.00       #,  c13_noesy.pks
         HA     12 THR  QG2     5.60       #,i;Me  c13_noesy.pks
         HA     13 PHE  HN      4.00       #,  n15_noesy.pks
         HA     13 PHE  CG      7.20       #,r;dd  c13_noesy.pks
         HA     35 ALA  HA      5.00       #,  c13_noesy.pks
         HA     36 LYS  HN      5.00       #,  n15_noesy.pks
         HA     36 LYS  QB      5.00       #,m;one  c13_noesy.pks
         HB     12 THR  QG2     6.00       #,m;Me  c13_noesy.pks
         HB     13 PHE  HN      5.00       #,  c13_noesy.pks
         HB     36 LYS  QB      6.00       #,m;one  c13_noesy.pks
         HB     45 THR  HA      4.00       #,  c13_noesy.pks
         HB     46 SER  HN      4.00       #,  n15_noesy.pks
         HB     46 SER  QB      6.00       #,m;one  c13_noesy.pks
         QG2    13 PHE  HN      6.00       #m;Me,  n15_noesy.pks
         QG2    36 LYS  HN      6.00       #m;Me,  n15_noesy.pks
         QG2    37 VAL  HA      6.00       #m;Me,  c13_noesy.pks
         QG2    38 THR  HN      6.00       #m;Me,  n15_noesy.pks
         QG2    38 THR  HB      6.00       #m;Me,  c13_noesy.pks
         QG2    45 THR  HA      6.00       #m;Me,  c13_noesy.pks
         QG2    46 SER  HN      6.00       #m;Me,  c13_noesy.pks
 13 PHE   
         HN     13 PHE  HA      4.00       #,  c13_noesy.pks
         HN     13 PHE  CG      6.00       #,m;dd  n15_noesy.pks
         HN     27 LYS  QE      6.00       #,m;de  n15_noesy.pks
         HN     35 ALA  QB      6.00       #,m;Me  c13_noesy.pks
         HN     37 VAL  HA      4.00       #,  n15_noesy.pks
         HN     38 THR  HN      5.00       #,  n15_noesy.pks
         HA     13 PHE  CG      6.00       #,m;dd  c13_noesy.pks
         HA     13 PHE  CZ      6.00       #,m;de  c13_noesy.pks
         HA     14 VAL  HN      3.00       #,  n15_noesy.pks
         HA     14 VAL  HA      5.00       #,  c13_noesy.pks
         HA     14 VAL  HB      5.00       #,  c13_noesy.pks
         HA     14 VAL  QQG     7.40       #,q;dMe  c13_noesy.pks
         HA     27 LYS  QE      6.00       #,m;de  c13_noesy.pks
         HA     47 TYR  HN      5.00       #,  c13_noesy.pks
         HA     47 TYR  QB      6.00       #,m;one  c13_noesy.pks
         HA     60 LYS  QG      6.00       #,m;dg  c13_noesy.pks
         CG     27 LYS  QE      8.20       #r;dd,m;de  c13_noesy.pks
         CG     35 ALA  HA      7.20       #r;dd,  c13_noesy.pks
         CZ     35 ALA  HA      7.20       #r;de,  c13_noesy.pks
         CZ     35 ALA  QB      8.20       #r;de,m;Me  c13_noesy.pks
         CZ     47 TYR  HB2     7.20       #r;de,both  c13_noesy.pks
         CZ     47 TYR  HB3     7.20       #r;de,both  c13_noesy.pks
         CZ     49 VAL  QQG     9.60       #r;de,q;dMe  c13_noesy.pks
         CZ     69 LEU  QB      8.20       #r;de,m;one  c13_noesy.pks
         CZ     74 LEU  QQD     9.60       #r;de,q;dMe  c13_noesy.pks
 14 VAL   
         HN     14 VAL  HA      4.00       #,  n15_noesy.pks
         HN     14 VAL  HB      4.00       #,  n15_noesy.pks
         HN     14 VAL  QQG     6.70       #,s;dMe  n15_noesy.pks
         HN     27 LYS  QE      6.00       #,m;de  n15_noesy.pks
         HN     48 LEU  HA      4.00       #,  n15_noesy.pks
         HN     49 VAL  HN      4.00       #,  n15_noesy.pks
         HN     60 LYS  QG      6.00       #,m;dg  c13_noesy.pks
         HN     60 LYS  QE      6.00       #,m;de  c13_noesy.pks
         HA     14 VAL  HB      5.00       #,  c13_noesy.pks
         HA     14 VAL  QQG     5.60       #,i;dMe  c13_noesy.pks
         HA     15 ILE  HN      4.00       #,  n15_noesy.pks
         HA     15 ILE  HB      5.00       #,  c13_noesy.pks
         HA     38 THR  HN      4.00       #,  n15_noesy.pks
         HA     39 ASP  HA      4.00       #,  c13_noesy.pks
         HA     39 ASP  QB      6.00       #,m;one  c13_noesy.pks
         HB     14 VAL  QQG     5.00       #,  c13_noesy.pks
         HB     15 ILE  HN      5.00       #,  c13_noesy.pks
         HB     39 ASP  HA      4.00       #,  c13_noesy.pks
         HB     48 LEU  HA      4.00       #,  c13_noesy.pks
         HB     49 VAL  HN      5.00       #,  n15_noesy.pks
         QQG    15 ILE  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    15 ILE  HB      7.40       #q;dMe,  c13_noesy.pks
         QQG    16 THR  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    38 THR  HN      7.40       #q;dMe,  c13_noesy.pks
         QQG    40 SER  HA      7.40       #q;dMe,  c13_noesy.pks
         QQG    40 SER  QB      8.40       #q;dMe,m;db  c13_noesy.pks
         QQG    41 VAL  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    41 VAL  HA      7.40       #q;dMe,  c13_noesy.pks
         QQG    42 SER  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    45 THR  HB      7.40       #q;dMe,  c13_noesy.pks
         QQG    47 TYR  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    48 LEU  QB      8.40       #q;dMe,m;one  c13_noesy.pks
 15 ILE   
         HN     15 ILE  HA      5.00       #,  n15_noesy.pks
         HN     15 ILE  HB      4.00       #,  n15_noesy.pks
         HN     15 ILE  QG2     6.00       #,m;Me  c13_noesy.pks
         HN     15 ILE  QD1     6.00       #,m;Me  c13_noesy.pks
         HN     38 THR  HN      5.00       #,  n15_noesy.pks
         HN     38 THR  HA      5.00       #,  n15_noesy.pks
         HA     15 ILE  HB      4.00       #,  c13_noesy.pks
         HA     15 ILE  QG2     5.60       #,i;Me  c13_noesy.pks
         HA     15 ILE  QD1     6.00       #,m;Me  c13_noesy.pks
         HA     16 THR  HN      3.00       #,  n15_noesy.pks
         HA     16 THR  HB      4.00       #,  c13_noesy.pks
         HA     16 THR  QG2     6.00       #,m;Me  c13_noesy.pks
         HA     48 LEU  QB      6.00       #,m;one  c13_noesy.pks
         HA     49 VAL  HN      4.00       #,  n15_noesy.pks
         HA     49 VAL  HB      3.00       #,  c13_noesy.pks
         HB     15 ILE  QG2     6.00       #,m;Me  c13_noesy.pks
         HB     15 ILE  QD1     6.00       #,m;Me  c13_noesy.pks
         HB     23 ARG  QD      6.00       #,m;dd  c13_noesy.pks
         QG2    16 THR  HN      6.00       #m;Me,  n15_noesy.pks
         QG2    16 THR  HA      6.00       #m;Me,  c13_noesy.pks
         QG2    18 GLU  HA      6.00       #m;Me,  c13_noesy.pks
         QG2    23 ARG  QB      7.00       #m;Me,m;one  c13_noesy.pks
         QG2    23 ARG  QD      7.00       #m;Me,m;dd  c13_noesy.pks
         QG2    49 VAL  HB      6.00       #m;Me,  c13_noesy.pks
         QD1    23 ARG  QD      7.00       #m;Me,m;dd  c13_noesy.pks
         QD1    23 ARG  HE      6.00       #m;Me,  c13_noesy.pks
         QD1    24 GLU  HA      6.00       #m;Me,  c13_noesy.pks
         QD1    27 LYS  HN      6.00       #m;Me,  n15_noesy.pks
         QD1    27 LYS  HA      6.00       #m;Me,  c13_noesy.pks
         QD1    27 LYS  QE      7.00       #m;Me,m;de  c13_noesy.pks
         QD1    30 LEU  HG      6.00       #m;Me,  c13_noesy.pks
         QD1    37 VAL  HA      6.00       #m;Me,  c13_noesy.pks
         QD1    69 LEU  QB      7.00       #m;Me,m;one  c13_noesy.pks
         QD1    71 GLU  HA      6.00       #m;Me,  c13_noesy.pks
 16 THR   
         HN     16 THR  HA      3.00       #,  n15_noesy.pks
         HN     16 THR  HB      5.00       #,  c13_noesy.pks
         HN     16 THR  QG2     6.00       #,m;Me  n15_noesy.pks
         HN     17 GLY  QA      5.60       #,i;one  n15_noesy.pks
         HN     49 VAL  HB      4.00       #,  n15_noesy.pks
         HN     50 VAL  QQG     7.40       #,q;dMe  n15_noesy.pks
         HA     16 THR  HB      4.00       #,  c13_noesy.pks
         HA     17 GLY  HN      3.00       #,  n15_noesy.pks
         HA     17 GLY  QA      5.60       #,i;one  c13_noesy.pks
         HB     16 THR  QG2     6.00       #,m;Me  c13_noesy.pks
         HB     17 GLY  HN      5.00       #,  c13_noesy.pks
         HB     48 LEU  QQD     7.40       #,q;dMe  c13_noesy.pks
         QG2    17 GLY  QA      6.60       #m;Me,i;one  c13_noesy.pks
         QG2    48 LEU  QQD     8.40       #m;Me,q;dMe  c13_noesy.pks
         QG2    50 VAL  HB      6.00       #m;Me,  c13_noesy.pks
         QG2    51 GLY  HN      6.00       #m;Me,  n15_noesy.pks
         QG2    54 PRO  HA      6.00       #m;Me,  c13_noesy.pks
         QG2    54 PRO  QD      7.00       #m;Me,m;one  c13_noesy.pks
         QG2    55 GLY  HN      6.00       #m;Me,  n15_noesy.pks
         QG2    56 SER  QB      7.00       #m;Me,m;db  c13_noesy.pks
         QG2    57 LYS  HA      6.00       #m;Me,  c13_noesy.pks
         QG2    58 LEU  HN      6.00       #m;Me,  n15_noesy.pks
 17 GLY   
         HN     17 GLY  HA2     4.00       #,both  n15_noesy.pks
         HN     17 GLY  HA1     4.00       #,both  n15_noesy.pks
         HA2    18 GLU  HN      5.00       #both,  n15_noesy.pks
         HA1    18 GLU  HN      5.00       #both,  n15_noesy.pks
         QA     18 GLU  HA      5.60       #i;one,  c13_noesy.pks
         QA     50 VAL  QQG     8.40       #m;one,q;dMe  c13_noesy.pks
         QA     52 GLU  HN      5.00       #m;one,  n15_noesy.pks
         QA     53 ASN  HN      6.00       #m;one,  n15_noesy.pks
 18 GLU   
         HN     18 GLU  HA      4.00       #,  n15_noesy.pks
         HN     18 GLU  QB      4.60       #,i;db  c13_noesy.pks
         HN     18 GLU  QG      6.00       #,m;dg  n15_noesy.pks
         HN     51 GLY  QA      6.00       #,m;one  n15_noesy.pks
         HN     51 GLY  QA      6.00       #,m;one  c13_noesy.pks
         HN     52 GLU  HN      5.00       #,  n15_noesy.pks
         HN     54 PRO  QD      6.00       #,m;one  n15_noesy.pks
         HA     19 LEU  HN      3.00       #,  n15_noesy.pks
         HA     19 LEU  QB      5.60       #,i;one  c13_noesy.pks
         HA     51 GLY  QA      5.00       #,m;one  c13_noesy.pks
         QB     22 PRO  HA      5.00       #m;db,  c13_noesy.pks
         QB     23 ARG  HN      5.00       #m;db,  n15_noesy.pks
         QB     24 GLU  HN      5.00       #m;db,  n15_noesy.pks
         QG     19 LEU  HN      6.00       #m;dg,  n15_noesy.pks
 19 LEU   
         HN     19 LEU  HA      4.00       #,  n15_noesy.pks
         HN     19 LEU  HB2     4.00       #,both  n15_noesy.pks
         HN     19 LEU  HB3     4.00       #,both  n15_noesy.pks
         HN     19 LEU  QQD     7.20       #,r;dMe  n15_noesy.pks
         HA     19 LEU  HB2     4.00       #,both  c13_noesy.pks
         HA     19 LEU  HB3     4.00       #,both  c13_noesy.pks
         HA     19 LEU  QQD     6.70       #,s;dMe  c13_noesy.pks
         HA     20 SER  HN      4.00       #,  c13_noesy.pks
         QB     19 LEU  HG      5.60       #i;one,  c13_noesy.pks
         HB2    19 LEU  QQD     5.00       #both,  c13_noesy.pks
         HB3    19 LEU  QQD     5.00       #both,  c13_noesy.pks
         HB2    20 SER  HN      4.00       #both,  n15_noesy.pks
         HB3    20 SER  HN      4.00       #both,  n15_noesy.pks
         HB2    20 SER  QB      5.60       #both,i;db  c13_noesy.pks
         HB3    20 SER  QB      5.60       #both,i;db  c13_noesy.pks
         HB2    21 ARG  HN      4.00       #both,  n15_noesy.pks
         HB3    21 ARG  HN      4.00       #both,  n15_noesy.pks
         QB     21 ARG  QB      5.00       #m;one,m;one  c13_noesy.pks
         QB     23 ARG  HN      5.00       #m;one,  n15_noesy.pks
         QB     51 GLY  QA      7.00       #m;one,m;one  c13_noesy.pks
         QB     71 GLU  QB      5.00       #m;one,m;db  c13_noesy.pks
         QQD    20 SER  HN      7.40       #q;dMe,  n15_noesy.pks
         QQD    21 ARG  HN      7.40       #q;dMe,  n15_noesy.pks
         QQD    51 GLY  HA2     7.40       #q;dMe,both  c13_noesy.pks
         QQD    51 GLY  HA1     7.40       #q;dMe,both  c13_noesy.pks
         QQD    52 GLU  QB      8.40       #q;dMe,m;one  c13_noesy.pks
         QQD    71 GLU  HN      7.40       #q;dMe,  c13_noesy.pks
         QQD    71 GLU  QB      8.40       #q;dMe,m;db  c13_noesy.pks
 20 SER   
         HN     20 SER  HA      4.00       #,  n15_noesy.pks
         HN     20 SER  QB      4.60       #,i;db  n15_noesy.pks
         HN     21 ARG  HN      4.00       #,  n15_noesy.pks
         QB     21 ARG  HN      5.60       #i;db,  c13_noesy.pks
 21 ARG   
         HN     21 ARG  HA      4.00       #,  n15_noesy.pks
         HN     21 ARG  HB2     5.00       #,both  c13_noesy.pks
         HN     21 ARG  HB3     5.00       #,both  c13_noesy.pks
         HN     22 PRO  HA      5.00       #,  n15_noesy.pks
         HN     23 ARG  QB      5.00       #,m;one  n15_noesy.pks
         HN     23 ARG  QB      6.00       #,m;one  c13_noesy.pks
         HA     21 ARG  HB2     4.00       #,both  c13_noesy.pks
         HA     21 ARG  HB3     4.00       #,both  c13_noesy.pks
         HA     22 PRO  HD2     5.00       #,both  c13_noesy.pks
         HA     22 PRO  HD3     5.00       #,both  c13_noesy.pks
         QB     22 PRO  HA      5.60       #i;one,  c13_noesy.pks
         QB     22 PRO  HD2     5.60       #i;one,both  c13_noesy.pks
         QB     22 PRO  HD3     5.60       #i;one,both  c13_noesy.pks
         QB     22 PRO  HD2     5.60       #i;one,both  c13_noesy.pks
         QB     22 PRO  HD3     5.60       #i;one,both  c13_noesy.pks
 22 PRO   
         HA     22 PRO  QB      4.60       #,i;one  c13_noesy.pks
         HA     23 ARG  HN      3.00       #,  n15_noesy.pks
         HA     24 GLU  HN      5.00       #,  n15_noesy.pks
         HA     24 GLU  QB      5.00       #,m;db  c13_noesy.pks
         QB     22 PRO  HD2     5.60       #i;one,both  c13_noesy.pks
         QB     22 PRO  HD3     5.60       #i;one,both  c13_noesy.pks
         QB     22 PRO  HD2     5.60       #i;one,both  c13_noesy.pks
         QB     22 PRO  HD3     5.60       #i;one,both  c13_noesy.pks
         QB     23 ARG  HN      4.60       #i;one,  n15_noesy.pks
         QB     24 GLU  HN      6.00       #m;one,  c13_noesy.pks
         QB     25 GLU  HN      5.00       #m;one,  c13_noesy.pks
         QD     25 GLU  QB      7.00       #m;one,m;db  c13_noesy.pks
 23 ARG   
         HN     23 ARG  HA      4.00       #,  n15_noesy.pks
         HN     23 ARG  HB2     4.00       #,both  c13_noesy.pks
         HN     23 ARG  HB3     4.00       #,both  c13_noesy.pks
         HN     24 GLU  HN      4.00       #,  n15_noesy.pks
         HA     23 ARG  QB      4.60       #,i;one  c13_noesy.pks
         HA     24 GLU  HN      5.00       #,  c13_noesy.pks
         HA     27 LYS  HN      4.00       #,  n15_noesy.pks
         QB     24 GLU  HN      4.60       #i;one,  c13_noesy.pks
         QG     27 LYS  HN      6.00       #m;dg,  n15_noesy.pks
         HE     49 VAL  HA      5.00       #,  c13_noesy.pks
 24 GLU   
         HN     24 GLU  HA      4.00       #,  n15_noesy.pks
         HN     24 GLU  QB      4.60       #,i;db  n15_noesy.pks
         HN     25 GLU  HN      4.00       #,  n15_noesy.pks
         HA     25 GLU  HN      4.00       #,  c13_noesy.pks
         HA     27 LYS  HN      5.00       #,  n15_noesy.pks
 25 GLU   
         HN     25 GLU  HA      5.00       #,  c13_noesy.pks
         HN     25 GLU  QB      4.60       #,i;db  c13_noesy.pks
         HN     26 VAL  HN      3.00       #,  n15_noesy.pks
         HA     28 ALA  QB      5.00       #,m;Me  c13_noesy.pks
         QB     26 VAL  HN      4.60       #i;db,  n15_noesy.pks
 26 VAL   
         HN     26 VAL  HA      4.00       #,  c13_noesy.pks
         HN     26 VAL  HB      3.00       #,  n15_noesy.pks
         HN     26 VAL  QQG     6.70       #,s;dMe  n15_noesy.pks
         HN     26 VAL  QG2     6.00       #,m;bothMe  c13_noesy.pks
         HN     27 LYS  HN      4.00       #,  n15_noesy.pks
         HA     26 VAL  QQG     5.60       #,i;dMe  c13_noesy.pks
         HA     27 LYS  HN      4.00       #,  c13_noesy.pks
         HA     29 LEU  HN      4.00       #,  n15_noesy.pks
         HA     29 LEU  HB2     5.00       #,both  c13_noesy.pks
         HA     29 LEU  HB3     5.00       #,both  c13_noesy.pks
         HA     30 LEU  QB      6.00       #,m;one  c13_noesy.pks
         HB     27 LYS  HN      4.00       #,  n15_noesy.pks
         HB     75 TYR  CZ      7.20       #,r;de  c13_noesy.pks
         QQG    27 LYS  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    27 LYS  HA      7.40       #q;dMe,  c13_noesy.pks
         QQG    27 LYS  QE      8.40       #q;dMe,m;de  c13_noesy.pks
         QQG    28 ALA  HN      7.40       #q;dMe,  c13_noesy.pks
         QQG    29 LEU  QB      8.40       #q;dMe,m;one  c13_noesy.pks
         QQG    30 LEU  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    37 VAL  HB      7.40       #q;dMe,  c13_noesy.pks
         QQG    75 TYR  CG      9.60       #q;dMe,r;dd  c13_noesy.pks
         QQG    27 LYS  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    75 TYR  CZ      9.60       #q;dMe,r;de  c13_noesy.pks
         QQG    79 GLU  QG      8.40       #q;dMe,m;dg  c13_noesy.pks
 27 LYS   
         HN     27 LYS  HA      4.00       #,  c13_noesy.pks
         HN     28 ALA  HN      4.00       #,  n15_noesy.pks
         HN     30 LEU  QB      5.00       #,m;one  n15_noesy.pks
         HA     27 LYS  HB2     4.00       #,both  c13_noesy.pks
         HA     27 LYS  HB3     4.00       #,both  c13_noesy.pks
         HA     28 ALA  HN      4.00       #,  c13_noesy.pks
         HA     30 LEU  HN      4.00       #,  n15_noesy.pks
         HA     30 LEU  QB      6.00       #,m;one  c13_noesy.pks
         HA     30 LEU  HG      5.00       #,  c13_noesy.pks
         HA     31 ARG  HN      5.00       #,  n15_noesy.pks
         HA     37 VAL  QQG     7.40       #,q;dMe  c13_noesy.pks
         QB     28 ALA  HN      4.60       #i;one,  n15_noesy.pks
         QB     28 ALA  HA      4.60       #i;one,  c13_noesy.pks
         QG     30 LEU  QB      7.00       #m;dg,m;one  c13_noesy.pks
         QG     38 THR  HN      6.00       #m;dg,  n15_noesy.pks
         QE     30 LEU  HG      6.00       #m;de,  c13_noesy.pks
         QE     35 ALA  QB      7.00       #m;de,m;Me  c13_noesy.pks
         QE     37 VAL  HA      6.00       #m;de,  c13_noesy.pks
         QE     37 VAL  HB      6.00       #m;de,  c13_noesy.pks
         QE     49 VAL  QQG     8.40       #m;de,q;dMe  c13_noesy.pks
         QE     74 LEU  QQD     8.40       #m;de,q;dMe  c13_noesy.pks
 28 ALA   
         HN     28 ALA  HA      4.00       #,  n15_noesy.pks
         HN     28 ALA  QB      4.60       #,i;Me  n15_noesy.pks
         HA     28 ALA  QB      4.20       #, ;Me  c13_noesy.pks
         HA     29 LEU  HN      4.00       #,  n15_noesy.pks
         HA     31 ARG  HN      5.00       #,  n15_noesy.pks
         HA     31 ARG  QD      6.00       #,m;dd  c13_noesy.pks
         QB     31 ARG  QD      7.00       #m;Me,m;dd  c13_noesy.pks
 29 LEU   
         HN     29 LEU  HA      4.00       #,  n15_noesy.pks
         HN     29 LEU  HB2     3.00       #,both  n15_noesy.pks
         HN     29 LEU  HB3     3.00       #,both  n15_noesy.pks
         HN     29 LEU  HG      5.00       #,  n15_noesy.pks
         HN     30 LEU  HN      3.00       #,  n15_noesy.pks
         HN     32 ARG  HN      5.00       #,  n15_noesy.pks
         HA     30 LEU  HN      4.00       #,  n15_noesy.pks
         HA     31 ARG  HN      5.00       #,  n15_noesy.pks
         HA     32 ARG  QD      6.00       #,m;dd  c13_noesy.pks
         QB     30 LEU  HN      4.60       #i;one,  n15_noesy.pks
         HG     30 LEU  HA      5.00       #,  c13_noesy.pks
         QQD    30 LEU  HN      7.40       #q;dMe,  n15_noesy.pks
         QQD    30 LEU  HA      7.40       #q;dMe,  c13_noesy.pks
         QQD    30 LEU  HB2     7.40       #q;dMe,both  c13_noesy.pks
         QQD    30 LEU  HB3     7.40       #q;dMe,both  c13_noesy.pks
         QQD    33 LEU  QB      8.40       #q;dMe,m;one  c13_noesy.pks
         QQD    33 LEU  QQD     9.80       #q;dMe,q;dMe  c13_noesy.pks
 30 LEU   
         HN     30 LEU  HA      4.00       #,  n15_noesy.pks
         HN     30 LEU  QB      4.60       #,i;one  n15_noesy.pks
         HN     30 LEU  HG      5.00       #,  n15_noesy.pks
         HN     31 ARG  HN      4.00       #,  n15_noesy.pks
         HA     30 LEU  HB2     5.00       #,both  c13_noesy.pks
         HA     30 LEU  HB3     5.00       #,both  c13_noesy.pks
         HA     30 LEU  HG      5.00       #,  c13_noesy.pks
         HA     31 ARG  HN      5.00       #,  n15_noesy.pks
         HA     33 LEU  HN      5.00       #,  n15_noesy.pks
         HA     33 LEU  HB2     5.00       #,both  c13_noesy.pks
         HA     33 LEU  HB3     5.00       #,both  c13_noesy.pks
         HA     33 LEU  QQD     7.40       #,q;dMe  c13_noesy.pks
         HB2    30 LEU  HG      5.00       #both,  c13_noesy.pks
         HB3    30 LEU  HG      5.00       #both,  c13_noesy.pks
         QB     31 ARG  HN      4.60       #i;one,  c13_noesy.pks
         QB     33 LEU  HN      6.00       #m;one,  n15_noesy.pks
         QB     33 LEU  QB      6.00       #m;one,m;one  c13_noesy.pks
         HB2    33 LEU  QQD     7.40       #both,q;dMe  c13_noesy.pks
         HB3    33 LEU  QQD     7.40       #both,q;dMe  c13_noesy.pks
         QB     78 LEU  QQD     8.40       #m;one,q;dMe  c13_noesy.pks
         HG     33 LEU  QB      6.00       #,m;one  c13_noesy.pks
         HG     33 LEU  QQD     7.40       #,q;dMe  c13_noesy.pks
 31 ARG   
         HN     31 ARG  HA      4.00       #,  n15_noesy.pks
         HN     37 VAL  QQG     7.40       #,q;dMe  n15_noesy.pks
         HA     31 ARG  QB      4.60       #,i;db  c13_noesy.pks
         HA     31 ARG  QD      6.00       #,m;dd  c13_noesy.pks
         HA     32 ARG  HN      5.00       #,  n15_noesy.pks
         HA     33 LEU  HN      5.00       #,  n15_noesy.pks
         HA     34 GLY  HN      5.00       #,  n15_noesy.pks
         QB     36 LYS  HA      6.00       #m;db,  c13_noesy.pks
         QB     37 VAL  HN      6.00       #m;db,  n15_noesy.pks
         QB     37 VAL  HA      6.00       #m;db,  c13_noesy.pks
 32 ARG   
         HN     32 ARG  HA      4.00       #,  n15_noesy.pks
         HN     33 LEU  HN      4.00       #,  n15_noesy.pks
         HN     33 LEU  HA      5.00       #,  n15_noesy.pks
         HA     32 ARG  QB      5.60       #,i;db  c13_noesy.pks
         HA     33 LEU  HN      5.00       #,  n15_noesy.pks
         QB     33 LEU  HN      5.60       #i;db,  n15_noesy.pks
         QB     33 LEU  QB      5.20       #i;db,i;one  c13_noesy.pks
 33 LEU   
         HN     33 LEU  HA      5.00       #,  n15_noesy.pks
         HN     33 LEU  HB2     5.00       #,both  n15_noesy.pks
         HN     33 LEU  HB3     5.00       #,both  n15_noesy.pks
         HN     33 LEU  HG      5.00       #,  n15_noesy.pks
         HN     34 GLY  HN      4.00       #,  n15_noesy.pks
         HN     34 GLY  QA      5.60       #,i;one  n15_noesy.pks
         HA     33 LEU  HB2     4.00       #,both  c13_noesy.pks
         HA     33 LEU  HB3     4.00       #,both  c13_noesy.pks
         HA     34 GLY  HN      5.00       #,  n15_noesy.pks
         HA     81 ARG  QD      6.00       #,m;dd  c13_noesy.pks
         HG     34 GLY  HN      5.00       #,  c13_noesy.pks
         QQD    35 ALA  HN      7.40       #q;dMe,  c13_noesy.pks
         QQD    79 GLU  HA      7.40       #q;dMe,  c13_noesy.pks
         QQD    81 ARG  HA      7.40       #q;dMe,  c13_noesy.pks
         QQD    81 ARG  QB      8.40       #q;dMe,m;db  c13_noesy.pks
         QQD    81 ARG  QD      8.40       #q;dMe,m;dd  c13_noesy.pks
         QQD    82 THR  HN      7.40       #q;dMe,  n15_noesy.pks
 34 GLY   
         HN     34 GLY  HA2     4.00       #,both  n15_noesy.pks
         HN     34 GLY  HA1     4.00       #,both  n15_noesy.pks
         HN     35 ALA  HN      4.00       #,  n15_noesy.pks
         HA2    35 ALA  HN      4.00       #both,  n15_noesy.pks
         HA1    35 ALA  HN      4.00       #both,  n15_noesy.pks
 35 ALA   
         HN     35 ALA  HA      4.00       #,  n15_noesy.pks
         HN     35 ALA  QB      4.60       #,i;Me  n15_noesy.pks
         HA     35 ALA  QB      4.20       #, ;Me  c13_noesy.pks
         HA     36 LYS  HN      4.00       #,  n15_noesy.pks
         HA     36 LYS  QB      4.60       #,i;one  c13_noesy.pks
         QB     36 LYS  HN      5.00       #m;Me,  n15_noesy.pks
 36 LYS   
         HN     36 LYS  HA      4.00       #,  n15_noesy.pks
         HN     36 LYS  QB      4.60       #,i;one  n15_noesy.pks
         HN     37 VAL  HA      5.00       #,  n15_noesy.pks
         HN     37 VAL  QQG     7.40       #,q;dMe  n15_noesy.pks
         HA     36 LYS  QB      4.60       #,i;one  c13_noesy.pks
         HA     36 LYS  QG      6.00       #,m;dg  c13_noesy.pks
         HA     37 VAL  HN      3.00       #,  n15_noesy.pks
         QB     37 VAL  HN      4.60       #i;one,  n15_noesy.pks
 37 VAL   
         HN     37 VAL  HA      4.00       #,  n15_noesy.pks
         HN     37 VAL  HB      4.00       #,  c13_noesy.pks
         HN     37 VAL  QQG     6.70       #,s;dMe  n15_noesy.pks
         HA     37 VAL  QQG     5.60       #,i;dMe  c13_noesy.pks
         HA     38 THR  HN      3.00       #,  c13_noesy.pks
         HB     37 VAL  QQG     5.00       #,  c13_noesy.pks
         QQG    38 THR  HN      7.40       #q;dMe,  n15_noesy.pks
 38 THR   
         HN     38 THR  HA      4.00       #,  n15_noesy.pks
         HN     38 THR  QG2     6.00       #,m;Me  n15_noesy.pks
         HA     38 THR  HB      3.00       #,  c13_noesy.pks
         HA     38 THR  QG2     5.60       #,i;Me  c13_noesy.pks
         HA     39 ASP  HN      3.00       #,  n15_noesy.pks
         HA     40 SER  HN      5.00       #,  c13_noesy.pks
         HB     38 THR  QG2     6.00       #,m;Me  c13_noesy.pks
         HB     39 ASP  HN      4.00       #,  c13_noesy.pks
         HB     40 SER  HN      4.00       #,  c13_noesy.pks
         QG2    40 SER  HN      6.00       #m;Me,  n15_noesy.pks
 39 ASP   
         HN     39 ASP  HA      5.00       #,  c13_noesy.pks
         HN     39 ASP  HB2     5.00       #,both  n15_noesy.pks
         HN     39 ASP  HB3     5.00       #,both  n15_noesy.pks
         HN     40 SER  HN      5.00       #,  n15_noesy.pks
         HA     39 ASP  HB2     4.00       #,both  c13_noesy.pks
         HA     39 ASP  HB3     4.00       #,both  c13_noesy.pks
         HA     40 SER  HN      4.00       #,  c13_noesy.pks
         HA     60 LYS  QB      6.00       #,m;one  c13_noesy.pks
         HA     60 LYS  QG      6.00       #,m;dg  c13_noesy.pks
         HB2    40 SER  HN      5.00       #both,  c13_noesy.pks
         HB3    40 SER  HN      5.00       #both,  c13_noesy.pks
 40 SER   
         HN     40 SER  HA      4.00       #,  c13_noesy.pks
         HN     40 SER  QB      5.60       #,i;db  c13_noesy.pks
         HN     60 LYS  QB      5.00       #,m;one  c13_noesy.pks
         HA     40 SER  QB      4.60       #,i;db  c13_noesy.pks
         HA     41 VAL  HN      3.00       #,  n15_noesy.pks
         QB     41 VAL  HN      5.60       #i;db,  n15_noesy.pks
         QB     41 VAL  QQG     8.00       #i;db,q;dMe  c13_noesy.pks
 41 VAL   
         HN     41 VAL  HA      4.00       #,  n15_noesy.pks
         HN     41 VAL  HB      4.00       #,  n15_noesy.pks
         HN     41 VAL  QQG     6.70       #,s;dMe  n15_noesy.pks
         HN     42 SER  QB      5.60       #,i;one  n15_noesy.pks
         HN     60 LYS  QB      5.00       #,m;one  n15_noesy.pks
         HA     41 VAL  HB      5.00       #,  c13_noesy.pks
         HA     41 VAL  QQG     5.60       #,i;dMe  c13_noesy.pks
         HA     42 SER  HN      4.00       #,  n15_noesy.pks
         HA     60 LYS  HN      4.00       #,  n15_noesy.pks
         HA     60 LYS  HB2     5.00       #,both  c13_noesy.pks
         HA     60 LYS  HB3     5.00       #,both  c13_noesy.pks
         HA     60 LYS  QE      6.00       #,m;de  c13_noesy.pks
         HA     63 ALA  QB      5.00       #,m;Me  c13_noesy.pks
         HB     60 LYS  HN      5.00       #,  n15_noesy.pks
         QQG    42 SER  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    42 SER  HA      7.40       #q;dMe,  c13_noesy.pks
         QQG    42 SER  QB      8.00       #q;dMe,i;one  c13_noesy.pks
         QQG    59 GLU  HA      7.40       #q;dMe,  c13_noesy.pks
         QQG    60 LYS  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    61 ALA  HN      7.40       #q;dMe,  n15_noesy.pks
 42 SER   
         HN     42 SER  HA      5.00       #,  n15_noesy.pks
         HN     42 SER  HB2     5.00       #,both  c13_noesy.pks
         HN     42 SER  HB3     5.00       #,both  c13_noesy.pks
         HN     45 THR  HB      4.00       #,  n15_noesy.pks
         HN     60 LYS  HA      4.00       #,  n15_noesy.pks
         HN     60 LYS  QG      6.00       #,m;dg  c13_noesy.pks
         HA     42 SER  HB2     4.00       #,both  c13_noesy.pks
         HA     42 SER  HB3     4.00       #,both  c13_noesy.pks
         HA     43 ARG  HN      4.00       #,  c13_noesy.pks
         HA     63 ALA  QB      6.00       #,m;Me  c13_noesy.pks
         HB2    43 ARG  HN      5.00       #both,  n15_noesy.pks
         HB3    43 ARG  HN      5.00       #both,  n15_noesy.pks
         QB     43 ARG  QG      6.60       #i;one,m;dg  c13_noesy.pks
         HB2    44 LYS  HN      5.00       #both,  c13_noesy.pks
         HB3    44 LYS  HN      5.00       #both,  c13_noesy.pks
         QB     44 LYS  HA      5.00       #m;one,  c13_noesy.pks
         QB     45 THR  HN      6.00       #m;one,  n15_noesy.pks
         QB     64 LEU  QQD     8.40       #m;one,q;dMe  c13_noesy.pks
 43 ARG   
         HN     43 ARG  QG      6.00       #,m;dg  n15_noesy.pks
         HN     44 LYS  HN      4.00       #,  n15_noesy.pks
         HN     44 LYS  HA      5.00       #,  n15_noesy.pks
         HA     43 ARG  QG      6.00       #,m;dg  c13_noesy.pks
         HA     43 ARG  QD      6.00       #,m;dd  c13_noesy.pks
         HA     45 THR  HN      4.00       #,  n15_noesy.pks
         HA     60 LYS  QE      6.00       #,m;de  c13_noesy.pks
         HA     63 ALA  QB      5.00       #,m;Me  c13_noesy.pks
         HA     64 LEU  HN      5.00       #,  n15_noesy.pks
         QG     44 LYS  HN      6.00       #m;dg,  n15_noesy.pks
 44 LYS   
         HN     44 LYS  HA      4.00       #,  c13_noesy.pks
         HN     45 THR  HN      4.00       #,  n15_noesy.pks
         HN     64 LEU  HG      5.00       #,  n15_noesy.pks
         HA     45 THR  HN      5.00       #,  n15_noesy.pks
         QB     45 THR  HN      5.60       #i;one,  c13_noesy.pks
         QD     44 LYS  QE      7.00       #m;dd,m;de  c13_noesy.pks
 45 THR   
         HN     45 THR  HA      4.00       #,  n15_noesy.pks
         HN     45 THR  HB      4.00       #,  n15_noesy.pks
         HN     60 LYS  QE      6.00       #,m;de  c13_noesy.pks
         HA     45 THR  HB      4.00       #,  c13_noesy.pks
         HA     46 SER  HN      3.00       #,  n15_noesy.pks
         HA     47 TYR  HN      4.00       #,  n15_noesy.pks
         HA     60 LYS  QG      6.00       #,m;dg  c13_noesy.pks
         HB     60 LYS  QB      5.00       #,m;one  c13_noesy.pks
         HB     60 LYS  QG      6.00       #,m;dg  c13_noesy.pks
         HB     60 LYS  QE      6.00       #,m;de  c13_noesy.pks
         HB     64 LEU  QB      6.00       #,m;one  c13_noesy.pks
 46 SER   
         HN     46 SER  HA      4.00       #,  n15_noesy.pks
         HN     46 SER  QB      4.60       #,i;one  c13_noesy.pks
         HN     47 TYR  HN      4.00       #,  n15_noesy.pks
         HA     46 SER  HB2     5.00       #,both  c13_noesy.pks
         HA     46 SER  HB3     5.00       #,both  c13_noesy.pks
         HA     47 TYR  HN      5.00       #,  n15_noesy.pks
         HA     47 TYR  CG      7.20       #,r;dd  c13_noesy.pks
         HA     66 VAL  HB      5.00       #,  c13_noesy.pks
         HB2    47 TYR  HN      4.00       #both,  c13_noesy.pks
         HB3    47 TYR  HN      4.00       #both,  c13_noesy.pks
         QB     47 TYR  HA      5.60       #i;one,  c13_noesy.pks
         QB     47 TYR  CG      7.80       #i;one,r;dd  c13_noesy.pks
         QB     47 TYR  CZ      7.80       #i;one,r;de  c13_noesy.pks
 47 TYR   
         HN     47 TYR  HA      4.00       #,  n15_noesy.pks
         HN     47 TYR  QB      5.60       #,i;one  c13_noesy.pks
         HN     47 TYR  CG      6.00       #,m;dd  n15_noesy.pks
         HN     47 TYR  CZ      6.00       #,m;de  n15_noesy.pks
         HA     47 TYR  HB2     4.00       #,both  c13_noesy.pks
         HA     47 TYR  HB3     4.00       #,both  c13_noesy.pks
         HA     47 TYR  CG      6.00       #,m;dd  c13_noesy.pks
         HA     47 TYR  CZ      6.00       #,m;de  c13_noesy.pks
         HA     48 LEU  HN      3.00       #,  c13_noesy.pks
         HA     48 LEU  QB      5.60       #,i;one  c13_noesy.pks
         HA     60 LYS  QG      6.00       #,m;dg  c13_noesy.pks
         HA     60 LYS  QE      6.00       #,m;de  c13_noesy.pks
         HA     68 THR  QG2     6.00       #,m;Me  c13_noesy.pks
         HA     69 LEU  HN      5.00       #,  n15_noesy.pks
         HB2    47 TYR  CG      6.00       #both,m;dd  c13_noesy.pks
         HB3    47 TYR  CG      6.00       #both,m;dd  c13_noesy.pks
         QB     47 TYR  CZ      6.60       #i;one,m;de  c13_noesy.pks
         HB2    48 LEU  HN      5.00       #both,  c13_noesy.pks
         HB3    48 LEU  HN      5.00       #both,  c13_noesy.pks
         QB     68 THR  HA      6.00       #m;one,  c13_noesy.pks
         QB     69 LEU  QB      6.00       #m;one,m;one  c13_noesy.pks
         CG     67 PRO  QB      8.20       #r;dd,m;db  c13_noesy.pks
         CG     69 LEU  QB      8.20       #r;dd,m;one  c13_noesy.pks
 48 LEU   
         HN     48 LEU  HB2     4.00       #,both  c13_noesy.pks
         HN     48 LEU  HB3     4.00       #,both  c13_noesy.pks
         HN     48 LEU  QQD     7.20       #,r;dMe  n15_noesy.pks
         HN     68 THR  HA      4.00       #,  n15_noesy.pks
         HN     69 LEU  HG      5.00       #,  n15_noesy.pks
         HA     48 LEU  QB      4.60       #,i;one  c13_noesy.pks
         HA     48 LEU  HG      5.00       #,  c13_noesy.pks
         HA     49 VAL  HN      3.00       #,  n15_noesy.pks
         QB     48 LEU  QQD     5.60       #i;one,  c13_noesy.pks
         QB     57 LYS  QB      6.00       #m;one,m;one  c13_noesy.pks
         HB2    60 LYS  QE      6.00       #both,m;de  c13_noesy.pks
         HB3    60 LYS  QE      6.00       #both,m;de  c13_noesy.pks
         HB2    68 THR  HA      5.00       #both,  c13_noesy.pks
         HB3    68 THR  HA      5.00       #both,  c13_noesy.pks
         HB2    68 THR  QG2     6.00       #both,m;Me  c13_noesy.pks
         HB3    68 THR  QG2     6.00       #both,m;Me  c13_noesy.pks
         HG     49 VAL  HN      5.00       #,  n15_noesy.pks
         HG     61 ALA  HN      5.00       #,  n15_noesy.pks
         HG     68 THR  HB      5.00       #,  c13_noesy.pks
         HG     69 LEU  HN      5.00       #,  n15_noesy.pks
         QQD    49 VAL  HN      7.40       #q;dMe,  n15_noesy.pks
         QQD    58 LEU  HN      7.40       #q;dMe,  n15_noesy.pks
         QQD    58 LEU  HA      7.40       #q;dMe,  c13_noesy.pks
         QQD    59 GLU  HN      7.40       #q;dMe,  n15_noesy.pks
         QQD    61 ALA  QB      8.40       #q;dMe,m;Me  c13_noesy.pks
         QQD    66 VAL  HN      7.40       #q;dMe,  n15_noesy.pks
         QQD    69 LEU  HN      7.40       #q;dMe,  n15_noesy.pks
 49 VAL   
         HN     49 VAL  HA      5.00       #,  c13_noesy.pks
         HN     49 VAL  HB      4.00       #,  n15_noesy.pks
         HN     49 VAL  QQG     6.70       #,s;dMe  n15_noesy.pks
         HN     57 LYS  QB      6.00       #,m;one  n15_noesy.pks
         HA     49 VAL  QQG     5.60       #,i;dMe  c13_noesy.pks
         HA     50 VAL  HN      3.00       #,  n15_noesy.pks
         HA     69 LEU  HN      5.00       #,  n15_noesy.pks
         HA     69 LEU  HB2     4.00       #,both  c13_noesy.pks
         HA     69 LEU  HB3     4.00       #,both  c13_noesy.pks
         HB     74 LEU  QQD     7.40       #,q;dMe  c13_noesy.pks
         QQG    50 VAL  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    51 GLY  QA      8.40       #q;dMe,m;one  c13_noesy.pks
         QQG    74 LEU  HN      7.40       #q;dMe,  c13_noesy.pks
         QQG    50 VAL  QQG     9.80       #q;dMe,q;dMe  c13_noesy.pks
         QQG    74 LEU  QQD     9.80       #q;dMe,q;dMe  c13_noesy.pks
 50 VAL   
         HN     50 VAL  HA      4.00       #,  n15_noesy.pks
         HN     50 VAL  HB      4.00       #,  n15_noesy.pks
         HN     50 VAL  QQG     6.70       #,s;dMe  n15_noesy.pks
         HN     70 THR  HA      3.00       #,  c13_noesy.pks
         HN     71 GLU  QB      6.00       #,m;db  n15_noesy.pks
         HA     50 VAL  QQG     5.60       #,i;dMe  c13_noesy.pks
         HA     51 GLY  HN      4.00       #,  c13_noesy.pks
         HB     50 VAL  QQG     5.00       #,  c13_noesy.pks
         HB     68 THR  HB      3.00       #,  c13_noesy.pks
         HB     70 THR  HA      5.00       #,  c13_noesy.pks
         QQG    51 GLY  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    52 GLU  HA      7.40       #q;dMe,  c13_noesy.pks
         QQG    55 GLY  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    58 LEU  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    68 THR  HA      7.40       #q;dMe,  c13_noesy.pks
         QQG    68 THR  HB      7.40       #q;dMe,  c13_noesy.pks
         QQG    69 LEU  HN      7.40       #q;dMe,  n15_noesy.pks
         QQG    71 GLU  QB      8.40       #q;dMe,m;db  c13_noesy.pks
 51 GLY   
         HN     51 GLY  QA      4.60       #,i;one  n15_noesy.pks
         HA2    52 GLU  HN      4.00       #both,  n15_noesy.pks
         HA1    52 GLU  HN      4.00       #both,  n15_noesy.pks
         QA     52 GLU  QB      6.20       #i;one,i;one  c13_noesy.pks
         QA     53 ASN  QB      7.00       #m;one,m;db  c13_noesy.pks
         QA     71 GLU  HN      6.00       #m;one,  c13_noesy.pks
         QA     71 GLU  QB      7.00       #m;one,m;db  c13_noesy.pks
 52 GLU   
         HN     52 GLU  HA      4.00       #,  n15_noesy.pks
         HN     52 GLU  QB      4.60       #,i;one  c13_noesy.pks
         HN     52 GLU  QG      6.00       #,m;one  n15_noesy.pks
         HA     53 ASN  HN      3.00       #,  n15_noesy.pks
         QB     53 ASN  HN      4.60       #i;one,  n15_noesy.pks
         QG     53 ASN  HN      6.00       #m;one,  c13_noesy.pks
 53 ASN   
         HN     53 ASN  HA      3.00       #,  n15_noesy.pks
         HN     53 ASN  QB      5.60       #,i;db  n15_noesy.pks
         HN     54 PRO  QD      6.00       #,m;one  n15_noesy.pks
         HA     53 ASN  QB      4.60       #,i;db  c13_noesy.pks
         HA     53 ASN  HD22    5.00       #,  c13_noesy.pks
         HA     54 PRO  QD      6.00       #,m;one  c13_noesy.pks
         QB     53 ASN  HD21    5.60       #i;db,both  n15_noesy.pks
         QB     53 ASN  HD22    5.60       #i;db,both  n15_noesy.pks
         QB     54 PRO  HA      5.60       #i;db,  c13_noesy.pks
         QB     54 PRO  QD      6.60       #i;db,m;one  c13_noesy.pks
 54 PRO   
         HA     54 PRO  QB      5.60       #,i;db  c13_noesy.pks
         HA     55 GLY  HN      5.00       #,  c13_noesy.pks
         HA     56 SER  HN      5.00       #,  n15_noesy.pks
         QB     55 GLY  QA      6.20       #i;db,i;one  c13_noesy.pks
         QB     56 SER  QB      7.00       #m;db,m;db  c13_noesy.pks
         QD     55 GLY  HN      6.00       #m;one,  n15_noesy.pks
 55 GLY   
         HN     55 GLY  QA      4.60       #,i;one  n15_noesy.pks
         HN     56 SER  HA      4.00       #,  n15_noesy.pks
         HN     56 SER  QB      5.60       #,i;db  c13_noesy.pks
         QA     56 SER  HN      4.60       #i;one,  c13_noesy.pks
         QA     56 SER  HN      5.60       #i;one,  n15_noesy.pks
         QA     57 LYS  HN      6.00       #m;one,  n15_noesy.pks
         QA     58 LEU  HN      5.00       #m;one,  n15_noesy.pks
         HA2    58 LEU  HB3     5.00       #both,both  c13_noesy.pks
         HA1    58 LEU  HB2     5.00       #both,both  c13_noesy.pks
         QA     58 LEU  QB      7.00       #m;one,m;one  c13_noesy.pks
 56 SER   
         HN     56 SER  HA      4.00       #,  c13_noesy.pks
         HN     56 SER  QB      5.60       #,i;db  n15_noesy.pks
         QB     57 LYS  HN      5.60       #i;db,  n15_noesy.pks
         QB     59 GLU  HN      6.00       #m;db,  n15_noesy.pks
         QB     59 GLU  QB      6.00       #m;db,m;one  c13_noesy.pks
 57 LYS   
         HN     58 LEU  HN      4.00       #,  n15_noesy.pks
         HA     61 ALA  HN      4.00       #,  n15_noesy.pks
 58 LEU   
         HN     58 LEU  HA      4.00       #,  n15_noesy.pks
         HN     58 LEU  HB2     5.00       #,both  n15_noesy.pks
         HN     58 LEU  HB3     5.00       #,both  n15_noesy.pks
         HN     58 LEU  HG      5.00       #,  n15_noesy.pks
         HN     59 GLU  QB      5.60       #,i;one  n15_noesy.pks
         HN     68 THR  QG2     6.00       #,m;Me  n15_noesy.pks
         HA     58 LEU  HB2     5.00       #,both  c13_noesy.pks
         HA     58 LEU  HB3     5.00       #,both  c13_noesy.pks
         HA     58 LEU  HG      5.00       #,  c13_noesy.pks
         HA     58 LEU  QQD     6.70       #,s;dMe  c13_noesy.pks
         HA     59 GLU  HN      4.00       #,  n15_noesy.pks
         HA     61 ALA  HN      4.00       #,  n15_noesy.pks
         HA     61 ALA  QB      6.00       #,m;Me  c13_noesy.pks
         QB     58 LEU  HG      5.60       #i;one,  c13_noesy.pks
         QB     59 GLU  HN      4.60       #i;one,  n15_noesy.pks
         HG     58 LEU  QQD     5.00       #,  c13_noesy.pks
         HG     59 GLU  HN      5.00       #,  c13_noesy.pks
         HG     61 ALA  QB      6.00       #,m;Me  c13_noesy.pks
         HG     62 ARG  QD      6.00       #,m;dd  c13_noesy.pks
         QQD    59 GLU  HN      7.40       #q;dMe,  n15_noesy.pks
         QQD    62 ARG  HN      7.40       #q;dMe,  n15_noesy.pks
 59 GLU   
         HN     59 GLU  HA      5.00       #,  c13_noesy.pks
         HN     60 LYS  HN      4.00       #,  n15_noesy.pks
         HA     63 ALA  HN      4.00       #,  n15_noesy.pks
 60 LYS   
         HN     60 LYS  HA      4.00       #,  n15_noesy.pks
         HN     60 LYS  QB      5.60       #,i;one  n15_noesy.pks
         HN     60 LYS  QG      6.00       #,m;dg  n15_noesy.pks
         HN     61 ALA  HN      4.00       #,  n15_noesy.pks
         HN     61 ALA  QB      6.00       #,m;Me  n15_noesy.pks
         HN     62 ARG  QB      6.00       #,m;db  n15_noesy.pks
         HA     60 LYS  QB      4.60       #,i;one  c13_noesy.pks
         HA     62 ARG  HN      4.00       #,  n15_noesy.pks
         HA     63 ALA  HN      4.00       #,  n15_noesy.pks
         HA     63 ALA  QB      5.00       #,m;Me  c13_noesy.pks
         HA     64 LEU  HN      5.00       #,  n15_noesy.pks
         QB     61 ALA  HN      4.60       #i;one,  n15_noesy.pks
         QG     61 ALA  HN      6.00       #m;dg,  n15_noesy.pks
         QE     64 LEU  QB      7.00       #m;de,m;one  c13_noesy.pks
         QE     68 THR  QG2     7.00       #m;de,m;Me  c13_noesy.pks
 61 ALA   
         HN     61 ALA  QB      4.60       #,i;Me  n15_noesy.pks
         QB     62 ARG  HN      6.00       #m;Me,  n15_noesy.pks
         QB     65 GLY  QA      6.00       #m;Me,m;one  c13_noesy.pks
         QB     66 VAL  HN      6.00       #m;Me,  n15_noesy.pks
         QB     68 THR  HA      6.00       #m;Me,  c13_noesy.pks
 62 ARG   
         HN     62 ARG  HA      4.00       #,  n15_noesy.pks
         HN     62 ARG  QB      4.60       #,i;db  c13_noesy.pks
         HN     63 ALA  HN      3.00       #,  n15_noesy.pks
         HN     65 GLY  QA      6.00       #,m;one  n15_noesy.pks
         HA     62 ARG  QD      6.00       #,m;dd  c13_noesy.pks
         HA     63 ALA  HN      4.00       #,  n15_noesy.pks
         HA     64 LEU  HN      5.00       #,  n15_noesy.pks
         QB     63 ALA  HN      4.60       #i;db,  n15_noesy.pks
         QD     65 GLY  QA      7.00       #m;dd,m;one  c13_noesy.pks
 63 ALA   
         HN     63 ALA  QB      3.60       #,i;Me  n15_noesy.pks
         HN     64 LEU  HN      4.00       #,  n15_noesy.pks
         QB     64 LEU  HN      5.00       #m;Me,  n15_noesy.pks
         QB     65 GLY  HN      6.00       #m;Me,  n15_noesy.pks
 64 LEU   
         HN     64 LEU  HA      4.00       #,  n15_noesy.pks
         HN     64 LEU  HB2     4.00       #,both  c13_noesy.pks
         HN     64 LEU  HB3     4.00       #,both  c13_noesy.pks
         HN     64 LEU  HG      5.00       #,  n15_noesy.pks
         HN     64 LEU  QQD     7.20       #,r;dMe  n15_noesy.pks
         HN     65 GLY  HN      3.00       #,  n15_noesy.pks
         HN     65 GLY  QA      4.60       #,i;one  n15_noesy.pks
         HA     64 LEU  HB2     4.00       #,both  c13_noesy.pks
         HA     64 LEU  HB3     4.00       #,both  c13_noesy.pks
         QB     64 LEU  HG      5.60       #i;one,  c13_noesy.pks
         QB     66 VAL  HN      6.00       #m;one,  n15_noesy.pks
         QB     66 VAL  HB      5.00       #m;one,  c13_noesy.pks
 65 GLY   
         HN     65 GLY  QA      4.60       #,i;one  n15_noesy.pks
         HN     65 GLY  QA      3.60       #,i;one  c13_noesy.pks
         HN     66 VAL  HN      4.00       #,  n15_noesy.pks
         QA     66 VAL  HN      5.60       #i;one,  n15_noesy.pks
 66 VAL   
         HN     66 VAL  HB      4.00       #,  c13_noesy.pks
         HN     67 PRO  QD      6.00       #,m;one  n15_noesy.pks
         HA     66 VAL  HB      5.00       #,  c13_noesy.pks
         HB     67 PRO  QD      6.00       #,m;one  c13_noesy.pks
 67 PRO   
         HA     67 PRO  QB      4.60       #,i;db  c13_noesy.pks
         HA     67 PRO  QD      6.00       #,m;one  c13_noesy.pks
         HA     68 THR  HN      4.00       #,  c13_noesy.pks
         HA     68 THR  HA      5.00       #,  c13_noesy.pks
         QB     67 PRO  HD2     5.60       #i;db,both  c13_noesy.pks
         QB     67 PRO  HD3     5.60       #i;db,both  c13_noesy.pks
         QB     68 THR  HN      5.60       #i;db,  c13_noesy.pks
 68 THR   
         HN     68 THR  HA      4.00       #,  n15_noesy.pks
         HN     68 THR  HB      5.00       #,  c13_noesy.pks
         HN     68 THR  QG2     6.00       #,m;Me  n15_noesy.pks
         HA     68 THR  HB      4.00       #,  c13_noesy.pks
         HA     68 THR  QG2     5.60       #,i;Me  c13_noesy.pks
         HA     69 LEU  HN      3.00       #,  n15_noesy.pks
         HA     69 LEU  HA      5.00       #,  c13_noesy.pks
         HB     69 LEU  HN      4.00       #,  c13_noesy.pks
         HB     69 LEU  HA      5.00       #,  c13_noesy.pks
 69 LEU   
         HN     69 LEU  HA      4.00       #,  n15_noesy.pks
         HN     69 LEU  HB2     4.00       #,both  c13_noesy.pks
         HN     69 LEU  HB3     4.00       #,both  c13_noesy.pks
         HN     69 LEU  HG      5.00       #,  n15_noesy.pks
         HA     69 LEU  HB2     4.00       #,both  c13_noesy.pks
         HA     69 LEU  HB3     4.00       #,both  c13_noesy.pks
         HA     69 LEU  HG      5.00       #,  c13_noesy.pks
         HA     70 THR  HN      3.00       #,  n15_noesy.pks
         HA     73 GLU  QB      6.00       #,m;db  c13_noesy.pks
         HB2    69 LEU  HG      5.00       #both,  c13_noesy.pks
         HB3    69 LEU  HG      5.00       #both,  c13_noesy.pks
         QB     74 LEU  HN      5.00       #m;one,  n15_noesy.pks
         HB2    74 LEU  HA      5.00       #both,  c13_noesy.pks
         HB3    74 LEU  HA      5.00       #both,  c13_noesy.pks
         HG     70 THR  HN      5.00       #,  n15_noesy.pks
         HG     73 GLU  QB      6.00       #,m;db  c13_noesy.pks
 70 THR   
         HN     70 THR  HA      4.00       #,  n15_noesy.pks
         HN     70 THR  HB      4.00       #,  c13_noesy.pks
         HN     70 THR  QG2     6.00       #,m;Me  n15_noesy.pks
         HN     73 GLU  QB      5.00       #,m;db  n15_noesy.pks
         HA     70 THR  QG2     5.60       #,i;Me  c13_noesy.pks
         HA     71 GLU  HN      3.00       #,  n15_noesy.pks
         HA     71 GLU  HA      5.00       #,  c13_noesy.pks
         HA     71 GLU  QB      5.60       #,i;db  c13_noesy.pks
         HA     73 GLU  HN      5.00       #,  c13_noesy.pks
         HB     70 THR  QG2     6.00       #,m;Me  c13_noesy.pks
         HB     71 GLU  HN      4.00       #,  c13_noesy.pks
         HB     72 GLU  HN      4.00       #,  n15_noesy.pks
         HB     72 GLU  QB      6.00       #,m;db  c13_noesy.pks
         HB     73 GLU  HN      4.00       #,  n15_noesy.pks
         QG2    71 GLU  HN      6.00       #m;Me,  n15_noesy.pks
         QG2    71 GLU  HA      6.00       #m;Me,  c13_noesy.pks
         QG2    71 GLU  QB      6.60       #m;Me,i;db  c13_noesy.pks
         QG2    72 GLU  QB      7.00       #m;Me,m;db  c13_noesy.pks
         QG2    72 GLU  QG      7.00       #m;Me,m;dg  c13_noesy.pks
 71 GLU   
         HN     71 GLU  HA      4.00       #,  n15_noesy.pks
         HN     71 GLU  QB      5.60       #,i;db  c13_noesy.pks
         HN     72 GLU  HN      4.00       #,  n15_noesy.pks
         HN     72 GLU  QB      5.60       #,i;db  c13_noesy.pks
         HA     71 GLU  QB      4.60       #,i;db  c13_noesy.pks
         HA     72 GLU  HN      5.00       #,  n15_noesy.pks
         HA     74 LEU  HN      4.00       #,  n15_noesy.pks
         HA     74 LEU  HB2     4.00       #,both  c13_noesy.pks
         HA     74 LEU  HB3     4.00       #,both  c13_noesy.pks
         HA     74 LEU  HG      5.00       #,  c13_noesy.pks
         HA     75 TYR  HN      5.00       #,  c13_noesy.pks
         QB     72 GLU  HN      5.60       #i;db,  c13_noesy.pks
         QG     74 LEU  QB      7.00       #m;dg,m;one  c13_noesy.pks
 72 GLU   
         HN     72 GLU  HA      4.00       #,  n15_noesy.pks
         HN     72 GLU  QB      5.60       #,i;db  c13_noesy.pks
         HN     72 GLU  QG      6.00       #,m;dg  n15_noesy.pks
         HN     73 GLU  HN      4.00       #,  n15_noesy.pks
         HA     72 GLU  QG      6.00       #,m;dg  c13_noesy.pks
         HA     73 GLU  HN      4.00       #,  c13_noesy.pks
         HA     75 TYR  HN      4.00       #,  n15_noesy.pks
         HA     75 TYR  CG      7.20       #,r;dd  c13_noesy.pks
         QB     73 GLU  HN      5.60       #i;db,  n15_noesy.pks
         QG     73 GLU  HN      6.00       #m;dg,  n15_noesy.pks
         QG     73 GLU  HA      6.00       #m;dg,  c13_noesy.pks
 73 GLU   
         HN     73 GLU  HA      4.00       #,  n15_noesy.pks
         HN     73 GLU  QB      5.60       #,i;db  n15_noesy.pks
         HN     74 LEU  HN      4.00       #,  n15_noesy.pks
         HA     73 GLU  QB      4.60       #,i;db  c13_noesy.pks
         HA     74 LEU  HN      5.00       #,  c13_noesy.pks
         HA     76 ARG  HN      4.00       #,  n15_noesy.pks
         HA     76 ARG  QB      5.00       #,m;db  c13_noesy.pks
         HA     76 ARG  QD      6.00       #,m;dd  c13_noesy.pks
         HA     77 LEU  HN      4.00       #,  c13_noesy.pks
         QB     74 LEU  HN      5.60       #i;db,  n15_noesy.pks
         QB     76 ARG  HN      6.00       #m;db,  c13_noesy.pks
         QB     77 LEU  HN      6.00       #m;db,  n15_noesy.pks
 74 LEU   
         HN     74 LEU  HA      4.00       #,  n15_noesy.pks
         HN     74 LEU  HB2     4.00       #,both  n15_noesy.pks
         HN     74 LEU  HB3     4.00       #,both  n15_noesy.pks
         HN     75 TYR  HN      4.00       #,  n15_noesy.pks
         HN     76 ARG  QB      6.00       #,m;db  n15_noesy.pks
         HA     74 LEU  QB      4.60       #,i;one  c13_noesy.pks
         HA     77 LEU  HN      5.00       #,  n15_noesy.pks
         HA     78 LEU  HN      5.00       #,  n15_noesy.pks
         HB2    74 LEU  HG      5.00       #both,  c13_noesy.pks
         HB3    74 LEU  HG      5.00       #both,  c13_noesy.pks
         HB2    75 TYR  HN      5.00       #both,  c13_noesy.pks
         HB3    75 TYR  HN      5.00       #both,  c13_noesy.pks
         QB     77 LEU  HN      6.00       #m;one,  n15_noesy.pks
         HG     75 TYR  HN      5.00       #,  n15_noesy.pks
 75 TYR   
         HN     75 TYR  HA      4.00       #,  n15_noesy.pks
         HN     75 TYR  QB      4.60       #,i;db  n15_noesy.pks
         HN     78 LEU  QQD     7.40       #,q;dMe  n15_noesy.pks
         HA     75 TYR  QB      5.60       #,i;db  c13_noesy.pks
         HA     75 TYR  CG      6.00       #,m;dd  c13_noesy.pks
         HA     75 TYR  CZ      6.00       #,m;de  c13_noesy.pks
         HA     76 ARG  HN      4.00       #,  n15_noesy.pks
         HA     78 LEU  HN      5.00       #,  n15_noesy.pks
         HA     78 LEU  QB      5.00       #,m;one  c13_noesy.pks
         HA     78 LEU  QQD     7.40       #,q;dMe  c13_noesy.pks
         HA     79 GLU  QG      6.00       #,m;dg  c13_noesy.pks
         HA     86 ALA  QB      6.00       #,m;Me  c13_noesy.pks
         QB     75 TYR  CG      6.60       #i;db,m;dd  c13_noesy.pks
         QB     75 TYR  CZ      6.60       #i;db,m;de  c13_noesy.pks
         QB     76 ARG  HN      4.60       #i;db,  n15_noesy.pks
         QB     76 ARG  HA      5.60       #i;db,  c13_noesy.pks
         QB     76 ARG  QB      6.20       #i;db,i;db  c13_noesy.pks
         QB     86 ALA  HA      6.00       #m;db,  c13_noesy.pks
         QB     86 ALA  QB      7.00       #m;db,m;Me  c13_noesy.pks
         CG     76 ARG  HA      7.20       #r;dd,  c13_noesy.pks
         CG     86 ALA  QB      8.20       #r;dd,m;Me  c13_noesy.pks
         CG     89 LEU  HG      7.20       #r;dd,  c13_noesy.pks
         CZ     78 LEU  QQD     9.60       #r;de,q;dMe  c13_noesy.pks
         CZ     79 GLU  QB      8.20       #r;de,m;db  c13_noesy.pks
         CZ     86 ALA  QB      8.20       #r;de,m;Me  c13_noesy.pks
         CZ     89 LEU  HG      7.20       #r;de,  c13_noesy.pks
 76 ARG   
         HN     76 ARG  QB      5.60       #,i;db  c13_noesy.pks
         HA     76 ARG  QB      3.60       #,i;db  c13_noesy.pks
         HA     76 ARG  QD      6.00       #,m;dd  c13_noesy.pks
         HA     78 LEU  HN      5.00       #,  n15_noesy.pks
         HA     79 GLU  QB      6.00       #,m;db  c13_noesy.pks
         HA     80 ALA  HN      5.00       #,  n15_noesy.pks
         HA     86 ALA  QB      6.00       #,m;Me  c13_noesy.pks
         QB     77 LEU  HN      5.60       #i;db,  n15_noesy.pks
         QB     78 LEU  HN      6.00       #m;db,  n15_noesy.pks
 77 LEU   
         HN     77 LEU  HA      3.00       #,  n15_noesy.pks
         HN     77 LEU  HB2     5.00       #,both  n15_noesy.pks
         HN     77 LEU  HB3     5.00       #,both  n15_noesy.pks
         HN     77 LEU  QQD     7.20       #,r;dMe  n15_noesy.pks
         HN     78 LEU  HN      4.00       #,  n15_noesy.pks
         HN     78 LEU  QB      5.60       #,i;one  n15_noesy.pks
         HA     77 LEU  HB2     4.00       #,both  c13_noesy.pks
         HA     77 LEU  HB3     4.00       #,both  c13_noesy.pks
         HA     78 LEU  HN      5.00       #,  n15_noesy.pks
         HA     81 ARG  HN      5.00       #,  n15_noesy.pks
         QB     78 LEU  HN      4.60       #i;one,  n15_noesy.pks
         QB     78 LEU  QB      5.20       #i;one,i;one  c13_noesy.pks
         QQD    78 LEU  HN      7.40       #q;dMe,  c13_noesy.pks
 78 LEU   
         HN     78 LEU  QD1     6.00       #,m;bothMe  n15_noesy.pks
         HN     78 LEU  QD2     6.00       #,m;bothMe  n15_noesy.pks
         HA     78 LEU  HB2     4.00       #,both  c13_noesy.pks
         HA     78 LEU  HB3     4.00       #,both  c13_noesy.pks
         HA     79 GLU  HN      4.00       #,  c13_noesy.pks
         HA     81 ARG  HN      4.00       #,  n15_noesy.pks
         HA     81 ARG  QB      5.00       #,m;db  c13_noesy.pks
         QB     78 LEU  QQD     5.60       #i;one,  c13_noesy.pks
         QB     79 GLU  HN      5.60       #i;one,  n15_noesy.pks
 79 GLU   
         HN     79 GLU  HA      4.00       #,  n15_noesy.pks
         HN     79 GLU  QB      4.60       #,i;db  n15_noesy.pks
         HN     79 GLU  QG      6.00       #,m;dg  n15_noesy.pks
         HN     80 ALA  HN      4.00       #,  n15_noesy.pks
         HA     79 GLU  QB      4.60       #,i;db  c13_noesy.pks
         HA     79 GLU  QG      6.00       #,m;dg  c13_noesy.pks
         HA     80 ALA  HN      4.00       #,  c13_noesy.pks
         HA     82 THR  HN      4.00       #,  n15_noesy.pks
         QB     80 ALA  HA      5.60       #i;db,  c13_noesy.pks
         QB     82 THR  HB      6.00       #m;db,  c13_noesy.pks
         QB     85 LYS  HN      6.00       #m;db,  n15_noesy.pks
         QB     85 LYS  HA      5.00       #m;db,  c13_noesy.pks
         QB     86 ALA  HN      6.00       #m;db,  n15_noesy.pks
         QG     80 ALA  HN      6.00       #m;dg,  c13_noesy.pks
         QG     82 THR  QG2     7.00       #m;dg,m;Me  c13_noesy.pks
         QG     85 LYS  HA      6.00       #m;dg,  c13_noesy.pks
         QG     86 ALA  HN      6.00       #m;dg,  n15_noesy.pks
         QG     86 ALA  HA      6.00       #m;dg,  c13_noesy.pks
         QG     86 ALA  QB      7.00       #m;dg,m;Me  c13_noesy.pks
 80 ALA   
         HN     80 ALA  HA      5.00       #,  n15_noesy.pks
         HN     80 ALA  QB      4.60       #,i;Me  n15_noesy.pks
         HN     81 ARG  HN      3.00       #,  n15_noesy.pks
         HN     82 THR  HB      5.00       #,  n15_noesy.pks
         HN     85 LYS  QB      5.00       #,m;one  n15_noesy.pks
         HA     80 ALA  QB      4.20       #, ;Me  c13_noesy.pks
         HA     81 ARG  HN      5.00       #,  n15_noesy.pks
         HA     83 GLY  HN      4.00       #,  n15_noesy.pks
         HA     84 LYS  HN      5.00       #,  n15_noesy.pks
         HA     84 LYS  HA      4.00       #,  c13_noesy.pks
         HA     85 LYS  QB      4.00       #,m;one  c13_noesy.pks
 81 ARG   
         HN     81 ARG  HA      4.00       #,  n15_noesy.pks
         HN     81 ARG  QB      4.60       #,i;db  c13_noesy.pks
         HN     82 THR  HN      4.00       #,  n15_noesy.pks
         HN     82 THR  HB      5.00       #,  n15_noesy.pks
         HA     81 ARG  QD      6.00       #,m;dd  c13_noesy.pks
         QB     82 THR  HN      5.60       #i;db,  n15_noesy.pks
         QB     82 THR  HA      4.60       #i;db,  c13_noesy.pks
         QD     82 THR  HA      6.00       #m;dd,  c13_noesy.pks
 82 THR   
         HN     82 THR  HA      4.00       #,  n15_noesy.pks
         HN     82 THR  HB      5.00       #,  c13_noesy.pks
         HN     83 GLY  HN      4.00       #,  n15_noesy.pks
         HA     83 GLY  HN      4.00       #,  n15_noesy.pks
         HB     84 LYS  HN      5.00       #,  n15_noesy.pks
         QG2    84 LYS  QG      7.00       #m;Me,m;one  c13_noesy.pks
 83 GLY   
         HN     83 GLY  HA2     4.00       #,both  n15_noesy.pks
         HN     83 GLY  HA1     4.00       #,both  n15_noesy.pks
         HA2    84 LYS  HN      5.00       #both,  n15_noesy.pks
         HA1    84 LYS  HN      5.00       #both,  n15_noesy.pks
         QA     84 LYS  HA      4.60       #i;one,  c13_noesy.pks
         QA     84 LYS  QB      6.20       #i;one,i;db  c13_noesy.pks
 84 LYS   
         HN     84 LYS  HA      4.00       #,  n15_noesy.pks
         HN     84 LYS  QB      4.60       #,i;db  n15_noesy.pks
         HN     84 LYS  HG2     5.00       #,both  c13_noesy.pks
         HN     84 LYS  HG3     5.00       #,both  c13_noesy.pks
         HA     84 LYS  QG      6.00       #,m;one  c13_noesy.pks
         HA     85 LYS  HN      4.00       #,  c13_noesy.pks
         QB     84 LYS  QD      6.60       #i;db,m;dd  c13_noesy.pks
         QB     85 LYS  HN      4.60       #i;db,  n15_noesy.pks
         QB     88 GLU  HN      6.00       #m;db,  n15_noesy.pks
         QB     89 LEU  HN      5.00       #m;db,  n15_noesy.pks
         HG2    84 LYS  QD      6.00       #both,m;dd  c13_noesy.pks
         HG3    84 LYS  QD      6.00       #both,m;dd  c13_noesy.pks
         QG     85 LYS  HN      6.00       #m;one,  c13_noesy.pks
         QG     85 LYS  HA      6.00       #m;one,  c13_noesy.pks
         QG     89 LEU  QB      7.00       #m;one,m;one  c13_noesy.pks
         QD     89 LEU  HA      6.00       #m;dd,  c13_noesy.pks
         QD     89 LEU  QB      7.00       #m;dd,m;one  c13_noesy.pks
 85 LYS   
         HN     85 LYS  HA      4.00       #,  n15_noesy.pks
         HN     85 LYS  QB      5.60       #,i;one  n15_noesy.pks
         HA     85 LYS  QB      4.60       #,i;one  c13_noesy.pks
         HA     86 ALA  HN      3.00       #,  n15_noesy.pks
         HA     86 ALA  QB      6.00       #,m;Me  c13_noesy.pks
         HA     87 GLU  HN      5.00       #,  c13_noesy.pks
         QB     86 ALA  HN      5.60       #i;one,  n15_noesy.pks
         QB     87 GLU  QB      5.00       #m;one,m;db  c13_noesy.pks
         QB     88 GLU  HN      6.00       #m;one,  n15_noesy.pks
         QE     87 GLU  QB      7.00       #m;de,m;db  c13_noesy.pks
 86 ALA   
         HN     86 ALA  HA      4.00       #,  n15_noesy.pks
         HN     86 ALA  QB      4.60       #,i;Me  n15_noesy.pks
         HN     87 GLU  HN      4.00       #,  n15_noesy.pks
         HN     87 GLU  QB      5.60       #,i;db  n15_noesy.pks
         HA     86 ALA  QB      4.20       #, ;Me  c13_noesy.pks
         HA     87 GLU  HN      4.00       #,  n15_noesy.pks
         HA     89 LEU  HN      4.00       #,  n15_noesy.pks
         HA     89 LEU  HB2     4.00       #,both  c13_noesy.pks
         HA     89 LEU  HB3     4.00       #,both  c13_noesy.pks
         QB     87 GLU  HN      5.00       #m;Me,  n15_noesy.pks
         QB     88 GLU  HN      6.00       #m;Me,  c13_noesy.pks
         QB     89 LEU  HN      6.00       #m;Me,  n15_noesy.pks
 87 GLU   
         HN     87 GLU  HA      4.00       #,  c13_noesy.pks
         HN     87 GLU  QB      4.60       #,i;db  n15_noesy.pks
         HN     87 GLU  QG      6.00       #,m;dg  n15_noesy.pks
         HN     88 GLU  HN      4.00       #,  n15_noesy.pks
         HA     87 GLU  QG      6.00       #,m;dg  c13_noesy.pks
         HA     90 VAL  HB      3.00       #,  c13_noesy.pks
         QB     88 GLU  HN      5.60       #i;db,  n15_noesy.pks
         QG     88 GLU  HN      6.00       #m;dg,  n15_noesy.pks
 88 GLU   
         HN     88 GLU  QB      5.60       #,i;db  n15_noesy.pks
         HA     88 GLU  QB      4.60       #,i;db  c13_noesy.pks
         QB     89 LEU  HA      4.60       #i;db,  c13_noesy.pks
 89 LEU   
         HN     89 LEU  HA      5.00       #,  n15_noesy.pks
         HN     89 LEU  HB2     4.00       #,both  c13_noesy.pks
         HN     89 LEU  HB3     4.00       #,both  c13_noesy.pks
         HN     89 LEU  HG      5.00       #,  c13_noesy.pks
         HA     89 LEU  QB      4.60       #,i;one  c13_noesy.pks
         HA     90 VAL  HN      4.00       #,  n15_noesy.pks
         QB     90 VAL  HN      4.60       #i;one,  n15_noesy.pks
         HG     90 VAL  HN      5.00       #,  n15_noesy.pks
         HG     90 VAL  HB      5.00       #,  c13_noesy.pks
 90 VAL   
         HN     90 VAL  HA      4.00       #,  n15_noesy.pks
         HN     90 VAL  HB      5.00       #,  c13_noesy.pks
         HN     90 VAL  QQG     6.70       #,s;dMe  n15_noesy.pks
         HA     90 VAL  HB      3.00       #,  c13_noesy.pks
         HA     91 GLY  HN      4.00       #,  n15_noesy.pks
         HB     91 GLY  HN      4.00       #,  n15_noesy.pks
         HB     91 GLY  QA      5.60       #,i;da  c13_noesy.pks
 91 GLY   
         HN     91 GLY  QA      4.60       #,i;da  n15_noesy.pks





  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   MET   1           HA       MET   1 -19.283   7.920 -19.471
    2   1HB   MET   1          2HB       MET   1 -21.453   6.938 -20.616
    3   2HB   MET   1          1HB       MET   1 -21.745   6.256 -19.017
    4   1HG   MET   1          2HG       MET   1 -21.016   9.160 -19.261
    5   2HG   MET   1          1HG       MET   1 -22.669   8.654 -19.603
    6   1HE   MET   1          1HE       MET   1 -22.211  10.713 -17.291
    7   2HE   MET   1          2HE       MET   1 -20.545  10.140 -17.271
    8   3HE   MET   1          3HE       MET   1 -21.505  10.087 -15.794
    9    H    GLU   2           H        GLU   2 -19.494   4.565 -18.449
   10    HA   GLU   2           HA       GLU   2 -19.679   5.231 -15.605
   11   1HB   GLU   2          2HB       GLU   2 -19.045   2.684 -15.452
   12   2HB   GLU   2          1HB       GLU   2 -20.642   3.148 -16.039
   13   1HG   GLU   2          2HG       GLU   2 -20.087   2.708 -18.281
   14   2HG   GLU   2          1HG       GLU   2 -18.353   2.804 -17.969
   15    H    LYS   3           H        LYS   3 -17.901   6.329 -14.856
   16    HA   LYS   3           HA       LYS   3 -15.191   5.668 -15.736
   17   1HB   LYS   3          2HB       LYS   3 -16.218   7.956 -14.838
   18   2HB   LYS   3          1HB       LYS   3 -15.724   7.298 -13.278
   19   1HG   LYS   3          2HG       LYS   3 -13.786   8.419 -13.911
   20   2HG   LYS   3          1HG       LYS   3 -13.458   6.806 -14.543
   21   1HD   LYS   3          2HD       LYS   3 -14.683   7.735 -16.695
   22   2HD   LYS   3          1HD       LYS   3 -14.226   9.301 -16.023
   23   1HE   LYS   3          2HE       LYS   3 -12.409   8.695 -17.428
   24   2HE   LYS   3          1HE       LYS   3 -11.857   8.321 -15.795
   25   1HZ   LYS   3          1HZ       LYS   3 -12.189   6.062 -16.114
   26   2HZ   LYS   3          2HZ       LYS   3 -11.550   6.566 -17.605
   27   3HZ   LYS   3          3HZ       LYS   3 -13.218   6.287 -17.443
   28    H    GLY   4           H        GLY   4 -17.346   4.614 -13.259
   29   1HA   GLY   4          2HA       GLY   4 -17.095   2.929 -11.639
   30   2HA   GLY   4          1HA       GLY   4 -15.545   2.538 -12.384
   31    H    GLY   5           H        GLY   5 -13.649   3.530 -11.582
   32   1HA   GLY   5          2HA       GLY   5 -12.292   4.666 -10.034
   33   2HA   GLY   5          1HA       GLY   5 -13.703   5.619  -9.578
   34    H    GLU   6           H        GLU   6 -12.557   2.235  -9.276
   35    HA   GLU   6           HA       GLU   6 -13.095   2.360  -6.375
   36   1HB   GLU   6          2HB       GLU   6 -15.116   1.463  -7.992
   37   2HB   GLU   6          1HB       GLU   6 -14.268  -0.042  -7.638
   38   1HG   GLU   6          2HG       GLU   6 -15.928   0.273  -5.915
   39   2HG   GLU   6          1HG       GLU   6 -14.350   0.585  -5.192
   40    H    ALA   7           H        ALA   7 -10.773   1.930  -8.259
   41    HA   ALA   7           HA       ALA   7  -9.799  -0.637  -8.486
   42   1HB   ALA   7          1HB       ALA   7  -8.413   1.909  -7.653
   43   2HB   ALA   7          2HB       ALA   7  -8.353   1.081  -9.208
   44   3HB   ALA   7          3HB       ALA   7  -7.514   0.401  -7.815
   45    H    LEU   8           H        LEU   8  -8.430   1.100  -5.697
   46    HA   LEU   8           HA       LEU   8  -9.314  -1.117  -3.915
   47   1HB   LEU   8          2HB       LEU   8  -6.956  -0.823  -2.847
   48   2HB   LEU   8          1HB       LEU   8  -7.086  -1.774  -4.321
   49    HG   LEU   8           HG       LEU   8  -6.554   0.367  -5.605
   50   1HD1  LEU   8          1HD1      LEU   8  -5.188   1.982  -4.092
   51   2HD1  LEU   8          2HD1      LEU   8  -6.092   1.264  -2.761
   52   3HD1  LEU   8          3HD1      LEU   8  -6.945   2.103  -4.057
   53   1HD2  LEU   8          1HD2      LEU   8  -4.180  -0.068  -3.935
   54   2HD2  LEU   8          2HD2      LEU   8  -4.418  -0.390  -5.652
   55   3HD2  LEU   8          3HD2      LEU   8  -4.944  -1.569  -4.454
   56    H    LYS   9           H        LYS   9 -10.250   1.625  -4.367
   57    HA   LYS   9           HA       LYS   9  -9.267   3.324  -2.234
   58   1HB   LYS   9          2HB       LYS   9 -11.501   3.391  -4.210
   59   2HB   LYS   9          1HB       LYS   9 -11.688   4.377  -2.759
   60   1HG   LYS   9          2HG       LYS   9  -9.747   5.641  -3.222
   61   2HG   LYS   9          1HG       LYS   9  -9.145   4.455  -4.381
   62   1HD   LYS   9          2HD       LYS   9 -11.802   5.658  -4.975
   63   2HD   LYS   9          1HD       LYS   9 -10.405   6.721  -5.138
   64   1HE   LYS   9          2HE       LYS   9  -9.339   5.173  -6.680
   65   2HE   LYS   9          1HE       LYS   9 -10.622   3.987  -6.433
   66   1HZ   LYS   9          1HZ       LYS   9 -12.205   5.607  -7.323
   67   2HZ   LYS   9          2HZ       LYS   9 -11.001   5.211  -8.455
   68   3HZ   LYS   9          3HZ       LYS   9 -10.934   6.690  -7.622
   69    H    GLY  10           H        GLY  10 -10.785   4.052  -0.422
   70   1HA   GLY  10          2HA       GLY  10 -12.397   3.593   1.256
   71   2HA   GLY  10          1HA       GLY  10 -12.822   2.105   0.410
   72    H    LEU  11           H        LEU  11  -9.509   2.197   0.590
   73    HA   LEU  11           HA       LEU  11  -9.505   0.626   3.139
   74   1HB   LEU  11          2HB       LEU  11  -8.201   0.145   0.485
   75   2HB   LEU  11          1HB       LEU  11  -7.342  -0.366   1.935
   76    HG   LEU  11           HG       LEU  11  -8.688  -2.222   1.133
   77   1HD1  LEU  11          1HD1      LEU  11  -8.634  -1.436   3.681
   78   2HD1  LEU  11          2HD1      LEU  11  -9.607  -2.815   3.168
   79   3HD1  LEU  11          3HD1      LEU  11 -10.366  -1.241   3.407
   80   1HD2  LEU  11          1HD2      LEU  11 -10.364  -0.461   0.059
   81   2HD2  LEU  11          2HD2      LEU  11 -11.237  -0.710   1.570
   82   3HD2  LEU  11          3HD2      LEU  11 -10.915  -2.076   0.504
   83    H    THR  12           H        THR  12  -7.612   0.816   4.444
   84    HA   THR  12           HA       THR  12  -6.027   3.302   3.929
   85    HB   THR  12           HB       THR  12  -7.021   2.063   6.507
   86    HG1  THR  12           HG1      THR  12  -7.606   4.448   6.624
   87   1HG2  THR  12          1HG2      THR  12  -4.857   4.116   6.036
   88   2HG2  THR  12          2HG2      THR  12  -4.797   2.678   7.054
   89   3HG2  THR  12          3HG2      THR  12  -5.769   4.065   7.544
   90    H    PHE  13           H        PHE  13  -3.774   3.153   4.264
   91    HA   PHE  13           HA       PHE  13  -2.719   0.432   4.919
   92   1HB   PHE  13          2HB       PHE  13  -1.761   2.281   2.711
   93   2HB   PHE  13          1HB       PHE  13  -0.983   0.770   3.176
   94    HD1  PHE  13           HD1      PHE  13  -2.496  -1.376   3.168
   95    HD2  PHE  13           HD2      PHE  13  -3.466   2.261   1.092
   96    HE1  PHE  13           HE1      PHE  13  -4.049  -2.631   1.693
   97    HE2  PHE  13           HE2      PHE  13  -5.018   1.003  -0.379
   98    HZ   PHE  13           HZ       PHE  13  -5.314  -1.438  -0.082
   99    H    VAL  14           H        VAL  14  -1.274   0.505   6.532
  100    HA   VAL  14           HA       VAL  14  -0.004   3.135   7.194
  101    HB   VAL  14           HB       VAL  14  -1.568   1.970   8.900
  102   1HG1  VAL  14          1HG1      VAL  14   0.867   0.429   9.707
  103   2HG1  VAL  14          2HG1      VAL  14  -0.170  -0.247   8.455
  104   3HG1  VAL  14          3HG1      VAL  14  -0.830   0.100  10.049
  105   1HG2  VAL  14          1HG2      VAL  14   1.244   2.854   9.564
  106   2HG2  VAL  14          2HG2      VAL  14   0.012   2.565  10.790
  107   3HG2  VAL  14          3HG2      VAL  14  -0.224   3.828   9.587
  108    H    ILE  15           H        ILE  15   2.227   3.180   7.688
  109    HA   ILE  15           HA       ILE  15   3.722   0.729   6.824
  110    HB   ILE  15           HB       ILE  15   4.754   3.577   6.743
  111   1HG1  ILE  15          2HG1      ILE  15   4.349   3.075   4.158
  112   2HG1  ILE  15          1HG1      ILE  15   3.078   2.031   4.794
  113   1HG2  ILE  15          1HG2      ILE  15   6.626   2.698   5.769
  114   2HG2  ILE  15          2HG2      ILE  15   5.724   1.447   4.917
  115   3HG2  ILE  15          3HG2      ILE  15   6.127   1.238   6.620
  116   1HD1  ILE  15          1HD1      ILE  15   3.112   4.914   4.563
  117   2HD1  ILE  15          2HD1      ILE  15   2.876   4.443   6.245
  118   3HD1  ILE  15          3HD1      ILE  15   1.773   3.854   5.002
  119    H    THR  16           H        THR  16   4.754  -0.244   8.494
  120    HA   THR  16           HA       THR  16   4.955   0.874  11.115
  121    HB   THR  16           HB       THR  16   6.187  -1.470   9.714
  122    HG1  THR  16           HG1      THR  16   4.712  -1.103  12.107
  123   1HG2  THR  16          1HG2      THR  16   7.277  -0.088  12.115
  124   2HG2  THR  16          2HG2      THR  16   8.109  -1.042  10.886
  125   3HG2  THR  16          3HG2      THR  16   7.199  -1.849  12.162
  126    H    GLY  17           H        GLY  17   6.032   2.841  11.244
  127   1HA   GLY  17          2HA       GLY  17   7.843   4.331  11.225
  128   2HA   GLY  17          1HA       GLY  17   8.863   2.894  11.305
  129    H    GLU  18           H        GLU  18   9.316   1.785   9.210
  130    HA   GLU  18           HA       GLU  18   8.921   3.487   6.824
  131   1HB   GLU  18          2HB       GLU  18  11.117   4.073   8.062
  132   2HB   GLU  18          1HB       GLU  18  11.699   2.518   7.468
  133   1HG   GLU  18          2HG       GLU  18  10.606   3.586   5.191
  134   2HG   GLU  18          1HG       GLU  18  11.210   5.033   5.997
  135    H    LEU  19           H        LEU  19   8.876   0.460   8.135
  136    HA   LEU  19           HA       LEU  19   8.581  -1.647   7.146
  137   1HB   LEU  19          2HB       LEU  19   7.812   0.210   5.139
  138   2HB   LEU  19          1HB       LEU  19   8.826  -0.990   4.345
  139    HG   LEU  19           HG       LEU  19   6.655  -1.875   6.234
  140   1HD1  LEU  19          1HD1      LEU  19   5.661  -2.072   3.604
  141   2HD1  LEU  19          2HD1      LEU  19   6.265  -0.423   3.755
  142   3HD1  LEU  19          3HD1      LEU  19   5.059  -1.028   4.890
  143   1HD2  LEU  19          1HD2      LEU  19   6.705  -3.716   4.345
  144   2HD2  LEU  19          2HD2      LEU  19   7.975  -3.689   5.568
  145   3HD2  LEU  19          3HD2      LEU  19   8.276  -3.011   3.969
  146    H    SER  20           H        SER  20  11.299   0.376   6.411
  147    HA   SER  20           HA       SER  20  13.550  -0.327   6.312
  148   1HB   SER  20          2HB       SER  20  12.691  -2.658   7.085
  149   2HB   SER  20          1HB       SER  20  12.706  -3.066   5.369
  150    HG   SER  20           HG       SER  20  14.908  -2.437   5.339
  151    H    ARG  21           H        ARG  21  11.819   0.828   4.338
  152    HA   ARG  21           HA       ARG  21  13.520   0.637   2.011
  153   1HB   ARG  21          2HB       ARG  21  11.248  -1.167   2.185
  154   2HB   ARG  21          1HB       ARG  21  11.036  -0.051   0.840
  155   1HG   ARG  21          2HG       ARG  21  13.600  -0.657   0.402
  156   2HG   ARG  21          1HG       ARG  21  13.153  -2.122   1.273
  157   1HD   ARG  21          2HD       ARG  21  11.406  -2.622  -0.312
  158   2HD   ARG  21          1HD       ARG  21  11.595  -1.055  -1.095
  159    HE   ARG  21           HE       ARG  21  13.406  -1.952  -2.303
  160   1HH1  ARG  21          1HH2      ARG  21  12.043  -4.629  -1.322
  161   2HH1  ARG  21          2HH2      ARG  21  13.464  -5.523  -0.900
  162   1HH2  ARG  21          1HH1      ARG  21  15.548  -2.751  -0.968
  163   2HH2  ARG  21          2HH1      ARG  21  15.450  -4.459  -0.700
  164    HA   PRO  22           HA       PRO  22  11.641   4.548   1.149
  165   1HB   PRO  22          2HB       PRO  22  10.818   4.499  -1.470
  166   2HB   PRO  22          1HB       PRO  22  12.519   4.629  -0.980
  167   1HG   PRO  22          2HG       PRO  22  10.982   2.223  -1.853
  168   2HG   PRO  22          1HG       PRO  22  12.624   2.732  -2.290
  169   1HD   PRO  22          2HD       PRO  22  12.192   0.815  -0.437
  170   2HD   PRO  22          1HD       PRO  22  13.548   1.953  -0.291
  171    H    ARG  23           H        ARG  23   9.842   4.444   2.530
  172    HA   ARG  23           HA       ARG  23   7.320   3.251   1.613
  173   1HB   ARG  23          2HB       ARG  23   6.443   4.092   3.792
  174   2HB   ARG  23          1HB       ARG  23   7.878   3.086   3.978
  175   1HG   ARG  23          2HG       ARG  23   9.206   4.854   4.623
  176   2HG   ARG  23          1HG       ARG  23   8.313   6.020   3.650
  177   1HD   ARG  23          2HD       ARG  23   6.440   5.933   5.248
  178   2HD   ARG  23          1HD       ARG  23   7.319   4.754   6.221
  179    HE   ARG  23           HE       ARG  23   8.941   7.090   5.862
  180   1HH1  ARG  23          1HH2      ARG  23   5.755   6.804   6.941
  181   2HH1  ARG  23          2HH2      ARG  23   6.043   7.505   8.498
  182   1HH2  ARG  23          1HH1      ARG  23   9.486   7.622   8.103
  183   2HH2  ARG  23          2HH1      ARG  23   8.154   7.969   9.155
  184    H    GLU  24           H        GLU  24   8.877   6.273   1.240
  185    HA   GLU  24           HA       GLU  24   6.434   7.883   1.186
  186   1HB   GLU  24          2HB       GLU  24   8.697   8.812   1.775
  187   2HB   GLU  24          1HB       GLU  24   9.183   8.562   0.098
  188   1HG   GLU  24          2HG       GLU  24   7.564  10.125  -0.707
  189   2HG   GLU  24          1HG       GLU  24   6.738  10.177   0.851
  190    H    GLU  25           H        GLU  25   8.611   6.398  -1.200
  191    HA   GLU  25           HA       GLU  25   7.378   7.479  -3.536
  192   1HB   GLU  25          2HB       GLU  25   8.810   4.839  -3.111
  193   2HB   GLU  25          1HB       GLU  25   8.360   5.478  -4.692
  194   1HG   GLU  25          2HG       GLU  25   9.701   7.523  -4.221
  195   2HG   GLU  25          1HG       GLU  25  10.202   6.815  -2.684
  196    H    VAL  26           H        VAL  26   6.911   4.234  -2.085
  197    HA   VAL  26           HA       VAL  26   4.700   3.494  -3.698
  198    HB   VAL  26           HB       VAL  26   5.949   1.905  -2.266
  199   1HG1  VAL  26          1HG1      VAL  26   5.682   1.872   0.121
  200   2HG1  VAL  26          2HG1      VAL  26   4.435   3.117   0.061
  201   3HG1  VAL  26          3HG1      VAL  26   6.108   3.527  -0.315
  202   1HG2  VAL  26          1HG2      VAL  26   3.536   1.521  -3.026
  203   2HG2  VAL  26          2HG2      VAL  26   3.050   1.983  -1.395
  204   3HG2  VAL  26          3HG2      VAL  26   4.068   0.565  -1.643
  205    H    LYS  27           H        LYS  27   4.847   5.406  -0.721
  206    HA   LYS  27           HA       LYS  27   1.971   5.473  -0.339
  207   1HB   LYS  27          2HB       LYS  27   4.273   7.090   0.758
  208   2HB   LYS  27          1HB       LYS  27   2.600   7.506   1.130
  209   1HG   LYS  27          2HG       LYS  27   3.724   4.726   1.552
  210   2HG   LYS  27          1HG       LYS  27   3.741   5.964   2.808
  211   1HD   LYS  27          2HD       LYS  27   1.564   5.620   3.277
  212   2HD   LYS  27          1HD       LYS  27   1.119   5.782   1.581
  213   1HE   LYS  27          2HE       LYS  27   2.397   3.253   2.617
  214   2HE   LYS  27          1HE       LYS  27   0.656   3.506   2.727
  215   1HZ   LYS  27          1HZ       LYS  27   1.193   2.352   0.702
  216   2HZ   LYS  27          2HZ       LYS  27   2.289   3.569   0.247
  217   3HZ   LYS  27          3HZ       LYS  27   0.625   3.906   0.327
  218    H    ALA  28           H        ALA  28   4.299   7.425  -2.121
  219    HA   ALA  28           HA       ALA  28   2.583   9.674  -2.619
  220   1HB   ALA  28          1HB       ALA  28   4.147  10.267  -4.359
  221   2HB   ALA  28          2HB       ALA  28   4.750   8.613  -4.456
  222   3HB   ALA  28          3HB       ALA  28   5.083   9.591  -3.027
  223    H    LEU  29           H        LEU  29   2.879   6.493  -4.056
  224    HA   LEU  29           HA       LEU  29   1.116   7.182  -6.313
  225   1HB   LEU  29          2HB       LEU  29   2.921   4.994  -5.587
  226   2HB   LEU  29          1HB       LEU  29   1.387   4.412  -6.225
  227    HG   LEU  29           HG       LEU  29   1.657   5.915  -8.191
  228   1HD1  LEU  29          1HD1      LEU  29   3.988   6.879  -8.521
  229   2HD1  LEU  29          2HD1      LEU  29   4.286   6.535  -6.817
  230   3HD1  LEU  29          3HD1      LEU  29   3.021   7.673  -7.279
  231   1HD2  LEU  29          1HD2      LEU  29   2.496   3.543  -8.188
  232   2HD2  LEU  29          2HD2      LEU  29   4.089   4.156  -7.744
  233   3HD2  LEU  29          3HD2      LEU  29   3.374   4.598  -9.295
  234    H    LEU  30           H        LEU  30   0.976   5.574  -3.173
  235    HA   LEU  30           HA       LEU  30  -1.518   4.256  -3.432
  236   1HB   LEU  30          2HB       LEU  30   0.205   4.199  -1.493
  237   2HB   LEU  30          1HB       LEU  30  -0.617   5.637  -0.896
  238    HG   LEU  30           HG       LEU  30  -1.485   3.535   0.126
  239   1HD1  LEU  30          1HD1      LEU  30  -3.671   4.273   0.144
  240   2HD1  LEU  30          2HD1      LEU  30  -3.716   4.519  -1.601
  241   3HD1  LEU  30          3HD1      LEU  30  -2.898   5.689  -0.567
  242   1HD2  LEU  30          1HD2      LEU  30  -1.123   2.322  -2.182
  243   2HD2  LEU  30          2HD2      LEU  30  -2.771   2.864  -2.501
  244   3HD2  LEU  30          3HD2      LEU  30  -2.437   1.819  -1.122
  245    H    ARG  31           H        ARG  31  -0.836   7.539  -2.163
  246    HA   ARG  31           HA       ARG  31  -3.521   8.350  -1.791
  247   1HB   ARG  31          2HB       ARG  31  -2.636  10.690  -2.122
  248   2HB   ARG  31          1HB       ARG  31  -1.712   9.739  -0.960
  249   1HG   ARG  31          2HG       ARG  31  -0.056   9.203  -2.713
  250   2HG   ARG  31          1HG       ARG  31  -0.976  10.158  -3.875
  251   1HD   ARG  31          2HD       ARG  31  -0.719  12.109  -2.219
  252   2HD   ARG  31          1HD       ARG  31   0.510  11.121  -1.431
  253    HE   ARG  31           HE       ARG  31   1.960  11.703  -3.184
  254   1HH1  ARG  31          1HH2      ARG  31  -0.828  13.349  -3.823
  255   2HH1  ARG  31          2HH2      ARG  31  -0.682  13.336  -5.549
  256   1HH2  ARG  31          1HH1      ARG  31   1.943  11.073  -5.575
  257   2HH2  ARG  31          2HH1      ARG  31   0.884  12.046  -6.539
  258    H    ARG  32           H        ARG  32  -1.466   8.476  -4.650
  259    HA   ARG  32           HA       ARG  32  -3.287   9.814  -6.406
  260   1HB   ARG  32          2HB       ARG  32  -0.776   8.441  -6.644
  261   2HB   ARG  32          1HB       ARG  32  -1.860   7.826  -7.890
  262   1HG   ARG  32          2HG       ARG  32  -1.556  10.790  -7.394
  263   2HG   ARG  32          1HG       ARG  32  -0.462   9.919  -8.468
  264   1HD   ARG  32          2HD       ARG  32  -2.243   9.284  -9.929
  265   2HD   ARG  32          1HD       ARG  32  -3.470   9.777  -8.763
  266    HE   ARG  32           HE       ARG  32  -1.962  11.565 -10.546
  267   1HH1  ARG  32          1HH2      ARG  32  -4.916  11.748 -10.065
  268   2HH1  ARG  32          2HH2      ARG  32  -5.029  13.129  -9.026
  269   1HH2  ARG  32          1HH1      ARG  32  -1.663  13.103  -8.191
  270   2HH2  ARG  32          2HH1      ARG  32  -3.186  13.896  -7.964
  271    H    LEU  33           H        LEU  33  -3.028   6.498  -5.320
  272    HA   LEU  33           HA       LEU  33  -4.943   5.411  -7.202
  273   1HB   LEU  33          2HB       LEU  33  -3.070   4.315  -5.562
  274   2HB   LEU  33          1HB       LEU  33  -4.524   4.028  -4.613
  275    HG   LEU  33           HG       LEU  33  -5.515   2.697  -6.288
  276   1HD1  LEU  33          1HD1      LEU  33  -4.277   2.527  -8.593
  277   2HD1  LEU  33          2HD1      LEU  33  -3.573   4.079  -8.139
  278   3HD1  LEU  33          3HD1      LEU  33  -5.323   3.913  -8.292
  279   1HD2  LEU  33          1HD2      LEU  33  -3.802   1.025  -6.854
  280   2HD2  LEU  33          2HD2      LEU  33  -3.574   1.600  -5.203
  281   3HD2  LEU  33          3HD2      LEU  33  -2.530   2.189  -6.492
  282    H    GLY  34           H        GLY  34  -5.511   7.652  -4.933
  283   1HA   GLY  34          2HA       GLY  34  -7.604   8.409  -4.147
  284   2HA   GLY  34          1HA       GLY  34  -8.332   6.918  -4.734
  285    H    ALA  35           H        ALA  35  -6.460   5.165  -3.252
  286    HA   ALA  35           HA       ALA  35  -7.942   4.963  -0.810
  287   1HB   ALA  35          1HB       ALA  35  -5.771   3.486  -0.241
  288   2HB   ALA  35          2HB       ALA  35  -5.550   3.628  -1.985
  289   3HB   ALA  35          3HB       ALA  35  -7.030   2.921  -1.338
  290    H    LYS  36           H        LYS  36  -7.044   5.152   1.390
  291    HA   LYS  36           HA       LYS  36  -5.254   7.532   1.609
  292   1HB   LYS  36          2HB       LYS  36  -7.334   6.315   3.433
  293   2HB   LYS  36          1HB       LYS  36  -6.169   7.502   4.020
  294   1HG   LYS  36          2HG       LYS  36  -6.939   9.143   2.406
  295   2HG   LYS  36          1HG       LYS  36  -7.995   7.954   1.643
  296   1HD   LYS  36          2HD       LYS  36  -9.171   7.718   3.882
  297   2HD   LYS  36          1HD       LYS  36  -8.246   9.116   4.428
  298   1HE   LYS  36          2HE       LYS  36  -9.961   9.153   1.934
  299   2HE   LYS  36          1HE       LYS  36 -10.561   9.643   3.518
  300   1HZ   LYS  36          1HZ       LYS  36  -9.810  11.632   2.778
  301   2HZ   LYS  36          2HZ       LYS  36  -8.617  10.953   1.776
  302   3HZ   LYS  36          3HZ       LYS  36  -8.360  11.067   3.452
  303    H    VAL  37           H        VAL  37  -3.745   7.482   3.555
  304    HA   VAL  37           HA       VAL  37  -2.881   4.736   4.295
  305    HB   VAL  37           HB       VAL  37  -0.536   5.289   3.800
  306   1HG1  VAL  37          1HG1      VAL  37  -0.674   5.088   1.415
  307   2HG1  VAL  37          2HG1      VAL  37  -2.236   5.902   1.374
  308   3HG1  VAL  37          3HG1      VAL  37  -2.102   4.284   2.062
  309   1HG2  VAL  37          1HG2      VAL  37  -0.118   7.371   2.404
  310   2HG2  VAL  37          2HG2      VAL  37  -0.534   7.686   4.088
  311   3HG2  VAL  37          3HG2      VAL  37  -1.748   7.894   2.826
  312    H    THR  38           H        THR  38  -1.205   4.859   6.097
  313    HA   THR  38           HA       THR  38  -1.287   7.346   7.695
  314    HB   THR  38           HB       THR  38  -1.991   5.915   9.724
  315    HG1  THR  38           HG1      THR  38  -3.507   4.214   8.679
  316   1HG2  THR  38          1HG2      THR  38  -4.288   6.396   9.366
  317   2HG2  THR  38          2HG2      THR  38  -4.136   6.210   7.619
  318   3HG2  THR  38          3HG2      THR  38  -3.419   7.606   8.423
  319    H    ASP  39           H        ASP  39  -0.191   6.470  10.020
  320    HA   ASP  39           HA       ASP  39   2.007   4.603   9.512
  321   1HB   ASP  39          2HB       ASP  39   3.746   6.356  10.118
  322   2HB   ASP  39          1HB       ASP  39   3.018   6.556   8.525
  323    H    SER  40           H        SER  40  -0.275   5.003  11.373
  324    HA   SER  40           HA       SER  40   1.228   4.609  13.887
  325   1HB   SER  40          2HB       SER  40  -1.036   6.619  13.644
  326   2HB   SER  40          1HB       SER  40  -0.197   6.181  15.130
  327    HG   SER  40           HG       SER  40   0.736   7.605  12.884
  328    H    VAL  41           H        VAL  41  -0.482   3.888  15.640
  329    HA   VAL  41           HA       VAL  41  -2.788   2.518  14.349
  330    HB   VAL  41           HB       VAL  41  -2.226   0.444  15.688
  331   1HG1  VAL  41          1HG1      VAL  41  -0.741  -0.410  14.008
  332   2HG1  VAL  41          2HG1      VAL  41  -0.111   1.199  13.654
  333   3HG1  VAL  41          3HG1      VAL  41  -1.769   0.783  13.214
  334   1HG2  VAL  41          1HG2      VAL  41  -0.659   1.281  17.298
  335   2HG2  VAL  41          2HG2      VAL  41   0.349   2.005  16.045
  336   3HG2  VAL  41          3HG2      VAL  41   0.274   0.252  16.211
  337    H    SER  42           H        SER  42  -4.578   2.751  15.518
  338    HA   SER  42           HA       SER  42  -4.394   3.063  18.473
  339   1HB   SER  42          2HB       SER  42  -5.916   4.904  16.598
  340   2HB   SER  42          1HB       SER  42  -6.066   4.916  18.353
  341    HG   SER  42           HG       SER  42  -3.550   5.129  17.094
  342    H    ARG  43           H        ARG  43  -6.242   2.324  15.580
  343    HA   ARG  43           HA       ARG  43  -7.609   0.099  16.493
  344   1HB   ARG  43          2HB       ARG  43  -8.746   1.251  18.239
  345   2HB   ARG  43          1HB       ARG  43  -9.048   2.660  17.225
  346   1HG   ARG  43          2HG       ARG  43 -10.740   1.558  15.997
  347   2HG   ARG  43          1HG       ARG  43 -10.202  -0.038  16.519
  348   1HD   ARG  43          2HD       ARG  43 -12.230   0.548  17.736
  349   2HD   ARG  43          1HD       ARG  43 -10.868   0.549  18.856
  350    HE   ARG  43           HE       ARG  43 -11.070   3.186  17.936
  351   1HH1  ARG  43          1HH2      ARG  43 -11.558   2.011  20.778
  352   2HH1  ARG  43          2HH2      ARG  43 -13.119   2.682  21.116
  353   1HH2  ARG  43          1HH1      ARG  43 -13.740   3.578  17.825
  354   2HH2  ARG  43          2HH1      ARG  43 -14.353   3.571  19.445
  355    H    LYS  44           H        LYS  44  -8.822   3.130  15.052
  356    HA   LYS  44           HA       LYS  44 -10.254   1.935  12.922
  357   1HB   LYS  44          2HB       LYS  44  -8.982   4.660  13.227
  358   2HB   LYS  44          1HB       LYS  44  -9.899   4.216  11.788
  359   1HG   LYS  44          2HG       LYS  44 -11.592   5.130  13.083
  360   2HG   LYS  44          1HG       LYS  44 -11.704   3.441  13.574
  361   1HD   LYS  44          2HD       LYS  44 -10.494   3.844  15.594
  362   2HD   LYS  44          1HD       LYS  44  -9.971   5.437  15.047
  363   1HE   LYS  44          2HE       LYS  44 -11.766   5.790  16.609
  364   2HE   LYS  44          1HE       LYS  44 -12.415   6.113  15.002
  365   1HZ   LYS  44          1HZ       LYS  44 -13.665   4.233  15.023
  366   2HZ   LYS  44          2HZ       LYS  44 -13.643   4.543  16.693
  367   3HZ   LYS  44          3HZ       LYS  44 -12.598   3.381  16.028
  368    H    THR  45           H        THR  45  -6.836   2.313  13.320
  369    HA   THR  45           HA       THR  45  -6.234   2.124  10.455
  370    HB   THR  45           HB       THR  45  -4.342   1.713  12.786
  371    HG1  THR  45           HG1      THR  45  -4.138   3.841  12.888
  372   1HG2  THR  45          1HG2      THR  45  -2.729   2.647  11.031
  373   2HG2  THR  45          2HG2      THR  45  -4.012   2.376   9.853
  374   3HG2  THR  45          3HG2      THR  45  -3.326   1.014  10.741
  375    H    SER  46           H        SER  46  -4.237   0.091  12.274
  376    HA   SER  46           HA       SER  46  -3.892  -2.212  12.277
  377   1HB   SER  46          2HB       SER  46  -5.683  -3.551  12.830
  378   2HB   SER  46          1HB       SER  46  -6.252  -1.976  13.338
  379    HG   SER  46           HG       SER  46  -7.151  -1.911  11.088
  380    H    TYR  47           H        TYR  47  -3.801  -0.754   9.808
  381    HA   TYR  47           HA       TYR  47  -4.125  -3.036   7.920
  382   1HB   TYR  47          2HB       TYR  47  -4.861  -0.153   7.290
  383   2HB   TYR  47          1HB       TYR  47  -4.902  -1.501   6.155
  384    HD1  TYR  47           HD1      TYR  47  -6.161  -3.681   7.431
  385    HD2  TYR  47           HD2      TYR  47  -6.993   0.502   7.939
  386    HE1  TYR  47           HE1      TYR  47  -8.466  -4.227   8.157
  387    HE2  TYR  47           HE2      TYR  47  -9.298  -0.045   8.667
  388    HH   TYR  47           HH       TYR  47 -10.357  -3.419   9.026
  389    H    LEU  48           H        LEU  48  -2.066  -3.445   7.202
  390    HA   LEU  48           HA       LEU  48  -0.266  -1.096   6.743
  391   1HB   LEU  48          2HB       LEU  48   0.548  -2.146   8.743
  392   2HB   LEU  48          1HB       LEU  48   0.379  -3.753   8.045
  393    HG   LEU  48           HG       LEU  48   2.099  -1.963   6.462
  394   1HD1  LEU  48          1HD1      LEU  48   2.639  -1.181   8.764
  395   2HD1  LEU  48          2HD1      LEU  48   3.991  -2.017   8.002
  396   3HD1  LEU  48          3HD1      LEU  48   3.013  -2.844   9.213
  397   1HD2  LEU  48          1HD2      LEU  48   2.647  -4.667   7.716
  398   2HD2  LEU  48          2HD2      LEU  48   3.457  -3.951   6.323
  399   3HD2  LEU  48          3HD2      LEU  48   1.775  -4.465   6.197
  400    H    VAL  49           H        VAL  49   1.171  -1.270   4.998
  401    HA   VAL  49           HA       VAL  49   0.349  -3.216   2.914
  402    HB   VAL  49           HB       VAL  49   2.297  -1.728   1.726
  403   1HG1  VAL  49          1HG1      VAL  49   0.386  -0.231   0.965
  404   2HG1  VAL  49          2HG1      VAL  49  -0.635  -1.101   2.108
  405   3HG1  VAL  49          3HG1      VAL  49   0.117  -1.963   0.769
  406   1HG2  VAL  49          1HG2      VAL  49   2.637  -0.425   3.841
  407   2HG2  VAL  49          2HG2      VAL  49   0.969   0.133   3.724
  408   3HG2  VAL  49          3HG2      VAL  49   2.137   0.582   2.483
  409    H    VAL  50           H        VAL  50   1.406  -5.154   3.016
  410    HA   VAL  50           HA       VAL  50   4.073  -5.351   4.223
  411    HB   VAL  50           HB       VAL  50   2.423  -7.460   2.785
  412   1HG1  VAL  50          1HG1      VAL  50   4.818  -8.027   3.063
  413   2HG1  VAL  50          2HG1      VAL  50   3.798  -9.041   4.085
  414   3HG1  VAL  50          3HG1      VAL  50   4.691  -7.696   4.791
  415   1HG2  VAL  50          1HG2      VAL  50   1.719  -8.127   5.077
  416   2HG2  VAL  50          2HG2      VAL  50   1.172  -6.501   4.671
  417   3HG2  VAL  50          3HG2      VAL  50   2.564  -6.724   5.730
  418    H    GLY  51           H        GLY  51   5.521  -4.237   2.798
  419   1HA   GLY  51          2HA       GLY  51   5.581  -5.182  -0.026
  420   2HA   GLY  51          1HA       GLY  51   6.345  -3.713   0.576
  421    H    GLU  52           H        GLU  52   8.086  -4.211   2.367
  422    HA   GLU  52           HA       GLU  52  10.122  -5.825   1.134
  423   1HB   GLU  52          2HB       GLU  52   9.844  -4.181   3.564
  424   2HB   GLU  52          1HB       GLU  52  10.974  -5.521   3.734
  425   1HG   GLU  52          2HG       GLU  52  11.190  -4.012   1.197
  426   2HG   GLU  52          1HG       GLU  52  11.637  -3.113   2.646
  427    H    ASN  53           H        ASN  53  11.335  -7.348   2.975
  428    HA   ASN  53           HA       ASN  53   9.295  -9.427   3.669
  429   1HB   ASN  53          2HB       ASN  53  11.869  -9.599   2.296
  430   2HB   ASN  53          1HB       ASN  53  11.786 -10.691   3.681
  431   1HD2  ASN  53          1HD2      ASN  53  10.685 -12.636   3.339
  432   2HD2  ASN  53          2HD2      ASN  53   9.638 -12.937   2.037
  433    HA   PRO  54           HA       PRO  54  12.065  -9.197   7.497
  434   1HB   PRO  54          2HB       PRO  54  14.534  -8.039   7.389
  435   2HB   PRO  54          1HB       PRO  54  14.246  -9.719   6.904
  436   1HG   PRO  54          2HG       PRO  54  14.785  -7.355   5.247
  437   2HG   PRO  54          1HG       PRO  54  15.052  -9.068   4.898
  438   1HD   PRO  54          2HD       PRO  54  12.899  -7.435   3.968
  439   2HD   PRO  54          1HD       PRO  54  13.108  -9.182   3.739
  440    H    GLY  55           H        GLY  55  10.893  -6.798   5.847
  441   1HA   GLY  55          2HA       GLY  55  11.807  -4.336   6.768
  442   2HA   GLY  55          1HA       GLY  55  10.127  -4.660   6.361
  443    H    SER  56           H        SER  56  10.986  -2.902   8.444
  444    HA   SER  56           HA       SER  56  10.879  -4.112  11.042
  445   1HB   SER  56          2HB       SER  56  10.048  -1.339  10.126
  446   2HB   SER  56          1HB       SER  56  10.204  -1.827  11.811
  447    HG   SER  56           HG       SER  56  12.080  -0.801  10.580
  448    H    LYS  57           H        LYS  57   8.556  -3.715   8.601
  449    HA   LYS  57           HA       LYS  57   6.132  -3.402  10.037
  450   1HB   LYS  57          2HB       LYS  57   5.058  -4.427   8.089
  451   2HB   LYS  57          1HB       LYS  57   6.316  -3.314   7.560
  452   1HG   LYS  57          2HG       LYS  57   7.821  -5.082   7.048
  453   2HG   LYS  57          1HG       LYS  57   6.865  -6.261   7.942
  454   1HD   LYS  57          2HD       LYS  57   5.223  -6.392   6.290
  455   2HD   LYS  57          1HD       LYS  57   5.631  -4.815   5.618
  456   1HE   LYS  57          2HE       LYS  57   6.482  -6.412   4.062
  457   2HE   LYS  57          1HE       LYS  57   7.884  -5.833   4.960
  458   1HZ   LYS  57          1HZ       LYS  57   7.466  -8.373   4.636
  459   2HZ   LYS  57          2HZ       LYS  57   6.432  -8.172   5.970
  460   3HZ   LYS  57          3HZ       LYS  57   8.081  -7.781   6.103
  461    H    LEU  58           H        LEU  58   8.334  -6.056   9.933
  462    HA   LEU  58           HA       LEU  58   6.807  -8.335  10.268
  463   1HB   LEU  58          2HB       LEU  58   9.388  -7.968  10.495
  464   2HB   LEU  58          1HB       LEU  58   9.039  -7.792  12.215
  465    HG   LEU  58           HG       LEU  58   7.653 -10.024  11.827
  466   1HD1  LEU  58          1HD1      LEU  58   9.778 -10.137   9.662
  467   2HD1  LEU  58          2HD1      LEU  58   8.039 -10.057   9.383
  468   3HD1  LEU  58          3HD1      LEU  58   8.744 -11.475  10.159
  469   1HD2  LEU  58          1HD2      LEU  58   9.572  -9.786  13.354
  470   2HD2  LEU  58          2HD2      LEU  58  10.685  -9.929  11.992
  471   3HD2  LEU  58          3HD2      LEU  58   9.683 -11.302  12.461
  472    H    GLU  59           H        GLU  59   6.942  -5.599  12.407
  473    HA   GLU  59           HA       GLU  59   5.849  -6.953  14.731
  474   1HB   GLU  59          2HB       GLU  59   7.117  -4.777  14.812
  475   2HB   GLU  59          1HB       GLU  59   5.725  -3.998  14.060
  476   1HG   GLU  59          2HG       GLU  59   4.324  -4.452  15.925
  477   2HG   GLU  59          1HG       GLU  59   5.454  -5.633  16.587
  478    H    LYS  60           H        LYS  60   4.376  -4.564  12.462
  479    HA   LYS  60           HA       LYS  60   1.694  -5.425  13.318
  480   1HB   LYS  60          2HB       LYS  60   2.408  -3.020  12.710
  481   2HB   LYS  60          1HB       LYS  60   2.310  -3.554  11.033
  482   1HG   LYS  60          2HG       LYS  60  -0.027  -4.107  11.259
  483   2HG   LYS  60          1HG       LYS  60   0.030  -3.876  13.008
  484   1HD   LYS  60          2HD       LYS  60   0.355  -1.517  12.778
  485   2HD   LYS  60          1HD       LYS  60   0.662  -1.661  11.047
  486   1HE   LYS  60          2HE       LYS  60  -1.954  -2.536  12.266
  487   2HE   LYS  60          1HE       LYS  60  -1.686  -0.872  11.747
  488   1HZ   LYS  60          1HZ       LYS  60  -0.843  -2.782   9.795
  489   2HZ   LYS  60          2HZ       LYS  60  -1.874  -1.444   9.626
  490   3HZ   LYS  60          3HZ       LYS  60  -2.492  -2.933  10.161
  491    H    ALA  61           H        ALA  61   3.902  -6.040  10.692
  492    HA   ALA  61           HA       ALA  61   1.946  -7.040   8.814
  493   1HB   ALA  61          1HB       ALA  61   3.805  -7.783   7.519
  494   2HB   ALA  61          2HB       ALA  61   4.865  -7.804   8.928
  495   3HB   ALA  61          3HB       ALA  61   4.303  -6.269   8.270
  496    H    ARG  62           H        ARG  62   3.805  -8.514  11.458
  497    HA   ARG  62           HA       ARG  62   2.948 -11.219  10.680
  498   1HB   ARG  62          2HB       ARG  62   5.144 -10.593  11.917
  499   2HB   ARG  62          1HB       ARG  62   4.129 -10.439  13.352
  500   1HG   ARG  62          2HG       ARG  62   3.288 -12.768  12.933
  501   2HG   ARG  62          1HG       ARG  62   4.457 -12.906  11.618
  502   1HD   ARG  62          2HD       ARG  62   5.788 -13.752  13.277
  503   2HD   ARG  62          1HD       ARG  62   6.096 -12.045  13.594
  504    HE   ARG  62           HE       ARG  62   4.021 -12.350  15.212
  505   1HH1  ARG  62          1HH2      ARG  62   7.070 -13.317  15.656
  506   2HH1  ARG  62          2HH2      ARG  62   6.741 -14.691  16.658
  507   1HH2  ARG  62          1HH1      ARG  62   3.339 -14.691  16.001
  508   2HH2  ARG  62          2HH1      ARG  62   4.631 -15.469  16.852
  509    H    ALA  63           H        ALA  63   2.254  -8.795  13.152
  510    HA   ALA  63           HA       ALA  63   0.543  -8.619  14.740
  511   1HB   ALA  63          1HB       ALA  63  -0.920  -9.428  12.225
  512   2HB   ALA  63          2HB       ALA  63  -0.508  -7.791  12.735
  513   3HB   ALA  63          3HB       ALA  63  -1.688  -8.728  13.649
  514    H    LEU  64           H        LEU  64   0.172  -9.926  16.419
  515    HA   LEU  64           HA       LEU  64  -0.417 -12.795  16.000
  516   1HB   LEU  64          2HB       LEU  64  -0.549 -11.550  18.719
  517   2HB   LEU  64          1HB       LEU  64   0.118 -13.107  18.232
  518    HG   LEU  64           HG       LEU  64   1.385 -10.423  17.617
  519   1HD1  LEU  64          1HD1      LEU  64   2.149 -12.526  19.666
  520   2HD1  LEU  64          2HD1      LEU  64   1.418 -10.964  20.035
  521   3HD1  LEU  64          3HD1      LEU  64   3.034 -11.037  19.333
  522   1HD2  LEU  64          1HD2      LEU  64   2.151 -13.300  17.100
  523   2HD2  LEU  64          2HD2      LEU  64   3.376 -12.035  17.189
  524   3HD2  LEU  64          3HD2      LEU  64   2.113 -11.954  15.961
  525    H    GLY  65           H        GLY  65  -2.317 -10.729  15.095
  526   1HA   GLY  65          2HA       GLY  65  -4.768 -11.817  15.648
  527   2HA   GLY  65          1HA       GLY  65  -4.529 -10.680  16.981
  528    H    VAL  66           H        VAL  66  -2.972  -8.804  15.491
  529    HA   VAL  66           HA       VAL  66  -5.051  -7.180  14.389
  530    HB   VAL  66           HB       VAL  66  -2.118  -6.768  13.811
  531   1HG1  VAL  66          1HG1      VAL  66  -3.448  -5.085  12.810
  532   2HG1  VAL  66          2HG1      VAL  66  -2.887  -4.362  14.318
  533   3HG1  VAL  66          3HG1      VAL  66  -4.529  -4.995  14.202
  534   1HG2  VAL  66          1HG2      VAL  66  -2.085  -7.289  16.136
  535   2HG2  VAL  66          2HG2      VAL  66  -3.600  -6.432  16.426
  536   3HG2  VAL  66          3HG2      VAL  66  -2.131  -5.527  16.061
  537    HA   PRO  67           HA       PRO  67  -4.888  -8.723  10.206
  538   1HB   PRO  67          2HB       PRO  67  -6.497  -6.861   9.028
  539   2HB   PRO  67          1HB       PRO  67  -7.110  -8.139  10.092
  540   1HG   PRO  67          2HG       PRO  67  -6.841  -5.265  10.588
  541   2HG   PRO  67          1HG       PRO  67  -7.876  -6.458  11.382
  542   1HD   PRO  67          2HD       PRO  67  -5.398  -5.377  12.345
  543   2HD   PRO  67          1HD       PRO  67  -6.417  -6.606  13.118
  544    H    THR  68           H        THR  68  -3.387  -8.476   8.612
  545    HA   THR  68           HA       THR  68  -2.177  -5.770   8.171
  546    HB   THR  68           HB       THR  68  -0.160  -6.855   7.581
  547    HG1  THR  68           HG1      THR  68  -1.794  -9.145   7.281
  548   1HG2  THR  68          1HG2      THR  68  -1.130  -8.877   9.568
  549   2HG2  THR  68          2HG2      THR  68  -1.101  -7.176  10.033
  550   3HG2  THR  68          3HG2      THR  68   0.382  -7.979   9.533
  551    H    LEU  69           H        LEU  69  -2.094  -4.976   5.994
  552    HA   LEU  69           HA       LEU  69  -3.856  -6.447   4.108
  553   1HB   LEU  69          2HB       LEU  69  -3.465  -3.682   4.778
  554   2HB   LEU  69          1HB       LEU  69  -3.061  -3.907   3.079
  555    HG   LEU  69           HG       LEU  69  -5.458  -3.392   3.358
  556   1HD1  LEU  69          1HD1      LEU  69  -6.252  -5.023   1.871
  557   2HD1  LEU  69          2HD1      LEU  69  -5.312  -6.310   2.626
  558   3HD1  LEU  69          3HD1      LEU  69  -4.507  -5.099   1.627
  559   1HD2  LEU  69          1HD2      LEU  69  -6.908  -4.653   4.696
  560   2HD2  LEU  69          2HD2      LEU  69  -5.445  -4.619   5.678
  561   3HD2  LEU  69          3HD2      LEU  69  -5.831  -6.049   4.723
  562    H    THR  70           H        THR  70  -2.863  -7.657   2.585
  563    HA   THR  70           HA       THR  70  -0.072  -7.728   2.101
  564    HB   THR  70           HB       THR  70  -2.133  -8.398  -0.001
  565    HG1  THR  70           HG1      THR  70  -2.960  -9.333   1.793
  566   1HG2  THR  70          1HG2      THR  70   0.344  -8.634  -0.443
  567   2HG2  THR  70          2HG2      THR  70  -0.568 -10.135  -0.597
  568   3HG2  THR  70          3HG2      THR  70   0.397  -9.834   0.848
  569    H    GLU  71           H        GLU  71   1.240  -6.343   0.961
  570    HA   GLU  71           HA       GLU  71   0.143  -3.976  -0.295
  571   1HB   GLU  71          2HB       GLU  71   2.502  -4.328   0.767
  572   2HB   GLU  71          1HB       GLU  71   2.935  -4.995  -0.807
  573   1HG   GLU  71          2HG       GLU  71   1.466  -2.410  -0.846
  574   2HG   GLU  71          1HG       GLU  71   3.114  -2.351  -0.225
  575    H    GLU  72           H        GLU  72   0.842  -7.194  -1.350
  576    HA   GLU  72           HA       GLU  72   1.314  -6.847  -4.112
  577   1HB   GLU  72          2HB       GLU  72  -0.316  -8.996  -2.713
  578   2HB   GLU  72          1HB       GLU  72   0.242  -9.091  -4.383
  579   1HG   GLU  72          2HG       GLU  72   2.134  -8.655  -2.060
  580   2HG   GLU  72          1HG       GLU  72   1.715 -10.262  -2.655
  581    H    GLU  73           H        GLU  73  -1.845  -7.262  -2.466
  582    HA   GLU  73           HA       GLU  73  -3.534  -6.898  -4.679
  583   1HB   GLU  73          2HB       GLU  73  -4.210  -7.434  -2.282
  584   2HB   GLU  73          1HB       GLU  73  -4.055  -5.711  -1.940
  585   1HG   GLU  73          2HG       GLU  73  -5.641  -5.366  -3.958
  586   2HG   GLU  73          1HG       GLU  73  -6.000  -7.085  -3.797
  587    H    LEU  74           H        LEU  74  -1.966  -4.448  -2.633
  588    HA   LEU  74           HA       LEU  74  -3.145  -2.166  -3.913
  589   1HB   LEU  74          2HB       LEU  74  -2.146  -1.645  -1.862
  590   2HB   LEU  74          1HB       LEU  74  -0.725  -2.630  -2.191
  591    HG   LEU  74           HG       LEU  74  -0.012  -0.985  -3.923
  592   1HD1  LEU  74          1HD1      LEU  74  -2.155  -0.056  -4.568
  593   2HD1  LEU  74          2HD1      LEU  74  -1.181   1.247  -3.899
  594   3HD1  LEU  74          3HD1      LEU  74  -2.455   0.510  -2.928
  595   1HD2  LEU  74          1HD2      LEU  74   0.510   0.877  -2.304
  596   2HD2  LEU  74          2HD2      LEU  74   0.908  -0.729  -1.701
  597   3HD2  LEU  74          3HD2      LEU  74  -0.550   0.086  -1.137
  598    H    TYR  75           H        TYR  75  -0.223  -4.071  -4.549
  599    HA   TYR  75           HA       TYR  75   0.772  -2.345  -6.637
  600   1HB   TYR  75          2HB       TYR  75   1.900  -4.345  -5.269
  601   2HB   TYR  75          1HB       TYR  75   1.368  -5.273  -6.671
  602    HD1  TYR  75           HD1      TYR  75   3.404  -2.359  -5.583
  603    HD2  TYR  75           HD2      TYR  75   2.423  -5.021  -8.811
  604    HE1  TYR  75           HE1      TYR  75   5.309  -1.469  -6.897
  605    HE2  TYR  75           HE2      TYR  75   4.329  -4.130 -10.122
  606    HH   TYR  75           HH       TYR  75   5.654  -1.621  -9.961
  607    H    ARG  76           H        ARG  76  -1.538  -5.017  -6.543
  608    HA   ARG  76           HA       ARG  76  -1.605  -5.461  -9.389
  609   1HB   ARG  76          2HB       ARG  76  -2.439  -7.108  -7.720
  610   2HB   ARG  76          1HB       ARG  76  -3.749  -6.002  -7.309
  611   1HG   ARG  76          2HG       ARG  76  -4.476  -6.065  -9.714
  612   2HG   ARG  76          1HG       ARG  76  -3.254  -7.304 -10.002
  613   1HD   ARG  76          2HD       ARG  76  -4.318  -8.737  -8.282
  614   2HD   ARG  76          1HD       ARG  76  -5.557  -7.506  -8.038
  615    HE   ARG  76           HE       ARG  76  -6.510  -8.092 -10.153
  616   1HH1  ARG  76          1HH1      ARG  76  -5.909 -10.877  -9.279
  617   2HH1  ARG  76          2HH1      ARG  76  -5.052 -11.516 -10.642
  618   1HH2  ARG  76          1HH2      ARG  76  -4.380  -8.405 -12.016
  619   2HH2  ARG  76          2HH2      ARG  76  -4.184 -10.117 -12.188
  620    H    LEU  77           H        LEU  77  -4.368  -4.238  -7.481
  621    HA   LEU  77           HA       LEU  77  -5.714  -3.003  -9.555
  622   1HB   LEU  77          2HB       LEU  77  -5.536  -2.143  -6.657
  623   2HB   LEU  77          1HB       LEU  77  -6.697  -1.477  -7.805
  624    HG   LEU  77           HG       LEU  77  -6.493  -4.455  -7.608
  625   1HD1  LEU  77          1HD1      LEU  77  -6.560  -3.606  -5.242
  626   2HD1  LEU  77          2HD1      LEU  77  -7.972  -4.557  -5.699
  627   3HD1  LEU  77          3HD1      LEU  77  -8.079  -2.800  -5.630
  628   1HD2  LEU  77          1HD2      LEU  77  -8.016  -2.874  -9.121
  629   2HD2  LEU  77          2HD2      LEU  77  -9.030  -2.866  -7.680
  630   3HD2  LEU  77          3HD2      LEU  77  -8.641  -4.390  -8.474
  631    H    LEU  78           H        LEU  78  -2.792  -1.842  -8.014
  632    HA   LEU  78           HA       LEU  78  -2.959   0.906  -8.831
  633   1HB   LEU  78          2HB       LEU  78  -1.235   0.166  -7.261
  634   2HB   LEU  78          1HB       LEU  78  -0.544  -0.899  -8.482
  635    HG   LEU  78           HG       LEU  78  -0.260   1.242  -9.910
  636   1HD1  LEU  78          1HD1      LEU  78  -1.721   2.643  -8.434
  637   2HD1  LEU  78          2HD1      LEU  78  -0.113   3.330  -8.662
  638   3HD1  LEU  78          3HD1      LEU  78  -0.511   2.497  -7.158
  639   1HD2  LEU  78          1HD2      LEU  78   1.364   1.033  -7.357
  640   2HD2  LEU  78          2HD2      LEU  78   1.901   1.675  -8.909
  641   3HD2  LEU  78          3HD2      LEU  78   1.565  -0.047  -8.736
  642    H    GLU  79           H        GLU  79  -1.027  -1.699 -10.332
  643    HA   GLU  79           HA       GLU  79  -0.677  -0.364 -12.835
  644   1HB   GLU  79          2HB       GLU  79  -0.785  -3.369 -12.436
  645   2HB   GLU  79          1HB       GLU  79   0.087  -2.488 -13.689
  646   1HG   GLU  79          2HG       GLU  79   0.667  -2.184 -10.728
  647   2HG   GLU  79          1HG       GLU  79   1.535  -3.300 -11.779
  648    H    ALA  80           H        ALA  80  -2.988  -2.919 -11.886
  649    HA   ALA  80           HA       ALA  80  -4.457  -3.101 -14.274
  650   1HB   ALA  80          1HB       ALA  80  -6.414  -3.639 -12.609
  651   2HB   ALA  80          2HB       ALA  80  -5.152  -3.529 -11.383
  652   3HB   ALA  80          3HB       ALA  80  -5.018  -4.713 -12.681
  653    H    ARG  81           H        ARG  81  -4.196  -0.392 -12.220
  654    HA   ARG  81           HA       ARG  81  -6.693   0.779 -13.389
  655   1HB   ARG  81          2HB       ARG  81  -6.584   0.600 -10.850
  656   2HB   ARG  81          1HB       ARG  81  -5.254   1.758 -10.909
  657   1HG   ARG  81          2HG       ARG  81  -7.137   2.983 -12.498
  658   2HG   ARG  81          1HG       ARG  81  -8.145   2.195 -11.286
  659   1HD   ARG  81          2HD       ARG  81  -6.949   3.279  -9.488
  660   2HD   ARG  81          1HD       ARG  81  -5.752   3.926 -10.611
  661    HE   ARG  81           HE       ARG  81  -7.406   5.500 -11.407
  662   1HH1  ARG  81          1HH1      ARG  81  -9.673   3.431 -10.747
  663   2HH1  ARG  81          2HH1      ARG  81 -10.552   4.339  -9.563
  664   1HH2  ARG  81          1HH2      ARG  81  -8.025   6.670  -9.092
  665   2HH2  ARG  81          2HH2      ARG  81  -9.618   6.177  -8.628
  666    H    THR  82           H        THR  82  -3.269   1.267 -12.647
  667    HA   THR  82           HA       THR  82  -3.099   3.923 -13.788
  668    HB   THR  82           HB       THR  82  -0.975   1.801 -13.333
  669    HG1  THR  82           HG1      THR  82  -0.675   2.807 -11.435
  670   1HG2  THR  82          1HG2      THR  82  -0.760   4.736 -14.055
  671   2HG2  THR  82          2HG2      THR  82  -0.171   3.364 -14.994
  672   3HG2  THR  82          3HG2      THR  82   0.589   3.770 -13.456
  673    H    GLY  83           H        GLY  83  -2.318   0.669 -15.012
  674   1HA   GLY  83          2HA       GLY  83  -2.558  -0.109 -17.252
  675   2HA   GLY  83          1HA       GLY  83  -2.945   1.538 -17.756
  676    H    LYS  84           H        LYS  84  -0.187   1.252 -15.745
  677    HA   LYS  84           HA       LYS  84   1.715   0.950 -17.979
  678   1HB   LYS  84          2HB       LYS  84   1.084   3.367 -18.001
  679   2HB   LYS  84          1HB       LYS  84   1.610   3.493 -16.322
  680   1HG   LYS  84          2HG       LYS  84   3.887   2.936 -16.923
  681   2HG   LYS  84          1HG       LYS  84   3.408   2.568 -18.581
  682   1HD   LYS  84          2HD       LYS  84   3.031   4.827 -19.106
  683   2HD   LYS  84          1HD       LYS  84   2.878   5.292 -17.411
  684   1HE   LYS  84          2HE       LYS  84   5.034   6.060 -18.233
  685   2HE   LYS  84          1HE       LYS  84   5.302   4.740 -17.095
  686   1HZ   LYS  84          1HZ       LYS  84   4.935   3.893 -19.826
  687   2HZ   LYS  84          2HZ       LYS  84   6.110   3.426 -18.691
  688   3HZ   LYS  84          3HZ       LYS  84   6.312   4.855 -19.588
  689    H    LYS  85           H        LYS  85   3.999   0.961 -17.107
  690    HA   LYS  85           HA       LYS  85   4.224  -0.706 -14.792
  691   1HB   LYS  85          2HB       LYS  85   6.432   1.026 -15.933
  692   2HB   LYS  85          1HB       LYS  85   6.600  -0.501 -15.069
  693   1HG   LYS  85          2HG       LYS  85   6.636  -1.492 -17.101
  694   2HG   LYS  85          1HG       LYS  85   4.910  -1.144 -17.185
  695   1HD   LYS  85          2HD       LYS  85   5.649  -0.123 -19.141
  696   2HD   LYS  85          1HD       LYS  85   5.743   1.228 -18.011
  697   1HE   LYS  85          2HE       LYS  85   7.858   1.331 -18.967
  698   2HE   LYS  85          1HE       LYS  85   8.183   0.285 -17.584
  699   1HZ   LYS  85          1HZ       LYS  85   8.154  -1.608 -18.916
  700   2HZ   LYS  85          2HZ       LYS  85   9.001  -0.472 -19.854
  701   3HZ   LYS  85          3HZ       LYS  85   7.375  -0.823 -20.201
  702    H    ALA  86           H        ALA  86   4.676  -0.189 -12.640
  703    HA   ALA  86           HA       ALA  86   4.100   2.542 -11.788
  704   1HB   ALA  86          1HB       ALA  86   3.325   0.777 -10.354
  705   2HB   ALA  86          2HB       ALA  86   4.643   1.574  -9.494
  706   3HB   ALA  86          3HB       ALA  86   4.923   0.032 -10.304
  707    H    GLU  87           H        GLU  87   6.926   0.648 -12.477
  708    HA   GLU  87           HA       GLU  87   8.759   2.434 -11.029
  709   1HB   GLU  87          2HB       GLU  87   9.298   0.197 -13.011
  710   2HB   GLU  87          1HB       GLU  87  10.528   1.039 -12.068
  711   1HG   GLU  87          2HG       GLU  87   9.444   0.285  -9.979
  712   2HG   GLU  87          1HG       GLU  87   8.220  -0.565 -10.922
  713    H    GLU  88           H        GLU  88   7.446   2.046 -14.241
  714    HA   GLU  88           HA       GLU  88   7.549   3.435 -16.118
  715   1HB   GLU  88          2HB       GLU  88   9.135   5.401 -14.452
  716   2HB   GLU  88          1HB       GLU  88   8.104   5.733 -15.841
  717   1HG   GLU  88          2HG       GLU  88   6.197   4.716 -14.387
  718   2HG   GLU  88          1HG       GLU  88   7.293   4.997 -13.034
  719    H    LEU  89           H        LEU  89   9.689   1.483 -15.404
  720    HA   LEU  89           HA       LEU  89  11.566   2.254 -17.494
  721   1HB   LEU  89          2HB       LEU  89  13.582   1.921 -15.915
  722   2HB   LEU  89          1HB       LEU  89  12.733   3.459 -15.826
  723    HG   LEU  89           HG       LEU  89  11.364   1.800 -14.019
  724   1HD1  LEU  89          1HD1      LEU  89  14.299   1.204 -14.113
  725   2HD1  LEU  89          2HD1      LEU  89  12.951   0.140 -13.713
  726   3HD1  LEU  89          3HD1      LEU  89  13.519   1.321 -12.535
  727   1HD2  LEU  89          1HD2      LEU  89  12.216   3.355 -12.366
  728   2HD2  LEU  89          2HD2      LEU  89  11.949   4.251 -13.861
  729   3HD2  LEU  89          3HD2      LEU  89  13.583   3.774 -13.400
  730    H    VAL  90           H        VAL  90  13.356   0.271 -15.616
  731    HA   VAL  90           HA       VAL  90  13.776  -2.023 -15.597
  732    HB   VAL  90           HB       VAL  90  10.812  -2.357 -16.158
  733   1HG1  VAL  90          1HG1      VAL  90  12.139  -4.404 -16.375
  734   2HG1  VAL  90          2HG1      VAL  90  11.168  -4.476 -14.905
  735   3HG1  VAL  90          3HG1      VAL  90  12.889  -4.107 -14.806
  736   1HG2  VAL  90          1HG2      VAL  90  11.009  -0.898 -14.239
  737   2HG2  VAL  90          2HG2      VAL  90  12.298  -1.890 -13.555
  738   3HG2  VAL  90          3HG2      VAL  90  10.652  -2.518 -13.639
  739    H    GLY  91           H        GLY  91  11.097  -2.196 -17.919
  740   1HA   GLY  91          2HA       GLY  91  12.282  -1.902 -20.367
  741   2HA   GLY  91          1HA       GLY  91  12.865  -3.491 -19.869
  742    H    SER  92           H        SER  92  11.592  -5.180 -20.421
  743    HA   SER  92           HA       SER  92   8.653  -4.856 -20.491
  744   1HB   SER  92          2HB       SER  92   9.549  -4.277 -22.789
  745   2HB   SER  92          1HB       SER  92  10.168  -5.924 -22.891
  746    HG   SER  92           HG       SER  92   7.535  -5.687 -22.094
  Start of MODEL    2
    1    HA   MET   1           HA       MET   1 -20.553  -6.129 -10.880
    2   1HB   MET   1          2HB       MET   1 -20.918  -6.227 -13.408
    3   2HB   MET   1          1HB       MET   1 -22.242  -6.839 -12.416
    4   1HG   MET   1          2HG       MET   1 -22.354  -3.941 -13.045
    5   2HG   MET   1          1HG       MET   1 -22.585  -5.028 -14.413
    6   1HE   MET   1          1HE       MET   1 -24.768  -3.008 -13.447
    7   2HE   MET   1          2HE       MET   1 -24.174  -3.101 -11.790
    8   3HE   MET   1          3HE       MET   1 -25.846  -3.529 -12.145
    9    H    GLU   2           H        GLU   2 -20.781  -2.921 -10.687
   10    HA   GLU   2           HA       GLU   2 -18.984  -2.015 -12.769
   11   1HB   GLU   2          2HB       GLU   2 -20.592  -0.547 -11.491
   12   2HB   GLU   2          1HB       GLU   2 -19.531  -0.701 -10.091
   13   1HG   GLU   2          2HG       GLU   2 -17.651   0.094 -11.705
   14   2HG   GLU   2          1HG       GLU   2 -18.976   0.639 -12.735
   15    H    LYS   3           H        LYS   3 -17.063  -3.178 -12.773
   16    HA   LYS   3           HA       LYS   3 -15.572  -3.587 -10.264
   17   1HB   LYS   3          2HB       LYS   3 -13.957  -4.784 -11.696
   18   2HB   LYS   3          1HB       LYS   3 -15.597  -5.364 -11.983
   19   1HG   LYS   3          2HG       LYS   3 -15.723  -3.711 -13.915
   20   2HG   LYS   3          1HG       LYS   3 -13.989  -3.463 -13.705
   21   1HD   LYS   3          2HD       LYS   3 -13.723  -5.987 -13.920
   22   2HD   LYS   3          1HD       LYS   3 -15.411  -6.036 -14.430
   23   1HE   LYS   3          2HE       LYS   3 -14.169  -5.909 -16.451
   24   2HE   LYS   3          1HE       LYS   3 -14.763  -4.270 -16.182
   25   1HZ   LYS   3          1HZ       LYS   3 -12.538  -3.953 -16.642
   26   2HZ   LYS   3          2HZ       LYS   3 -12.045  -5.342 -15.799
   27   3HZ   LYS   3          3HZ       LYS   3 -12.548  -3.961 -14.947
   28    H    GLY   4           H        GLY   4 -16.028  -0.967 -12.108
   29   1HA   GLY   4          2HA       GLY   4 -13.191  -0.036 -11.856
   30   2HA   GLY   4          1HA       GLY   4 -14.307   0.566 -13.083
   31    H    GLY   5           H        GLY   5 -13.610   2.684 -12.029
   32   1HA   GLY   5          2HA       GLY   5 -14.232   4.554 -10.754
   33   2HA   GLY   5          1HA       GLY   5 -15.734   3.701 -10.395
   34    H    GLU   6           H        GLU   6 -12.498   2.523  -9.639
   35    HA   GLU   6           HA       GLU   6 -12.442   3.398  -6.904
   36   1HB   GLU   6          2HB       GLU   6 -14.411   1.633  -7.067
   37   2HB   GLU   6          1HB       GLU   6 -13.088   0.470  -7.004
   38   1HG   GLU   6          2HG       GLU   6 -12.238   1.746  -4.962
   39   2HG   GLU   6          1HG       GLU   6 -13.788   2.589  -4.961
   40    H    ALA   7           H        ALA   7 -11.714   0.242  -8.439
   41    HA   ALA   7           HA       ALA   7  -9.624  -0.739  -8.919
   42   1HB   ALA   7          1HB       ALA   7  -8.871   1.771  -9.235
   43   2HB   ALA   7          2HB       ALA   7  -7.654   0.524  -8.982
   44   3HB   ALA   7          3HB       ALA   7  -8.145   1.557  -7.644
   45    H    LEU   8           H        LEU   8  -8.401   1.031  -6.095
   46    HA   LEU   8           HA       LEU   8  -9.025  -1.360  -4.429
   47   1HB   LEU   8          2HB       LEU   8  -6.826  -0.862  -3.219
   48   2HB   LEU   8          1HB       LEU   8  -6.689  -1.589  -4.814
   49    HG   LEU   8           HG       LEU   8  -6.357   0.730  -5.762
   50   1HD1  LEU   8          1HD1      LEU   8  -5.447   2.266  -3.749
   51   2HD1  LEU   8          2HD1      LEU   8  -6.682   1.370  -2.866
   52   3HD1  LEU   8          3HD1      LEU   8  -7.127   2.321  -4.283
   53   1HD2  LEU   8          1HD2      LEU   8  -4.079   0.852  -4.158
   54   2HD2  LEU   8          2HD2      LEU   8  -4.249  -0.096  -5.635
   55   3HD2  LEU   8          3HD2      LEU   8  -4.558  -0.842  -4.070
   56    H    LYS   9           H        LYS   9  -9.372   1.913  -4.929
   57    HA   LYS   9           HA       LYS   9  -9.165   3.239  -2.515
   58   1HB   LYS   9          2HB       LYS   9 -10.043   4.101  -4.767
   59   2HB   LYS   9          1HB       LYS   9 -11.620   3.498  -4.260
   60   1HG   LYS   9          2HG       LYS   9 -11.698   4.973  -2.388
   61   2HG   LYS   9          1HG       LYS   9  -9.986   5.372  -2.537
   62   1HD   LYS   9          2HD       LYS   9 -10.542   6.337  -4.831
   63   2HD   LYS   9          1HD       LYS   9 -12.242   6.166  -4.394
   64   1HE   LYS   9          2HE       LYS   9 -10.153   7.823  -2.953
   65   2HE   LYS   9          1HE       LYS   9 -11.551   8.422  -3.844
   66   1HZ   LYS   9          1HZ       LYS   9 -12.875   6.978  -2.208
   67   2HZ   LYS   9          2HZ       LYS   9 -12.256   8.463  -1.661
   68   3HZ   LYS   9          3HZ       LYS   9 -11.470   7.010  -1.259
   69    H    GLY  10           H        GLY  10 -11.126   3.903  -1.076
   70   1HA   GLY  10          2HA       GLY  10 -13.097   3.267   0.150
   71   2HA   GLY  10          1HA       GLY  10 -12.986   1.652  -0.552
   72    H    LEU  11           H        LEU  11  -9.926   2.083   0.163
   73    HA   LEU  11           HA       LEU  11 -10.172   1.326   3.048
   74   1HB   LEU  11          2HB       LEU  11  -8.439   0.039   0.916
   75   2HB   LEU  11          1HB       LEU  11  -8.301  -0.292   2.642
   76    HG   LEU  11           HG       LEU  11 -10.987  -0.646   2.259
   77   1HD1  LEU  11          1HD1      LEU  11 -10.753  -0.342  -0.185
   78   2HD1  LEU  11          2HD1      LEU  11 -11.259  -1.984   0.207
   79   3HD1  LEU  11          3HD1      LEU  11  -9.583  -1.660  -0.235
   80   1HD2  LEU  11          1HD2      LEU  11  -9.416  -2.166   3.431
   81   2HD2  LEU  11          2HD2      LEU  11  -8.812  -2.732   1.873
   82   3HD2  LEU  11          3HD2      LEU  11 -10.480  -3.056   2.344
   83    H    THR  12           H        THR  12  -7.812   1.326   3.999
   84    HA   THR  12           HA       THR  12  -6.401   3.775   3.017
   85    HB   THR  12           HB       THR  12  -7.087   2.912   5.837
   86    HG1  THR  12           HG1      THR  12  -8.229   4.491   4.142
   87   1HG2  THR  12          1HG2      THR  12  -5.761   5.017   6.468
   88   2HG2  THR  12          2HG2      THR  12  -5.043   4.917   4.860
   89   3HG2  THR  12          3HG2      THR  12  -4.812   3.602   6.013
   90    H    PHE  13           H        PHE  13  -4.094   3.741   3.324
   91    HA   PHE  13           HA       PHE  13  -2.972   1.040   3.965
   92   1HB   PHE  13          2HB       PHE  13  -2.259   2.959   1.738
   93   2HB   PHE  13          1HB       PHE  13  -1.158   1.686   2.265
   94    HD1  PHE  13           HD1      PHE  13  -3.884   2.468   0.115
   95    HD2  PHE  13           HD2      PHE  13  -2.189  -0.733   2.427
   96    HE1  PHE  13           HE1      PHE  13  -5.123   0.813  -1.258
   97    HE2  PHE  13           HE2      PHE  13  -3.428  -2.382   1.052
   98    HZ   PHE  13           HZ       PHE  13  -4.897  -1.608  -0.789
   99    H    VAL  14           H        VAL  14  -1.276   1.052   5.391
  100    HA   VAL  14           HA       VAL  14  -0.109   3.712   6.123
  101    HB   VAL  14           HB       VAL  14  -0.445   1.522   8.158
  102   1HG1  VAL  14          1HG1      VAL  14  -0.380   3.369   9.713
  103   2HG1  VAL  14          2HG1      VAL  14  -0.498   4.537   8.400
  104   3HG1  VAL  14          3HG1      VAL  14   0.956   3.560   8.581
  105   1HG2  VAL  14          1HG2      VAL  14  -2.705   1.654   7.683
  106   2HG2  VAL  14          2HG2      VAL  14  -2.571   3.269   6.992
  107   3HG2  VAL  14          3HG2      VAL  14  -2.570   3.057   8.742
  108    H    ILE  15           H        ILE  15   2.068   3.598   6.997
  109    HA   ILE  15           HA       ILE  15   3.542   1.101   6.216
  110    HB   ILE  15           HB       ILE  15   4.934   3.750   6.304
  111   1HG1  ILE  15          2HG1      ILE  15   2.866   4.179   4.979
  112   2HG1  ILE  15          1HG1      ILE  15   4.322   4.258   3.992
  113   1HG2  ILE  15          1HG2      ILE  15   5.315   1.725   4.154
  114   2HG2  ILE  15          2HG2      ILE  15   5.777   1.251   5.787
  115   3HG2  ILE  15          3HG2      ILE  15   6.511   2.665   5.044
  116   1HD1  ILE  15          1HD1      ILE  15   3.475   2.683   2.636
  117   2HD1  ILE  15          2HD1      ILE  15   2.038   2.565   3.651
  118   3HD1  ILE  15          3HD1      ILE  15   3.439   1.549   3.986
  119    H    THR  16           H        THR  16   4.918   0.255   7.845
  120    HA   THR  16           HA       THR  16   4.586   1.035  10.514
  121    HB   THR  16           HB       THR  16   5.629  -1.113   9.435
  122    HG1  THR  16           HG1      THR  16   6.562   0.128  11.803
  123   1HG2  THR  16          1HG2      THR  16   8.211   0.289  10.078
  124   2HG2  THR  16          2HG2      THR  16   7.517   0.398   8.461
  125   3HG2  THR  16          3HG2      THR  16   7.946  -1.175   9.131
  126    H    GLY  17           H        GLY  17   6.042   2.933   8.219
  127   1HA   GLY  17          2HA       GLY  17   7.336   4.889   8.426
  128   2HA   GLY  17          1HA       GLY  17   7.231   4.700  10.180
  129    H    GLU  18           H        GLU  18   8.340   2.116   8.159
  130    HA   GLU  18           HA       GLU  18  11.128   2.567   8.097
  131   1HB   GLU  18          2HB       GLU  18  10.265   2.131  10.734
  132   2HB   GLU  18          1HB       GLU  18  10.903   0.572  10.219
  133   1HG   GLU  18          2HG       GLU  18  13.002   1.640   9.517
  134   2HG   GLU  18          1HG       GLU  18  12.366   3.218   9.985
  135    H    LEU  19           H        LEU  19   8.812   1.265   6.736
  136    HA   LEU  19           HA       LEU  19   8.901  -1.543   6.786
  137   1HB   LEU  19          2HB       LEU  19   7.854   0.453   5.039
  138   2HB   LEU  19          1HB       LEU  19   8.680  -0.743   4.056
  139    HG   LEU  19           HG       LEU  19   6.729  -1.525   6.225
  140   1HD1  LEU  19          1HD1      LEU  19   5.183  -0.497   4.880
  141   2HD1  LEU  19          2HD1      LEU  19   5.370  -1.962   3.921
  142   3HD1  LEU  19          3HD1      LEU  19   6.249  -0.502   3.476
  143   1HD2  LEU  19          1HD2      LEU  19   8.330  -3.233   5.390
  144   2HD2  LEU  19          2HD2      LEU  19   7.767  -2.939   3.746
  145   3HD2  LEU  19          3HD2      LEU  19   6.670  -3.626   4.943
  146    H    SER  20           H        SER  20  11.287   0.719   5.631
  147    HA   SER  20           HA       SER  20  13.540   0.220   5.140
  148   1HB   SER  20          2HB       SER  20  14.345  -1.927   5.170
  149   2HB   SER  20          1HB       SER  20  12.824  -2.215   6.001
  150    HG   SER  20           HG       SER  20  13.430  -2.602   3.255
  151    H    ARG  21           H        ARG  21  11.446   1.222   3.443
  152    HA   ARG  21           HA       ARG  21  12.745   0.801   0.840
  153   1HB   ARG  21          2HB       ARG  21  10.950  -0.199  -0.270
  154   2HB   ARG  21          1HB       ARG  21  10.804  -0.950   1.315
  155   1HG   ARG  21          2HG       ARG  21   9.180   0.831   1.973
  156   2HG   ARG  21          1HG       ARG  21   9.262   1.470   0.332
  157   1HD   ARG  21          2HD       ARG  21   8.779  -1.238  -0.059
  158   2HD   ARG  21          1HD       ARG  21   7.790  -0.841   1.348
  159    HE   ARG  21           HE       ARG  21   7.137   1.198  -0.303
  160   1HH1  ARG  21          1HH2      ARG  21   5.583  -1.478   0.016
  161   2HH1  ARG  21          2HH2      ARG  21   5.290  -1.856  -1.648
  162   1HH2  ARG  21          1HH1      ARG  21   7.609   0.426  -2.846
  163   2HH2  ARG  21          2HH1      ARG  21   6.435  -0.777  -3.270
  164    HA   PRO  22           HA       PRO  22  11.381   4.990   0.235
  165   1HB   PRO  22          2HB       PRO  22  10.378   5.099  -2.312
  166   2HB   PRO  22          1HB       PRO  22  12.107   4.945  -1.951
  167   1HG   PRO  22          2HG       PRO  22  10.153   2.863  -2.779
  168   2HG   PRO  22          1HG       PRO  22  11.850   3.070  -3.243
  169   1HD   PRO  22          2HD       PRO  22  11.014   1.245  -1.377
  170   2HD   PRO  22          1HD       PRO  22  12.636   1.967  -1.372
  171    H    ARG  23           H        ARG  23   9.423   3.231   1.447
  172    HA   ARG  23           HA       ARG  23   6.823   3.213   0.634
  173   1HB   ARG  23          2HB       ARG  23   6.161   3.415   3.014
  174   2HB   ARG  23          1HB       ARG  23   7.525   2.322   2.788
  175   1HG   ARG  23          2HG       ARG  23   8.531   3.556   4.411
  176   2HG   ARG  23          1HG       ARG  23   8.797   4.741   3.133
  177   1HD   ARG  23          2HD       ARG  23   6.478   5.670   3.725
  178   2HD   ARG  23          1HD       ARG  23   6.574   4.680   5.181
  179    HE   ARG  23           HE       ARG  23   8.935   6.332   4.835
  180   1HH1  ARG  23          1HH2      ARG  23   6.071   7.758   4.743
  181   2HH1  ARG  23          2HH2      ARG  23   6.050   8.393   6.353
  182   1HH2  ARG  23          1HH1      ARG  23   8.744   6.490   7.420
  183   2HH2  ARG  23          2HH1      ARG  23   7.564   7.674   7.871
  184    H    GLU  24           H        GLU  24   8.585   6.150   1.124
  185    HA   GLU  24           HA       GLU  24   6.172   7.770   1.600
  186   1HB   GLU  24          2HB       GLU  24   9.098   8.366   1.189
  187   2HB   GLU  24          1HB       GLU  24   7.908   9.659   1.036
  188   1HG   GLU  24          2HG       GLU  24   7.700   7.889   3.427
  189   2HG   GLU  24          1HG       GLU  24   9.031   9.043   3.392
  190    H    GLU  25           H        GLU  25   8.528   7.282  -0.994
  191    HA   GLU  25           HA       GLU  25   7.341   8.874  -3.009
  192   1HB   GLU  25          2HB       GLU  25   9.565   7.638  -3.136
  193   2HB   GLU  25          1HB       GLU  25   8.642   6.180  -3.505
  194   1HG   GLU  25          2HG       GLU  25   9.088   6.964  -5.650
  195   2HG   GLU  25          1HG       GLU  25   7.526   7.722  -5.342
  196    H    VAL  26           H        VAL  26   6.827   5.382  -2.386
  197    HA   VAL  26           HA       VAL  26   4.737   5.062  -4.299
  198    HB   VAL  26           HB       VAL  26   6.028   3.220  -3.090
  199   1HG1  VAL  26          1HG1      VAL  26   3.908   3.589  -0.963
  200   2HG1  VAL  26          2HG1      VAL  26   5.540   4.234  -0.801
  201   3HG1  VAL  26          3HG1      VAL  26   5.290   2.495  -0.938
  202   1HG2  VAL  26          1HG2      VAL  26   3.001   3.127  -3.244
  203   2HG2  VAL  26          2HG2      VAL  26   4.017   1.702  -3.032
  204   3HG2  VAL  26          3HG2      VAL  26   4.141   2.662  -4.505
  205    H    LYS  27           H        LYS  27   4.707   6.112  -0.911
  206    HA   LYS  27           HA       LYS  27   1.962   6.031  -0.345
  207   1HB   LYS  27          2HB       LYS  27   3.929   6.856   1.135
  208   2HB   LYS  27          1HB       LYS  27   3.653   8.425   0.386
  209   1HG   LYS  27          2HG       LYS  27   2.073   8.767   1.959
  210   2HG   LYS  27          1HG       LYS  27   1.097   7.574   1.105
  211   1HD   LYS  27          2HD       LYS  27   3.157   6.754   3.159
  212   2HD   LYS  27          1HD       LYS  27   1.508   7.173   3.622
  213   1HE   LYS  27          2HE       LYS  27   1.093   5.448   1.510
  214   2HE   LYS  27          1HE       LYS  27   2.518   4.756   2.284
  215   1HZ   LYS  27          1HZ       LYS  27   1.268   4.968   4.428
  216   2HZ   LYS  27          2HZ       LYS  27   0.644   3.822   3.340
  217   3HZ   LYS  27          3HZ       LYS  27  -0.115   5.332   3.515
  218    H    ALA  28           H        ALA  28   3.791   8.454  -2.195
  219    HA   ALA  28           HA       ALA  28   1.564  10.223  -2.655
  220   1HB   ALA  28          1HB       ALA  28   3.928   9.806  -4.507
  221   2HB   ALA  28          2HB       ALA  28   4.039  10.749  -3.022
  222   3HB   ALA  28          3HB       ALA  28   2.955  11.264  -4.314
  223    H    LEU  29           H        LEU  29   2.867   7.394  -4.316
  224    HA   LEU  29           HA       LEU  29   1.038   7.556  -6.576
  225   1HB   LEU  29          2HB       LEU  29   3.213   5.844  -5.684
  226   2HB   LEU  29          1HB       LEU  29   1.851   4.877  -6.245
  227    HG   LEU  29           HG       LEU  29   1.801   6.231  -8.345
  228   1HD1  LEU  29          1HD1      LEU  29   4.232   7.489  -7.050
  229   2HD1  LEU  29          2HD1      LEU  29   2.785   8.300  -7.646
  230   3HD1  LEU  29          3HD1      LEU  29   3.925   7.583  -8.784
  231   1HD2  LEU  29          1HD2      LEU  29   4.449   4.913  -7.658
  232   2HD2  LEU  29          2HD2      LEU  29   3.900   5.273  -9.294
  233   3HD2  LEU  29          3HD2      LEU  29   3.021   4.106  -8.305
  234    H    LEU  30           H        LEU  30   1.020   6.084  -3.385
  235    HA   LEU  30           HA       LEU  30  -1.309   4.414  -3.797
  236   1HB   LEU  30          2HB       LEU  30  -0.075   5.538  -1.259
  237   2HB   LEU  30          1HB       LEU  30  -1.342   4.315  -1.295
  238    HG   LEU  30           HG       LEU  30   1.555   4.079  -1.990
  239   1HD1  LEU  30          1HD1      LEU  30   0.860   3.159   0.104
  240   2HD1  LEU  30          2HD1      LEU  30   1.097   1.788  -0.980
  241   3HD1  LEU  30          3HD1      LEU  30  -0.533   2.366  -0.631
  242   1HD2  LEU  30          1HD2      LEU  30  -0.667   2.513  -3.339
  243   2HD2  LEU  30          2HD2      LEU  30   1.007   1.962  -3.273
  244   3HD2  LEU  30          3HD2      LEU  30   0.605   3.453  -4.120
  245    H    ARG  31           H        ARG  31  -0.823   7.583  -2.221
  246    HA   ARG  31           HA       ARG  31  -3.548   8.091  -1.588
  247   1HB   ARG  31          2HB       ARG  31  -1.482   9.412  -0.850
  248   2HB   ARG  31          1HB       ARG  31  -1.541  10.197  -2.427
  249   1HG   ARG  31          2HG       ARG  31  -3.809  11.005  -1.972
  250   2HG   ARG  31          1HG       ARG  31  -3.818  10.162  -0.422
  251   1HD   ARG  31          2HD       ARG  31  -3.254  12.653  -0.327
  252   2HD   ARG  31          1HD       ARG  31  -2.106  11.575   0.466
  253    HE   ARG  31           HE       ARG  31  -0.566  11.926  -1.386
  254   1HH1  ARG  31          1HH2      ARG  31  -3.377  12.793  -2.839
  255   2HH1  ARG  31          2HH2      ARG  31  -2.851  14.338  -3.417
  256   1HH2  ARG  31          1HH1      ARG  31   0.078  14.330  -1.562
  257   2HH2  ARG  31          2HH1      ARG  31  -0.894  15.209  -2.694
  258    H    ARG  32           H        ARG  32  -1.647   8.838  -4.460
  259    HA   ARG  32           HA       ARG  32  -3.619  10.245  -5.953
  260   1HB   ARG  32          2HB       ARG  32  -1.242   8.565  -6.700
  261   2HB   ARG  32          1HB       ARG  32  -2.359   9.074  -7.968
  262   1HG   ARG  32          2HG       ARG  32  -2.112  11.447  -7.014
  263   2HG   ARG  32          1HG       ARG  32  -0.735  10.818  -6.110
  264   1HD   ARG  32          2HD       ARG  32  -1.070  10.827  -9.122
  265   2HD   ARG  32          1HD       ARG  32   0.081  11.779  -8.186
  266    HE   ARG  32           HE       ARG  32   1.032   9.469  -7.491
  267   1HH1  ARG  32          1HH2      ARG  32  -1.227   8.581  -9.620
  268   2HH1  ARG  32          2HH2      ARG  32  -0.169   8.003 -10.864
  269   1HH2  ARG  32          1HH1      ARG  32   2.679   9.388  -9.456
  270   2HH2  ARG  32          2HH1      ARG  32   2.040   8.457 -10.769
  271    H    LEU  33           H        LEU  33  -3.159   6.821  -5.352
  272    HA   LEU  33           HA       LEU  33  -5.091   5.900  -7.303
  273   1HB   LEU  33          2HB       LEU  33  -3.128   4.677  -5.912
  274   2HB   LEU  33          1HB       LEU  33  -4.506   4.243  -4.906
  275    HG   LEU  33           HG       LEU  33  -5.645   3.218  -6.768
  276   1HD1  LEU  33          1HD1      LEU  33  -5.299   4.379  -8.722
  277   2HD1  LEU  33          2HD1      LEU  33  -4.069   3.142  -8.963
  278   3HD1  LEU  33          3HD1      LEU  33  -3.613   4.726  -8.342
  279   1HD2  LEU  33          1HD2      LEU  33  -2.802   2.331  -7.181
  280   2HD2  LEU  33          2HD2      LEU  33  -4.263   1.352  -7.052
  281   3HD2  LEU  33          3HD2      LEU  33  -3.569   2.100  -5.612
  282    H    GLY  34           H        GLY  34  -5.826   7.905  -4.961
  283   1HA   GLY  34          2HA       GLY  34  -7.985   8.391  -4.122
  284   2HA   GLY  34          1HA       GLY  34  -8.519   6.794  -4.633
  285    H    ALA  35           H        ALA  35  -6.980   5.037  -3.288
  286    HA   ALA  35           HA       ALA  35  -8.044   4.871  -0.726
  287   1HB   ALA  35          1HB       ALA  35  -6.969   2.934  -1.522
  288   2HB   ALA  35          2HB       ALA  35  -5.926   3.472  -0.208
  289   3HB   ALA  35          3HB       ALA  35  -5.475   3.801  -1.882
  290    H    LYS  36           H        LYS  36  -7.500   5.625   1.303
  291    HA   LYS  36           HA       LYS  36  -5.884   8.031   1.472
  292   1HB   LYS  36          2HB       LYS  36  -7.513   6.372   3.338
  293   2HB   LYS  36          1HB       LYS  36  -6.253   7.371   4.062
  294   1HG   LYS  36          2HG       LYS  36  -7.179   9.376   3.127
  295   2HG   LYS  36          1HG       LYS  36  -8.273   8.462   2.089
  296   1HD   LYS  36          2HD       LYS  36  -9.569   9.272   3.953
  297   2HD   LYS  36          1HD       LYS  36  -9.348   7.537   4.185
  298   1HE   LYS  36          2HE       LYS  36  -7.289   9.347   5.369
  299   2HE   LYS  36          1HE       LYS  36  -8.868   9.297   6.149
  300   1HZ   LYS  36          1HZ       LYS  36  -6.971   7.587   6.736
  301   2HZ   LYS  36          2HZ       LYS  36  -7.641   6.748   5.420
  302   3HZ   LYS  36          3HZ       LYS  36  -8.607   7.145   6.759
  303    H    VAL  37           H        VAL  37  -3.931   8.246   2.845
  304    HA   VAL  37           HA       VAL  37  -2.462   5.677   3.228
  305    HB   VAL  37           HB       VAL  37  -0.396   6.919   2.457
  306   1HG1  VAL  37          1HG1      VAL  37  -2.696   6.469   0.538
  307   2HG1  VAL  37          2HG1      VAL  37  -1.411   5.335   0.955
  308   3HG1  VAL  37          3HG1      VAL  37  -1.042   6.779   0.013
  309   1HG2  VAL  37          1HG2      VAL  37  -1.453   9.202   2.748
  310   2HG2  VAL  37          2HG2      VAL  37  -2.420   8.866   1.312
  311   3HG2  VAL  37          3HG2      VAL  37  -0.664   8.961   1.191
  312    H    THR  38           H        THR  38  -0.924   5.721   4.955
  313    HA   THR  38           HA       THR  38  -0.602   8.158   6.563
  314    HB   THR  38           HB       THR  38  -1.402   6.692   8.632
  315    HG1  THR  38           HG1      THR  38  -2.810   5.648   6.409
  316   1HG2  THR  38          1HG2      THR  38  -3.370   7.943   8.662
  317   2HG2  THR  38          2HG2      THR  38  -3.609   7.800   6.921
  318   3HG2  THR  38          3HG2      THR  38  -2.367   8.880   7.555
  319    H    ASP  39           H        ASP  39   0.421   7.009   8.885
  320    HA   ASP  39           HA       ASP  39   2.379   4.958   8.040
  321   1HB   ASP  39          2HB       ASP  39   4.278   6.325   8.882
  322   2HB   ASP  39          1HB       ASP  39   3.489   7.071   7.492
  323    H    SER  40           H        SER  40   0.244   6.089  10.322
  324    HA   SER  40           HA       SER  40   1.599   4.510  12.463
  325   1HB   SER  40          2HB       SER  40   1.783   6.947  12.951
  326   2HB   SER  40          1HB       SER  40   0.028   7.077  12.866
  327    HG   SER  40           HG       SER  40   0.882   6.780  15.016
  328    H    VAL  41           H        VAL  41   0.060   3.543  13.990
  329    HA   VAL  41           HA       VAL  41  -2.730   3.369  12.932
  330    HB   VAL  41           HB       VAL  41  -2.694   0.933  13.482
  331   1HG1  VAL  41          1HG1      VAL  41  -1.135   0.302  11.574
  332   2HG1  VAL  41          2HG1      VAL  41  -0.675   1.999  11.493
  333   3HG1  VAL  41          3HG1      VAL  41  -2.344   1.522  11.182
  334   1HG2  VAL  41          1HG2      VAL  41  -0.434  -0.120  13.781
  335   2HG2  VAL  41          2HG2      VAL  41  -0.901   0.909  15.133
  336   3HG2  VAL  41          3HG2      VAL  41   0.256   1.495  13.939
  337    H    SER  42           H        SER  42  -4.335   3.153  14.510
  338    HA   SER  42           HA       SER  42  -3.563   2.829  17.340
  339   1HB   SER  42          2HB       SER  42  -4.795   5.372  16.245
  340   2HB   SER  42          1HB       SER  42  -4.794   4.952  17.956
  341    HG   SER  42           HG       SER  42  -2.923   5.941  17.871
  342    H    ARG  43           H        ARG  43  -6.043   3.221  14.864
  343    HA   ARG  43           HA       ARG  43  -7.734   1.202  15.962
  344   1HB   ARG  43          2HB       ARG  43  -8.004   3.772  17.210
  345   2HB   ARG  43          1HB       ARG  43  -9.455   3.473  16.256
  346   1HG   ARG  43          2HG       ARG  43  -9.785   1.318  17.363
  347   2HG   ARG  43          1HG       ARG  43  -8.281   1.524  18.262
  348   1HD   ARG  43          2HD       ARG  43  -9.341   3.742  19.105
  349   2HD   ARG  43          1HD       ARG  43 -10.865   3.050  18.549
  350    HE   ARG  43           HE       ARG  43  -9.210   2.021  20.784
  351   1HH1  ARG  43          1HH1      ARG  43 -10.288  -0.323  19.385
  352   2HH1  ARG  43          2HH1      ARG  43 -11.858  -0.521  20.092
  353   1HH2  ARG  43          1HH2      ARG  43 -11.954   2.683  21.413
  354   2HH2  ARG  43          2HH2      ARG  43 -12.802   1.183  21.239
  355    H    LYS  44           H        LYS  44  -8.542   4.379  14.569
  356    HA   LYS  44           HA       LYS  44 -10.197   3.266  12.497
  357   1HB   LYS  44          2HB       LYS  44  -8.848   5.985  12.555
  358   2HB   LYS  44          1HB       LYS  44 -10.245   5.531  11.579
  359   1HG   LYS  44          2HG       LYS  44 -10.161   5.546  14.613
  360   2HG   LYS  44          1HG       LYS  44 -10.927   6.776  13.608
  361   1HD   LYS  44          2HD       LYS  44 -12.229   4.749  12.572
  362   2HD   LYS  44          1HD       LYS  44 -11.756   3.918  14.055
  363   1HE   LYS  44          2HE       LYS  44 -13.223   6.572  13.948
  364   2HE   LYS  44          1HE       LYS  44 -13.979   5.011  14.268
  365   1HZ   LYS  44          1HZ       LYS  44 -11.857   6.297  15.900
  366   2HZ   LYS  44          2HZ       LYS  44 -12.513   4.758  16.191
  367   3HZ   LYS  44          3HZ       LYS  44 -13.492   6.140  16.326
  368    H    THR  45           H        THR  45  -6.840   3.336  12.831
  369    HA   THR  45           HA       THR  45  -6.493   2.891   9.889
  370    HB   THR  45           HB       THR  45  -4.081   3.739  10.376
  371    HG1  THR  45           HG1      THR  45  -4.136   5.310  12.097
  372   1HG2  THR  45          1HG2      THR  45  -6.390   5.699  10.483
  373   2HG2  THR  45          2HG2      THR  45  -5.786   4.935   9.012
  374   3HG2  THR  45          3HG2      THR  45  -4.754   6.040   9.918
  375    H    SER  46           H        SER  46  -6.099   0.757   9.632
  376    HA   SER  46           HA       SER  46  -3.970  -0.505  11.228
  377   1HB   SER  46          2HB       SER  46  -6.532  -2.048  11.037
  378   2HB   SER  46          1HB       SER  46  -5.235  -2.178  12.219
  379    HG   SER  46           HG       SER  46  -7.100  -0.047  11.962
  380    H    TYR  47           H        TYR  47  -3.359  -0.050   8.826
  381    HA   TYR  47           HA       TYR  47  -3.709  -2.611   7.360
  382   1HB   TYR  47          2HB       TYR  47  -4.230   0.122   6.149
  383   2HB   TYR  47          1HB       TYR  47  -4.107  -1.376   5.226
  384    HD1  TYR  47           HD1      TYR  47  -6.244   0.713   7.263
  385    HD2  TYR  47           HD2      TYR  47  -5.730  -3.267   5.728
  386    HE1  TYR  47           HE1      TYR  47  -8.625   0.220   7.744
  387    HE2  TYR  47           HE2      TYR  47  -8.112  -3.758   6.209
  388    HH   TYR  47           HH       TYR  47 -10.209  -2.552   6.527
  389    H    LEU  48           H        LEU  48  -1.736  -3.282   6.641
  390    HA   LEU  48           HA       LEU  48   0.409  -1.216   6.368
  391   1HB   LEU  48          2HB       LEU  48   0.551  -2.926   8.298
  392   2HB   LEU  48          1HB       LEU  48   0.866  -4.123   7.051
  393    HG   LEU  48           HG       LEU  48   3.034  -3.548   7.484
  394   1HD1  LEU  48          1HD1      LEU  48   2.708  -2.823   5.169
  395   2HD1  LEU  48          2HD1      LEU  48   3.908  -1.826   5.981
  396   3HD1  LEU  48          3HD1      LEU  48   2.281  -1.207   5.729
  397   1HD2  LEU  48          1HD2      LEU  48   2.355  -2.019   9.338
  398   2HD2  LEU  48          2HD2      LEU  48   2.164  -0.724   8.158
  399   3HD2  LEU  48          3HD2      LEU  48   3.755  -1.428   8.446
  400    H    VAL  49           H        VAL  49   1.180  -1.058   4.345
  401    HA   VAL  49           HA       VAL  49   0.462  -3.031   2.283
  402    HB   VAL  49           HB       VAL  49   2.287  -1.524   1.006
  403   1HG1  VAL  49          1HG1      VAL  49  -0.361  -1.740   0.859
  404   2HG1  VAL  49          2HG1      VAL  49   0.495  -0.432   0.041
  405   3HG1  VAL  49          3HG1      VAL  49  -0.295  -0.136   1.589
  406   1HG2  VAL  49          1HG2      VAL  49   2.436   0.703   1.861
  407   2HG2  VAL  49          2HG2      VAL  49   2.819  -0.360   3.215
  408   3HG2  VAL  49          3HG2      VAL  49   1.223   0.384   3.101
  409    H    VAL  50           H        VAL  50   1.478  -4.958   2.900
  410    HA   VAL  50           HA       VAL  50   4.177  -5.123   3.886
  411    HB   VAL  50           HB       VAL  50   2.680  -7.273   2.351
  412   1HG1  VAL  50          1HG1      VAL  50   5.034  -7.792   2.738
  413   2HG1  VAL  50          2HG1      VAL  50   4.041  -8.779   3.809
  414   3HG1  VAL  50          3HG1      VAL  50   4.880  -7.361   4.441
  415   1HG2  VAL  50          1HG2      VAL  50   2.046  -7.999   4.745
  416   2HG2  VAL  50          2HG2      VAL  50   1.179  -6.618   4.074
  417   3HG2  VAL  50          3HG2      VAL  50   2.487  -6.362   5.228
  418    H    GLY  51           H        GLY  51   5.551  -3.871   2.498
  419   1HA   GLY  51          2HA       GLY  51   5.614  -4.657  -0.360
  420   2HA   GLY  51          1HA       GLY  51   6.401  -3.251   0.345
  421    H    GLU  52           H        GLU  52   8.265  -3.811   1.913
  422    HA   GLU  52           HA       GLU  52  10.139  -5.435   0.459
  423   1HB   GLU  52          2HB       GLU  52  10.366  -3.474   2.356
  424   2HB   GLU  52          1HB       GLU  52  10.788  -4.909   3.291
  425   1HG   GLU  52          2HG       GLU  52  12.864  -4.390   2.392
  426   2HG   GLU  52          1HG       GLU  52  12.249  -5.472   1.145
  427    H    ASN  53           H        ASN  53  11.517  -6.827   2.386
  428    HA   ASN  53           HA       ASN  53   9.614  -9.015   3.134
  429   1HB   ASN  53          2HB       ASN  53  12.454  -9.763   2.758
  430   2HB   ASN  53          1HB       ASN  53  10.990 -10.605   2.257
  431   1HD2  ASN  53          1HD2      ASN  53  13.607  -8.768   1.082
  432   2HD2  ASN  53          2HD2      ASN  53  12.966  -8.386  -0.443
  433    HA   PRO  54           HA       PRO  54  12.670  -8.649   6.726
  434   1HB   PRO  54          2HB       PRO  54  14.950  -7.165   6.453
  435   2HB   PRO  54          1HB       PRO  54  14.819  -8.842   5.894
  436   1HG   PRO  54          2HG       PRO  54  14.990  -6.384   4.341
  437   2HG   PRO  54          1HG       PRO  54  15.230  -8.060   3.828
  438   1HD   PRO  54          2HD       PRO  54  12.877  -6.384   3.487
  439   2HD   PRO  54          1HD       PRO  54  13.191  -8.002   2.827
  440    H    GLY  55           H        GLY  55  11.117  -6.232   5.334
  441   1HA   GLY  55          2HA       GLY  55  11.860  -3.805   6.541
  442   2HA   GLY  55          1HA       GLY  55  10.213  -4.213   6.074
  443    H    SER  56           H        SER  56  10.736  -2.667   8.337
  444    HA   SER  56           HA       SER  56  10.713  -4.308  10.743
  445   1HB   SER  56          2HB       SER  56  11.333  -1.738  10.370
  446   2HB   SER  56          1HB       SER  56   9.622  -1.520  10.725
  447    HG   SER  56           HG       SER  56  11.481  -2.970  12.313
  448    H    LYS  57           H        LYS  57   8.477  -3.710   8.340
  449    HA   LYS  57           HA       LYS  57   6.027  -3.314   9.680
  450   1HB   LYS  57          2HB       LYS  57   4.971  -4.052   7.702
  451   2HB   LYS  57          1HB       LYS  57   6.507  -3.398   7.147
  452   1HG   LYS  57          2HG       LYS  57   5.977  -6.338   7.688
  453   2HG   LYS  57          1HG       LYS  57   5.971  -5.591   6.092
  454   1HD   LYS  57          2HD       LYS  57   8.359  -4.755   6.761
  455   2HD   LYS  57          1HD       LYS  57   8.285  -6.049   7.952
  456   1HE   LYS  57          2HE       LYS  57   8.984  -7.430   6.313
  457   2HE   LYS  57          1HE       LYS  57   7.372  -7.262   5.621
  458   1HZ   LYS  57          1HZ       LYS  57   8.807  -5.002   4.893
  459   2HZ   LYS  57          2HZ       LYS  57   8.296  -6.273   3.889
  460   3HZ   LYS  57          3HZ       LYS  57   9.833  -6.324   4.614
  461    H    LEU  58           H        LEU  58   8.113  -6.058   9.717
  462    HA   LEU  58           HA       LEU  58   6.473  -8.261  10.075
  463   1HB   LEU  58          2HB       LEU  58   9.122  -7.455  11.015
  464   2HB   LEU  58          1HB       LEU  58   8.311  -8.530  12.155
  465    HG   LEU  58           HG       LEU  58   7.769 -10.018  10.133
  466   1HD1  LEU  58          1HD1      LEU  58   8.224  -8.402   8.364
  467   2HD1  LEU  58          2HD1      LEU  58   9.359  -9.745   8.220
  468   3HD1  LEU  58          3HD1      LEU  58   9.888  -8.215   8.919
  469   1HD2  LEU  58          1HD2      LEU  58  10.043 -11.035  10.164
  470   2HD2  LEU  58          2HD2      LEU  58   9.484 -10.615  11.782
  471   3HD2  LEU  58          3HD2      LEU  58  10.660  -9.588  10.963
  472    H    GLU  59           H        GLU  59   6.723  -5.475  12.153
  473    HA   GLU  59           HA       GLU  59   5.554  -6.695  14.499
  474   1HB   GLU  59          2HB       GLU  59   6.084  -3.892  13.566
  475   2HB   GLU  59          1HB       GLU  59   4.990  -4.140  14.927
  476   1HG   GLU  59          2HG       GLU  59   7.729  -5.416  14.821
  477   2HG   GLU  59          1HG       GLU  59   7.470  -3.810  15.502
  478    H    LYS  60           H        LYS  60   4.112  -4.357  12.153
  479    HA   LYS  60           HA       LYS  60   1.432  -5.158  13.062
  480   1HB   LYS  60          2HB       LYS  60   1.901  -2.809  12.417
  481   2HB   LYS  60          1HB       LYS  60   2.248  -3.346  10.773
  482   1HG   LYS  60          2HG       LYS  60  -0.020  -4.157  10.489
  483   2HG   LYS  60          1HG       LYS  60  -0.389  -3.843  12.184
  484   1HD   LYS  60          2HD       LYS  60   0.051  -1.415  11.780
  485   2HD   LYS  60          1HD       LYS  60   0.263  -1.776  10.067
  486   1HE   LYS  60          2HE       LYS  60  -2.009  -1.108  10.269
  487   2HE   LYS  60          1HE       LYS  60  -2.060  -2.868  10.173
  488   1HZ   LYS  60          1HZ       LYS  60  -2.555  -1.114  12.461
  489   2HZ   LYS  60          2HZ       LYS  60  -1.846  -2.629  12.765
  490   3HZ   LYS  60          3HZ       LYS  60  -3.356  -2.534  11.991
  491    H    ALA  61           H        ALA  61   3.584  -5.800  10.355
  492    HA   ALA  61           HA       ALA  61   1.652  -6.989   8.607
  493   1HB   ALA  61          1HB       ALA  61   3.912  -6.346   7.854
  494   2HB   ALA  61          2HB       ALA  61   3.575  -8.041   7.502
  495   3HB   ALA  61          3HB       ALA  61   4.605  -7.613   8.868
  496    H    ARG  62           H        ARG  62   3.652  -8.347  11.263
  497    HA   ARG  62           HA       ARG  62   2.719 -11.058  10.816
  498   1HB   ARG  62          2HB       ARG  62   4.810 -10.544  12.081
  499   2HB   ARG  62          1HB       ARG  62   3.839  -9.768  13.332
  500   1HG   ARG  62          2HG       ARG  62   2.911 -11.785  14.055
  501   2HG   ARG  62          1HG       ARG  62   3.212 -12.592  12.516
  502   1HD   ARG  62          2HD       ARG  62   4.777 -13.441  14.183
  503   2HD   ARG  62          1HD       ARG  62   5.661 -12.495  12.986
  504    HE   ARG  62           HE       ARG  62   5.755 -10.652  14.648
  505   1HH1  ARG  62          1HH2      ARG  62   6.694 -13.510  15.712
  506   2HH1  ARG  62          2HH2      ARG  62   6.200 -13.347  17.364
  507   1HH2  ARG  62          1HH1      ARG  62   4.254 -10.537  16.780
  508   2HH2  ARG  62          2HH1      ARG  62   4.819 -11.664  17.969
  509    H    ALA  63           H        ALA  63   1.748  -8.251  12.712
  510    HA   ALA  63           HA       ALA  63  -0.236  -7.721  13.774
  511   1HB   ALA  63          1HB       ALA  63  -2.184  -9.436  13.025
  512   2HB   ALA  63          2HB       ALA  63  -1.019  -9.724  11.734
  513   3HB   ALA  63          3HB       ALA  63  -1.634  -8.098  12.019
  514    H    LEU  64           H        LEU  64  -1.482  -8.239  15.535
  515    HA   LEU  64           HA       LEU  64  -1.028 -10.899  16.822
  516   1HB   LEU  64          2HB       LEU  64  -1.177  -9.567  19.023
  517   2HB   LEU  64          1HB       LEU  64   0.324  -9.402  18.112
  518    HG   LEU  64           HG       LEU  64  -1.791  -7.469  17.369
  519   1HD1  LEU  64          1HD1      LEU  64  -2.132  -7.583  19.813
  520   2HD1  LEU  64          2HD1      LEU  64  -1.406  -6.046  19.344
  521   3HD1  LEU  64          3HD1      LEU  64  -0.407  -7.308  20.066
  522   1HD2  LEU  64          1HD2      LEU  64   1.104  -7.071  18.183
  523   2HD2  LEU  64          2HD2      LEU  64   0.099  -5.971  17.239
  524   3HD2  LEU  64          3HD2      LEU  64   0.607  -7.512  16.549
  525    H    GLY  65           H        GLY  65  -3.112  -9.060  15.279
  526   1HA   GLY  65          2HA       GLY  65  -5.494 -10.290  15.858
  527   2HA   GLY  65          1HA       GLY  65  -5.416  -8.989  17.055
  528    H    VAL  66           H        VAL  66  -3.790  -7.328  15.232
  529    HA   VAL  66           HA       VAL  66  -5.968  -5.973  13.863
  530    HB   VAL  66           HB       VAL  66  -4.216  -4.367  13.165
  531   1HG1  VAL  66          1HG1      VAL  66  -3.645  -3.583  15.369
  532   2HG1  VAL  66          2HG1      VAL  66  -3.805  -5.204  16.048
  533   3HG1  VAL  66          3HG1      VAL  66  -5.236  -4.338  15.482
  534   1HG2  VAL  66          1HG2      VAL  66  -2.394  -5.944  12.741
  535   2HG2  VAL  66          2HG2      VAL  66  -2.349  -6.392  14.446
  536   3HG2  VAL  66          3HG2      VAL  66  -1.877  -4.767  13.949
  537    HA   PRO  67           HA       PRO  67  -5.272  -7.792   9.868
  538   1HB   PRO  67          2HB       PRO  67  -6.510  -5.930   8.305
  539   2HB   PRO  67          1HB       PRO  67  -7.385  -7.021   9.394
  540   1HG   PRO  67          2HG       PRO  67  -6.916  -4.148   9.626
  541   2HG   PRO  67          1HG       PRO  67  -8.118  -5.165  10.430
  542   1HD   PRO  67          2HD       PRO  67  -5.616  -4.177  11.502
  543   2HD   PRO  67          1HD       PRO  67  -6.864  -5.140  12.325
  544    H    THR  68           H        THR  68  -3.974  -7.707   8.009
  545    HA   THR  68           HA       THR  68  -2.280  -5.261   7.612
  546    HB   THR  68           HB       THR  68  -0.347  -6.591   7.327
  547    HG1  THR  68           HG1      THR  68  -0.572  -8.919   7.210
  548   1HG2  THR  68          1HG2      THR  68  -1.878  -8.144   9.421
  549   2HG2  THR  68          2HG2      THR  68  -1.273  -6.509   9.695
  550   3HG2  THR  68          3HG2      THR  68  -0.148  -7.824   9.366
  551    H    LEU  69           H        LEU  69  -2.027  -4.666   5.374
  552    HA   LEU  69           HA       LEU  69  -3.627  -6.364   3.504
  553   1HB   LEU  69          2HB       LEU  69  -3.847  -3.660   4.115
  554   2HB   LEU  69          1HB       LEU  69  -2.979  -3.668   2.580
  555    HG   LEU  69           HG       LEU  69  -5.472  -5.322   3.019
  556   1HD1  LEU  69          1HD1      LEU  69  -5.280  -2.463   2.879
  557   2HD1  LEU  69          2HD1      LEU  69  -6.730  -3.462   2.946
  558   3HD1  LEU  69          3HD1      LEU  69  -6.016  -3.049   1.388
  559   1HD2  LEU  69          1HD2      LEU  69  -3.865  -4.395   0.627
  560   2HD2  LEU  69          2HD2      LEU  69  -5.514  -4.995   0.464
  561   3HD2  LEU  69          3HD2      LEU  69  -4.254  -6.048   1.105
  562    H    THR  70           H        THR  70  -2.425  -7.516   2.108
  563    HA   THR  70           HA       THR  70   0.363  -7.287   1.721
  564    HB   THR  70           HB       THR  70  -1.487  -8.249  -0.456
  565    HG1  THR  70           HG1      THR  70  -1.619 -10.198   0.732
  566   1HG2  THR  70          1HG2      THR  70   1.043  -9.499   0.623
  567   2HG2  THR  70          2HG2      THR  70   1.081  -8.236  -0.607
  568   3HG2  THR  70          3HG2      THR  70   0.274  -9.768  -0.940
  569    H    GLU  71           H        GLU  71   1.617  -5.993   0.422
  570    HA   GLU  71           HA       GLU  71   0.376  -3.705  -0.895
  571   1HB   GLU  71          2HB       GLU  71   2.600  -3.594   0.261
  572   2HB   GLU  71          1HB       GLU  71   3.267  -4.622  -1.006
  573   1HG   GLU  71          2HG       GLU  71   1.768  -2.321  -2.055
  574   2HG   GLU  71          1HG       GLU  71   3.161  -1.855  -1.081
  575    H    GLU  72           H        GLU  72   1.419  -6.875  -1.852
  576    HA   GLU  72           HA       GLU  72   1.978  -6.468  -4.598
  577   1HB   GLU  72          2HB       GLU  72   0.536  -8.852  -3.397
  578   2HB   GLU  72          1HB       GLU  72   1.471  -8.826  -4.892
  579   1HG   GLU  72          2HG       GLU  72   2.509  -8.479  -2.066
  580   2HG   GLU  72          1HG       GLU  72   2.893  -9.776  -3.195
  581    H    GLU  73           H        GLU  73  -1.153  -7.368  -3.098
  582    HA   GLU  73           HA       GLU  73  -2.723  -7.211  -5.449
  583   1HB   GLU  73          2HB       GLU  73  -3.393  -8.026  -3.090
  584   2HB   GLU  73          1HB       GLU  73  -3.722  -6.330  -2.735
  585   1HG   GLU  73          2HG       GLU  73  -5.288  -6.232  -4.645
  586   2HG   GLU  73          1HG       GLU  73  -4.963  -7.930  -4.996
  587    H    LEU  74           H        LEU  74  -1.600  -4.683  -3.248
  588    HA   LEU  74           HA       LEU  74  -3.213  -2.560  -4.325
  589   1HB   LEU  74          2HB       LEU  74  -2.173  -2.214  -2.189
  590   2HB   LEU  74          1HB       LEU  74  -0.575  -2.576  -2.834
  591    HG   LEU  74           HG       LEU  74  -2.030  -0.360  -4.174
  592   1HD1  LEU  74          1HD1      LEU  74  -2.041   1.144  -2.446
  593   2HD1  LEU  74          2HD1      LEU  74  -0.641   0.412  -1.661
  594   3HD1  LEU  74          3HD1      LEU  74  -2.236  -0.315  -1.478
  595   1HD2  LEU  74          1HD2      LEU  74   0.733  -0.153  -3.059
  596   2HD2  LEU  74          2HD2      LEU  74   0.110   0.374  -4.622
  597   3HD2  LEU  74          3HD2      LEU  74   0.475  -1.328  -4.348
  598    H    TYR  75           H        TYR  75   0.021  -3.807  -5.129
  599    HA   TYR  75           HA       TYR  75   0.678  -1.817  -7.085
  600   1HB   TYR  75          2HB       TYR  75   1.838  -4.216  -6.077
  601   2HB   TYR  75          1HB       TYR  75   1.756  -4.382  -7.830
  602    HD1  TYR  75           HD1      TYR  75   3.418  -3.388  -9.154
  603    HD2  TYR  75           HD2      TYR  75   2.712  -1.898  -5.187
  604    HE1  TYR  75           HE1      TYR  75   5.357  -1.861  -9.381
  605    HE2  TYR  75           HE2      TYR  75   4.651  -0.370  -5.416
  606    HH   TYR  75           HH       TYR  75   6.715  -0.208  -6.725
  607    H    ARG  76           H        ARG  76  -1.349  -4.650  -7.154
  608    HA   ARG  76           HA       ARG  76  -1.534  -4.928 -10.021
  609   1HB   ARG  76          2HB       ARG  76  -2.280  -6.588  -8.154
  610   2HB   ARG  76          1HB       ARG  76  -3.765  -5.640  -8.114
  611   1HG   ARG  76          2HG       ARG  76  -4.406  -7.118  -9.743
  612   2HG   ARG  76          1HG       ARG  76  -3.539  -5.991 -10.786
  613   1HD   ARG  76          2HD       ARG  76  -2.724  -8.193 -11.309
  614   2HD   ARG  76          1HD       ARG  76  -1.456  -7.381 -10.390
  615    HE   ARG  76           HE       ARG  76  -2.681  -8.651  -8.382
  616   1HH1  ARG  76          1HH1      ARG  76  -0.324 -10.030  -9.456
  617   2HH1  ARG  76          2HH1      ARG  76  -0.959 -11.558  -9.971
  618   1HH2  ARG  76          1HH2      ARG  76  -4.257 -10.491  -9.966
  619   2HH2  ARG  76          2HH2      ARG  76  -3.183 -11.818 -10.261
  620    H    LEU  77           H        LEU  77  -4.160  -3.860  -7.846
  621    HA   LEU  77           HA       LEU  77  -5.733  -2.557  -9.720
  622   1HB   LEU  77          2HB       LEU  77  -5.247  -1.988  -6.798
  623   2HB   LEU  77          1HB       LEU  77  -6.357  -0.991  -7.734
  624    HG   LEU  77           HG       LEU  77  -7.586  -2.797  -6.624
  625   1HD1  LEU  77          1HD1      LEU  77  -7.553  -3.773  -9.438
  626   2HD1  LEU  77          2HD1      LEU  77  -7.901  -2.062  -9.192
  627   3HD1  LEU  77          3HD1      LEU  77  -8.915  -3.285  -8.430
  628   1HD2  LEU  77          1HD2      LEU  77  -7.099  -5.102  -6.941
  629   2HD2  LEU  77          2HD2      LEU  77  -5.537  -4.350  -6.633
  630   3HD2  LEU  77          3HD2      LEU  77  -6.003  -4.770  -8.281
  631    H    LEU  78           H        LEU  78  -2.746  -1.361  -8.262
  632    HA   LEU  78           HA       LEU  78  -2.977   1.382  -8.996
  633   1HB   LEU  78          2HB       LEU  78  -1.172   0.649  -7.546
  634   2HB   LEU  78          1HB       LEU  78  -0.538  -0.409  -8.802
  635    HG   LEU  78           HG       LEU  78  -0.236   1.690 -10.233
  636   1HD1  LEU  78          1HD1      LEU  78  -1.694   3.206  -9.008
  637   2HD1  LEU  78          2HD1      LEU  78  -0.040   3.809  -8.905
  638   3HD1  LEU  78          3HD1      LEU  78  -0.758   2.968  -7.532
  639   1HD2  LEU  78          1HD2      LEU  78   1.836   2.368  -8.950
  640   2HD2  LEU  78          2HD2      LEU  78   1.685   0.633  -9.225
  641   3HD2  LEU  78          3HD2      LEU  78   1.295   1.313  -7.645
  642    H    GLU  79           H        GLU  79  -0.823  -0.876 -10.707
  643    HA   GLU  79           HA       GLU  79  -0.703   0.536 -13.134
  644   1HB   GLU  79          2HB       GLU  79  -0.652  -2.478 -12.758
  645   2HB   GLU  79          1HB       GLU  79  -0.081  -1.619 -14.190
  646   1HG   GLU  79          2HG       GLU  79   1.537  -0.371 -12.737
  647   2HG   GLU  79          1HG       GLU  79   1.026  -1.372 -11.376
  648    H    ALA  80           H        ALA  80  -3.014  -1.977 -12.143
  649    HA   ALA  80           HA       ALA  80  -4.552  -2.056 -14.540
  650   1HB   ALA  80          1HB       ALA  80  -6.388  -2.887 -12.941
  651   2HB   ALA  80          2HB       ALA  80  -5.194  -2.693 -11.659
  652   3HB   ALA  80          3HB       ALA  80  -4.890  -3.817 -12.983
  653    H    ARG  81           H        ARG  81  -4.220   0.453 -12.277
  654    HA   ARG  81           HA       ARG  81  -6.850   1.638 -13.082
  655   1HB   ARG  81          2HB       ARG  81  -6.396   1.334 -10.599
  656   2HB   ARG  81          1HB       ARG  81  -5.103   2.521 -10.766
  657   1HG   ARG  81          2HG       ARG  81  -7.824   3.204 -11.825
  658   2HG   ARG  81          1HG       ARG  81  -7.558   3.273 -10.084
  659   1HD   ARG  81          2HD       ARG  81  -6.542   5.266 -10.316
  660   2HD   ARG  81          1HD       ARG  81  -5.326   4.529 -11.357
  661    HE   ARG  81           HE       ARG  81  -6.432   5.483 -13.205
  662   1HH1  ARG  81          1HH1      ARG  81  -7.536   7.670 -11.611
  663   2HH1  ARG  81          2HH1      ARG  81  -9.245   7.515 -11.844
  664   1HH2  ARG  81          1HH2      ARG  81  -9.056   4.253 -13.005
  665   2HH2  ARG  81          2HH2      ARG  81 -10.107   5.579 -12.631
  666    H    THR  82           H        THR  82  -3.386   2.348 -12.609
  667    HA   THR  82           HA       THR  82  -3.534   4.990 -13.798
  668    HB   THR  82           HB       THR  82  -1.040   4.765 -13.946
  669    HG1  THR  82           HG1      THR  82  -1.690   2.166 -13.037
  670   1HG2  THR  82          1HG2      THR  82  -2.239   3.872 -11.308
  671   2HG2  THR  82          2HG2      THR  82  -2.144   5.542 -11.867
  672   3HG2  THR  82          3HG2      THR  82  -0.667   4.642 -11.525
  673    H    GLY  83           H        GLY  83  -2.722   1.763 -14.982
  674   1HA   GLY  83          2HA       GLY  83  -3.076   0.939 -17.194
  675   2HA   GLY  83          1HA       GLY  83  -3.427   2.585 -17.725
  676    H    LYS  84           H        LYS  84  -0.614   2.302 -15.798
  677    HA   LYS  84           HA       LYS  84   1.162   1.941 -18.145
  678   1HB   LYS  84          2HB       LYS  84   0.613   4.426 -17.810
  679   2HB   LYS  84          1HB       LYS  84   1.502   4.311 -16.292
  680   1HG   LYS  84          2HG       LYS  84   3.498   3.528 -17.510
  681   2HG   LYS  84          1HG       LYS  84   2.611   3.626 -19.032
  682   1HD   LYS  84          2HD       LYS  84   2.188   6.106 -18.371
  683   2HD   LYS  84          1HD       LYS  84   3.514   5.870 -17.232
  684   1HE   LYS  84          2HE       LYS  84   3.641   5.432 -20.230
  685   2HE   LYS  84          1HE       LYS  84   4.386   6.761 -19.343
  686   1HZ   LYS  84          1HZ       LYS  84   6.139   5.358 -19.402
  687   2HZ   LYS  84          2HZ       LYS  84   5.178   3.961 -19.515
  688   3HZ   LYS  84          3HZ       LYS  84   5.397   4.725 -18.014
  689    H    LYS  85           H        LYS  85   3.403   1.524 -17.464
  690    HA   LYS  85           HA       LYS  85   3.518  -0.118 -15.095
  691   1HB   LYS  85          2HB       LYS  85   5.944  -0.315 -15.636
  692   2HB   LYS  85          1HB       LYS  85   4.913  -0.650 -17.026
  693   1HG   LYS  85          2HG       LYS  85   5.251   2.011 -17.367
  694   2HG   LYS  85          1HG       LYS  85   6.760   1.633 -16.539
  695   1HD   LYS  85          2HD       LYS  85   7.290   1.319 -18.817
  696   2HD   LYS  85          1HD       LYS  85   6.971  -0.314 -18.234
  697   1HE   LYS  85          2HE       LYS  85   5.058  -0.523 -19.465
  698   2HE   LYS  85          1HE       LYS  85   4.603   1.165 -19.234
  699   1HZ   LYS  85          1HZ       LYS  85   6.523   1.690 -20.772
  700   2HZ   LYS  85          2HZ       LYS  85   5.157   0.972 -21.484
  701   3HZ   LYS  85          3HZ       LYS  85   6.542   0.040 -21.167
  702    H    ALA  86           H        ALA  86   3.202   1.020 -13.201
  703    HA   ALA  86           HA       ALA  86   4.137   3.627 -12.599
  704   1HB   ALA  86          1HB       ALA  86   3.866   2.945 -10.216
  705   2HB   ALA  86          2HB       ALA  86   3.677   1.272 -10.740
  706   3HB   ALA  86          3HB       ALA  86   2.480   2.481 -11.204
  707    H    GLU  87           H        GLU  87   5.734   0.509 -12.488
  708    HA   GLU  87           HA       GLU  87   7.996   1.146 -10.901
  709   1HB   GLU  87          2HB       GLU  87   7.988  -0.639 -13.351
  710   2HB   GLU  87          1HB       GLU  87   9.063  -0.745 -11.958
  711   1HG   GLU  87          2HG       GLU  87   7.578  -2.267 -11.164
  712   2HG   GLU  87          1HG       GLU  87   6.579  -0.869 -10.774
  713    H    GLU  88           H        GLU  88   7.329   1.729 -14.329
  714    HA   GLU  88           HA       GLU  88   8.427   3.050 -15.914
  715   1HB   GLU  88          2HB       GLU  88   9.273   4.356 -13.325
  716   2HB   GLU  88          1HB       GLU  88   9.846   4.956 -14.879
  717   1HG   GLU  88          2HG       GLU  88   6.914   4.553 -14.226
  718   2HG   GLU  88          1HG       GLU  88   7.754   6.091 -14.029
  719    H    LEU  89           H        LEU  89   9.874   0.708 -14.320
  720    HA   LEU  89           HA       LEU  89  12.559   1.253 -15.528
  721   1HB   LEU  89          2HB       LEU  89  12.194   1.052 -12.877
  722   2HB   LEU  89          1HB       LEU  89  12.307  -0.667 -13.253
  723    HG   LEU  89           HG       LEU  89  14.425  -0.027 -14.606
  724   1HD1  LEU  89          1HD1      LEU  89  15.557   2.011 -13.849
  725   2HD1  LEU  89          2HD1      LEU  89  14.203   2.395 -12.787
  726   3HD1  LEU  89          3HD1      LEU  89  13.987   2.424 -14.538
  727   1HD2  LEU  89          1HD2      LEU  89  15.818  -0.166 -12.579
  728   2HD2  LEU  89          2HD2      LEU  89  14.448  -1.271 -12.459
  729   3HD2  LEU  89          3HD2      LEU  89  14.427   0.259 -11.582
  730    H    VAL  90           H        VAL  90   9.802  -0.709 -15.525
  731    HA   VAL  90           HA       VAL  90   9.328  -2.821 -16.458
  732    HB   VAL  90           HB       VAL  90  11.653  -2.261 -18.307
  733   1HG1  VAL  90          1HG1      VAL  90  10.171  -3.288 -19.964
  734   2HG1  VAL  90          2HG1      VAL  90   8.875  -3.394 -18.773
  735   3HG1  VAL  90          3HG1      VAL  90  10.336  -4.362 -18.574
  736   1HG2  VAL  90          1HG2      VAL  90  10.620  -0.130 -18.245
  737   2HG2  VAL  90          2HG2      VAL  90   9.006  -0.823 -18.085
  738   3HG2  VAL  90          3HG2      VAL  90   9.862  -0.928 -19.623
  739    H    GLY  91           H        GLY  91  10.899  -3.111 -14.186
  740   1HA   GLY  91          2HA       GLY  91  12.302  -4.661 -13.126
  741   2HA   GLY  91          1HA       GLY  91  12.045  -5.693 -14.533
  742    H    SER  92           H        SER  92  13.922  -2.838 -13.497
  743    HA   SER  92           HA       SER  92  16.054  -2.096 -14.142
  744   1HB   SER  92          2HB       SER  92  16.578  -5.052 -14.552
  745   2HB   SER  92          1HB       SER  92  17.765  -3.800 -14.195
  746    HG   SER  92           HG       SER  92  15.873  -3.666 -12.354
  Start of MODEL    3
    1    HA   MET   1           HA       MET   1 -16.774  -1.763  -2.936
    2   1HB   MET   1          2HB       MET   1 -17.190  -0.699  -0.681
    3   2HB   MET   1          1HB       MET   1 -18.788  -0.233  -1.261
    4   1HG   MET   1          2HG       MET   1 -19.293  -2.263  -0.259
    5   2HG   MET   1          1HG       MET   1 -18.941  -2.807  -1.898
    6   1HE   MET   1          1HE       MET   1 -17.381  -1.940   1.529
    7   2HE   MET   1          2HE       MET   1 -16.621  -3.473   1.949
    8   3HE   MET   1          3HE       MET   1 -18.362  -3.402   1.699
    9    H    GLU   2           H        GLU   2 -19.722   0.250  -2.798
   10    HA   GLU   2           HA       GLU   2 -20.928  -1.441  -4.898
   11   1HB   GLU   2          2HB       GLU   2 -22.128  -0.645  -2.760
   12   2HB   GLU   2          1HB       GLU   2 -22.214   0.935  -3.540
   13   1HG   GLU   2          2HG       GLU   2 -23.219  -0.357  -5.560
   14   2HG   GLU   2          1HG       GLU   2 -23.491  -1.659  -4.400
   15    H    LYS   3           H        LYS   3 -19.891   1.907  -4.393
   16    HA   LYS   3           HA       LYS   3 -20.797   2.751  -7.052
   17   1HB   LYS   3          2HB       LYS   3 -18.892   4.240  -5.234
   18   2HB   LYS   3          1HB       LYS   3 -19.961   4.908  -6.467
   19   1HG   LYS   3          2HG       LYS   3 -21.883   3.880  -5.050
   20   2HG   LYS   3          1HG       LYS   3 -20.683   3.789  -3.761
   21   1HD   LYS   3          2HD       LYS   3 -21.461   6.307  -5.268
   22   2HD   LYS   3          1HD       LYS   3 -21.966   5.897  -3.629
   23   1HE   LYS   3          2HE       LYS   3 -19.139   6.433  -4.584
   24   2HE   LYS   3          1HE       LYS   3 -20.086   7.408  -3.462
   25   1HZ   LYS   3          1HZ       LYS   3 -18.968   4.702  -3.034
   26   2HZ   LYS   3          2HZ       LYS   3 -20.185   5.345  -2.038
   27   3HZ   LYS   3          3HZ       LYS   3 -18.673   6.113  -2.140
   28    H    GLY   4           H        GLY   4 -18.267   0.881  -6.011
   29   1HA   GLY   4          2HA       GLY   4 -16.516   0.024  -7.392
   30   2HA   GLY   4          1HA       GLY   4 -16.765   1.370  -8.505
   31    H    GLY   5           H        GLY   5 -16.541   3.555  -6.843
   32   1HA   GLY   5          2HA       GLY   5 -15.019   4.853  -5.585
   33   2HA   GLY   5          1HA       GLY   5 -14.166   3.368  -5.157
   34    H    GLU   6           H        GLU   6 -12.252   2.971  -6.178
   35    HA   GLU   6           HA       GLU   6 -11.715   4.273  -8.797
   36   1HB   GLU   6          2HB       GLU   6 -10.826   5.611  -6.727
   37   2HB   GLU   6          1HB       GLU   6  -9.610   4.336  -6.643
   38   1HG   GLU   6          2HG       GLU   6  -9.612   4.960  -9.330
   39   2HG   GLU   6          1HG       GLU   6  -9.890   6.533  -8.581
   40    H    ALA   7           H        ALA   7 -12.282   1.529  -8.007
   41    HA   ALA   7           HA       ALA   7 -11.522  -0.558  -8.765
   42   1HB   ALA   7          1HB       ALA   7  -8.752   0.464  -9.275
   43   2HB   ALA   7          2HB       ALA   7 -10.052   0.981 -10.349
   44   3HB   ALA   7          3HB       ALA   7  -9.686  -0.734 -10.169
   45    H    LEU   8           H        LEU   8  -9.175   1.361  -6.840
   46    HA   LEU   8           HA       LEU   8  -8.705  -1.064  -5.162
   47   1HB   LEU   8          2HB       LEU   8  -6.742  -0.090  -6.460
   48   2HB   LEU   8          1HB       LEU   8  -6.940   1.378  -5.519
   49    HG   LEU   8           HG       LEU   8  -5.197  -0.378  -4.735
   50   1HD1  LEU   8          1HD1      LEU   8  -5.253   0.946  -2.933
   51   2HD1  LEU   8          2HD1      LEU   8  -6.645   0.061  -2.313
   52   3HD1  LEU   8          3HD1      LEU   8  -6.883   1.464  -3.354
   53   1HD2  LEU   8          1HD2      LEU   8  -7.625  -1.604  -3.413
   54   2HD2  LEU   8          2HD2      LEU   8  -5.976  -2.226  -3.464
   55   3HD2  LEU   8          3HD2      LEU   8  -6.969  -2.245  -4.920
   56    H    LYS   9           H        LYS   9  -9.811   2.198  -5.382
   57    HA   LYS   9           HA       LYS   9  -9.472   3.332  -2.891
   58   1HB   LYS   9          2HB       LYS   9 -10.953   3.962  -5.062
   59   2HB   LYS   9          1HB       LYS   9 -12.238   3.513  -3.943
   60   1HG   LYS   9          2HG       LYS   9 -10.715   5.040  -2.301
   61   2HG   LYS   9          1HG       LYS   9 -10.357   5.812  -3.846
   62   1HD   LYS   9          2HD       LYS   9 -12.918   5.794  -4.226
   63   2HD   LYS   9          1HD       LYS   9 -13.035   5.474  -2.496
   64   1HE   LYS   9          2HE       LYS   9 -11.603   7.510  -2.099
   65   2HE   LYS   9          1HE       LYS   9 -11.728   7.866  -3.822
   66   1HZ   LYS   9          1HZ       LYS   9 -14.131   7.935  -3.598
   67   2HZ   LYS   9          2HZ       LYS   9 -13.399   9.056  -2.551
   68   3HZ   LYS   9          3HZ       LYS   9 -14.011   7.592  -1.941
   69    H    GLY  10           H        GLY  10 -11.331   3.672  -1.258
   70   1HA   GLY  10          2HA       GLY  10 -12.826   2.788   0.357
   71   2HA   GLY  10          1HA       GLY  10 -12.982   1.338  -0.638
   72    H    LEU  11           H        LEU  11  -9.819   1.543  -0.576
   73    HA   LEU  11           HA       LEU  11  -9.548  -0.047   1.940
   74   1HB   LEU  11          2HB       LEU  11  -8.300  -0.213  -0.769
   75   2HB   LEU  11          1HB       LEU  11  -7.292  -0.645   0.610
   76    HG   LEU  11           HG       LEU  11  -9.109  -2.206   1.372
   77   1HD1  LEU  11          1HD1      LEU  11 -10.728  -2.840  -0.547
   78   2HD1  LEU  11          2HD1      LEU  11 -10.314  -1.271  -1.236
   79   3HD1  LEU  11          3HD1      LEU  11 -11.073  -1.365   0.353
   80   1HD2  LEU  11          1HD2      LEU  11  -8.250  -2.834  -1.462
   81   2HD2  LEU  11          2HD2      LEU  11  -8.472  -3.954  -0.117
   82   3HD2  LEU  11          3HD2      LEU  11  -7.107  -2.838  -0.118
   83    H    THR  12           H        THR  12  -7.113   0.078   2.703
   84    HA   THR  12           HA       THR  12  -6.022   2.821   2.431
   85    HB   THR  12           HB       THR  12  -6.839   1.546   5.061
   86    HG1  THR  12           HG1      THR  12  -7.703   3.722   3.512
   87   1HG2  THR  12          1HG2      THR  12  -4.801   2.579   5.590
   88   2HG2  THR  12          2HG2      THR  12  -5.970   3.861   5.904
   89   3HG2  THR  12          3HG2      THR  12  -5.037   3.867   4.409
   90    H    PHE  13           H        PHE  13  -3.791   2.836   2.618
   91    HA   PHE  13           HA       PHE  13  -2.487   0.255   3.388
   92   1HB   PHE  13          2HB       PHE  13  -1.742   2.181   1.172
   93   2HB   PHE  13          1HB       PHE  13  -0.734   0.831   1.685
   94    HD1  PHE  13           HD1      PHE  13  -2.957  -1.188   2.254
   95    HD2  PHE  13           HD2      PHE  13  -2.303   1.492  -1.044
   96    HE1  PHE  13           HE1      PHE  13  -4.243  -2.699   0.771
   97    HE2  PHE  13           HE2      PHE  13  -3.588  -0.027  -2.522
   98    HZ   PHE  13           HZ       PHE  13  -4.567  -2.113  -1.620
   99    H    VAL  14           H        VAL  14  -1.118   0.465   5.051
  100    HA   VAL  14           HA       VAL  14  -0.072   3.197   5.689
  101    HB   VAL  14           HB       VAL  14  -0.529   0.922   7.634
  102   1HG1  VAL  14          1HG1      VAL  14  -0.158   3.883   8.116
  103   2HG1  VAL  14          2HG1      VAL  14   1.138   2.694   8.245
  104   3HG1  VAL  14          3HG1      VAL  14  -0.244   2.612   9.333
  105   1HG2  VAL  14          1HG2      VAL  14  -2.295   3.258   6.858
  106   2HG2  VAL  14          2HG2      VAL  14  -2.504   2.357   8.358
  107   3HG2  VAL  14          3HG2      VAL  14  -2.703   1.545   6.808
  108    H    ILE  15           H        ILE  15   2.075   3.321   6.506
  109    HA   ILE  15           HA       ILE  15   3.815   0.989   5.785
  110    HB   ILE  15           HB       ILE  15   4.753   3.843   6.049
  111   1HG1  ILE  15          2HG1      ILE  15   2.875   3.911   4.456
  112   2HG1  ILE  15          1HG1      ILE  15   4.407   4.148   3.622
  113   1HG2  ILE  15          1HG2      ILE  15   6.305   1.834   5.891
  114   2HG2  ILE  15          2HG2      ILE  15   6.574   3.118   4.718
  115   3HG2  ILE  15          3HG2      ILE  15   5.738   1.645   4.232
  116   1HD1  ILE  15          1HD1      ILE  15   2.734   1.627   3.712
  117   2HD1  ILE  15          2HD1      ILE  15   4.388   1.660   3.105
  118   3HD1  ILE  15          3HD1      ILE  15   3.134   2.601   2.300
  119    H    THR  16           H        THR  16   4.758   0.010   7.641
  120    HA   THR  16           HA       THR  16   4.473   1.239  10.224
  121    HB   THR  16           HB       THR  16   5.879  -1.188   9.121
  122    HG1  THR  16           HG1      THR  16   4.213  -1.099  11.359
  123   1HG2  THR  16          1HG2      THR  16   7.518  -0.860  10.687
  124   2HG2  THR  16          2HG2      THR  16   6.294  -1.514  11.772
  125   3HG2  THR  16          3HG2      THR  16   6.524   0.230  11.656
  126    H    GLY  17           H        GLY  17   5.463   3.356   9.745
  127   1HA   GLY  17          2HA       GLY  17   7.240   4.881   9.922
  128   2HA   GLY  17          1HA       GLY  17   8.172   3.571  10.653
  129    H    GLU  18           H        GLU  18   8.940   1.880   9.045
  130    HA   GLU  18           HA       GLU  18   9.316   2.793   6.288
  131   1HB   GLU  18          2HB       GLU  18  11.880   2.369   6.600
  132   2HB   GLU  18          1HB       GLU  18  11.218   3.929   7.085
  133   1HG   GLU  18          2HG       GLU  18  11.317   3.409   9.372
  134   2HG   GLU  18          1HG       GLU  18  11.371   1.671   9.074
  135    H    LEU  19           H        LEU  19   8.499   0.916   5.432
  136    HA   LEU  19           HA       LEU  19   8.819  -1.677   6.596
  137   1HB   LEU  19          2HB       LEU  19   8.319  -1.042   3.677
  138   2HB   LEU  19          1HB       LEU  19   7.953  -2.554   4.501
  139    HG   LEU  19           HG       LEU  19   6.760   0.048   5.449
  140   1HD1  LEU  19          1HD1      LEU  19   5.704  -1.809   3.298
  141   2HD1  LEU  19          2HD1      LEU  19   6.156  -0.117   3.092
  142   3HD1  LEU  19          3HD1      LEU  19   4.755  -0.543   4.076
  143   1HD2  LEU  19          1HD2      LEU  19   6.661  -1.993   6.883
  144   2HD2  LEU  19          2HD2      LEU  19   5.807  -2.823   5.581
  145   3HD2  LEU  19          3HD2      LEU  19   5.066  -1.437   6.379
  146    H    SER  20           H        SER  20  11.153   0.266   5.179
  147    HA   SER  20           HA       SER  20  13.431  -0.266   4.816
  148   1HB   SER  20          2HB       SER  20  12.884  -2.532   5.972
  149   2HB   SER  20          1HB       SER  20  12.728  -3.159   4.333
  150    HG   SER  20           HG       SER  20  14.819  -2.916   4.037
  151    H    ARG  21           H        ARG  21  11.076   0.163   2.983
  152    HA   ARG  21           HA       ARG  21  12.504  -0.463   0.437
  153   1HB   ARG  21          2HB       ARG  21   9.909  -1.459   1.330
  154   2HB   ARG  21          1HB       ARG  21   9.758  -0.544  -0.167
  155   1HG   ARG  21          2HG       ARG  21  11.788  -1.934  -0.986
  156   2HG   ARG  21          1HG       ARG  21  11.429  -2.998   0.374
  157   1HD   ARG  21          2HD       ARG  21   9.030  -3.085  -0.506
  158   2HD   ARG  21          1HD       ARG  21   9.646  -2.325  -1.973
  159    HE   ARG  21           HE       ARG  21  10.937  -4.837  -1.045
  160   1HH1  ARG  21          1HH2      ARG  21   8.300  -5.484  -2.208
  161   2HH1  ARG  21          2HH2      ARG  21   8.650  -5.638  -3.899
  162   1HH2  ARG  21          1HH1      ARG  21  11.696  -3.993  -3.687
  163   2HH2  ARG  21          2HH1      ARG  21  10.573  -4.794  -4.735
  164    HA   PRO  22           HA       PRO  22  11.492   3.720  -0.656
  165   1HB   PRO  22          2HB       PRO  22  10.281   3.632  -3.114
  166   2HB   PRO  22          1HB       PRO  22  12.014   3.345  -2.869
  167   1HG   PRO  22          2HG       PRO  22   9.807   1.384  -3.254
  168   2HG   PRO  22          1HG       PRO  22  11.457   1.369  -3.899
  169   1HD   PRO  22          2HD       PRO  22  10.700  -0.147  -1.761
  170   2HD   PRO  22          1HD       PRO  22  12.354   0.465  -1.963
  171    H    ARG  23           H        ARG  23   9.489   2.325   0.917
  172    HA   ARG  23           HA       ARG  23   6.826   2.559   0.269
  173   1HB   ARG  23          2HB       ARG  23   6.437   3.084   2.706
  174   2HB   ARG  23          1HB       ARG  23   7.455   1.678   2.402
  175   1HG   ARG  23          2HG       ARG  23   8.774   2.747   3.967
  176   2HG   ARG  23          1HG       ARG  23   9.394   3.518   2.511
  177   1HD   ARG  23          2HD       ARG  23   7.109   5.008   3.271
  178   2HD   ARG  23          1HD       ARG  23   8.024   4.725   4.750
  179    HE   ARG  23           HE       ARG  23   8.804   6.491   2.615
  180   1HH1  ARG  23          1HH1      ARG  23   9.857   4.490   5.211
  181   2HH1  ARG  23          2HH1      ARG  23  11.491   5.061   5.166
  182   1HH2  ARG  23          1HH2      ARG  23  10.984   7.111   2.418
  183   2HH2  ARG  23          2HH2      ARG  23  12.128   6.543   3.587
  184    H    GLU  24           H        GLU  24   9.007   5.220   0.452
  185    HA   GLU  24           HA       GLU  24   6.914   7.213   1.008
  186   1HB   GLU  24          2HB       GLU  24   9.757   7.191   1.018
  187   2HB   GLU  24          1HB       GLU  24   9.272   8.339  -0.228
  188   1HG   GLU  24          2HG       GLU  24   7.747   9.430   1.416
  189   2HG   GLU  24          1HG       GLU  24   8.346   8.333   2.661
  190    H    GLU  25           H        GLU  25   9.089   6.615  -1.720
  191    HA   GLU  25           HA       GLU  25   7.785   8.138  -3.691
  192   1HB   GLU  25          2HB       GLU  25   9.976   6.866  -3.946
  193   2HB   GLU  25          1HB       GLU  25   9.010   5.418  -4.234
  194   1HG   GLU  25          2HG       GLU  25   8.083   6.289  -6.228
  195   2HG   GLU  25          1HG       GLU  25   8.553   7.941  -5.827
  196    H    VAL  26           H        VAL  26   7.201   4.700  -2.876
  197    HA   VAL  26           HA       VAL  26   5.024   4.355  -4.697
  198    HB   VAL  26           HB       VAL  26   6.361   2.563  -3.373
  199   1HG1  VAL  26          1HG1      VAL  26   5.481   1.891  -1.251
  200   2HG1  VAL  26          2HG1      VAL  26   4.113   2.994  -1.392
  201   3HG1  VAL  26          3HG1      VAL  26   5.737   3.632  -1.147
  202   1HG2  VAL  26          1HG2      VAL  26   3.510   2.630  -4.182
  203   2HG2  VAL  26          2HG2      VAL  26   3.963   1.288  -3.132
  204   3HG2  VAL  26          3HG2      VAL  26   4.793   1.523  -4.669
  205    H    LYS  27           H        LYS  27   5.197   5.669  -1.415
  206    HA   LYS  27           HA       LYS  27   2.449   5.615  -0.747
  207   1HB   LYS  27          2HB       LYS  27   4.372   6.418   0.732
  208   2HB   LYS  27          1HB       LYS  27   4.277   7.949  -0.131
  209   1HG   LYS  27          2HG       LYS  27   2.733   8.525   1.422
  210   2HG   LYS  27          1HG       LYS  27   1.637   7.487   0.516
  211   1HD   LYS  27          2HD       LYS  27   3.396   6.534   2.798
  212   2HD   LYS  27          1HD       LYS  27   1.699   6.969   2.974
  213   1HE   LYS  27          2HE       LYS  27   2.855   4.700   1.329
  214   2HE   LYS  27          1HE       LYS  27   1.781   4.579   2.722
  215   1HZ   LYS  27          1HZ       LYS  27   1.070   4.760   0.052
  216   2HZ   LYS  27          2HZ       LYS  27   0.613   6.232   0.762
  217   3HZ   LYS  27          3HZ       LYS  27   0.041   4.767   1.398
  218    H    ALA  28           H        ALA  28   4.274   7.856  -2.800
  219    HA   ALA  28           HA       ALA  28   2.094   9.688  -3.258
  220   1HB   ALA  28          1HB       ALA  28   4.553  10.120  -3.769
  221   2HB   ALA  28          2HB       ALA  28   3.438  10.555  -5.064
  222   3HB   ALA  28          3HB       ALA  28   4.367   9.060  -5.166
  223    H    LEU  29           H        LEU  29   3.214   6.703  -4.770
  224    HA   LEU  29           HA       LEU  29   1.279   6.783  -6.949
  225   1HB   LEU  29          2HB       LEU  29   3.440   5.049  -6.041
  226   2HB   LEU  29          1HB       LEU  29   2.028   4.110  -6.513
  227    HG   LEU  29           HG       LEU  29   1.960   5.388  -8.673
  228   1HD1  LEU  29          1HD1      LEU  29   3.116   7.415  -7.983
  229   2HD1  LEU  29          2HD1      LEU  29   4.048   6.651  -9.271
  230   3HD1  LEU  29          3HD1      LEU  29   4.572   6.497  -7.593
  231   1HD2  LEU  29          1HD2      LEU  29   3.044   3.204  -8.619
  232   2HD2  LEU  29          2HD2      LEU  29   4.532   3.920  -7.999
  233   3HD2  LEU  29          3HD2      LEU  29   3.995   4.285  -9.638
  234    H    LEU  30           H        LEU  30   1.300   5.711  -3.630
  235    HA   LEU  30           HA       LEU  30  -1.013   3.965  -3.804
  236   1HB   LEU  30          2HB       LEU  30   0.725   5.073  -1.679
  237   2HB   LEU  30          1HB       LEU  30  -0.935   4.753  -1.187
  238    HG   LEU  30           HG       LEU  30  -0.709   2.441  -2.136
  239   1HD1  LEU  30          1HD1      LEU  30   2.233   3.143  -2.287
  240   2HD1  LEU  30          2HD1      LEU  30   1.177   3.022  -3.692
  241   3HD1  LEU  30          3HD1      LEU  30   1.497   1.598  -2.703
  242   1HD2  LEU  30          1HD2      LEU  30  -0.208   3.162   0.307
  243   2HD2  LEU  30          2HD2      LEU  30   1.485   2.926  -0.126
  244   3HD2  LEU  30          3HD2      LEU  30   0.354   1.575  -0.219
  245    H    ARG  31           H        ARG  31  -0.523   7.321  -2.674
  246    HA   ARG  31           HA       ARG  31  -3.212   7.900  -1.992
  247   1HB   ARG  31          2HB       ARG  31  -1.083   9.342  -1.666
  248   2HB   ARG  31          1HB       ARG  31  -1.379   9.912  -3.309
  249   1HG   ARG  31          2HG       ARG  31  -3.657  10.625  -2.642
  250   2HG   ARG  31          1HG       ARG  31  -3.335  10.082  -0.996
  251   1HD   ARG  31          2HD       ARG  31  -1.210  11.656  -1.250
  252   2HD   ARG  31          1HD       ARG  31  -2.217  12.439  -2.467
  253    HE   ARG  31           HE       ARG  31  -3.625  13.225  -0.732
  254   1HH1  ARG  31          1HH1      ARG  31  -1.045  13.101   0.904
  255   2HH1  ARG  31          2HH1      ARG  31  -1.598  12.293   2.332
  256   1HH2  ARG  31          1HH2      ARG  31  -4.537  11.170   0.874
  257   2HH2  ARG  31          2HH2      ARG  31  -3.578  11.199   2.315
  258    H    ARG  32           H        ARG  32  -1.513   8.176  -5.067
  259    HA   ARG  32           HA       ARG  32  -3.664   9.263  -6.619
  260   1HB   ARG  32          2HB       ARG  32  -1.116   8.786  -7.224
  261   2HB   ARG  32          1HB       ARG  32  -1.778   7.275  -7.846
  262   1HG   ARG  32          2HG       ARG  32  -1.908   8.694  -9.712
  263   2HG   ARG  32          1HG       ARG  32  -3.530   8.810  -9.030
  264   1HD   ARG  32          2HD       ARG  32  -2.901  11.060  -9.426
  265   2HD   ARG  32          1HD       ARG  32  -2.628  10.830  -7.699
  266    HE   ARG  32           HE       ARG  32  -0.234  10.213  -9.170
  267   1HH1  ARG  32          1HH1      ARG  32  -1.706  12.958  -9.940
  268   2HH1  ARG  32          2HH1      ARG  32  -0.672  14.046  -9.075
  269   1HH2  ARG  32          1HH2      ARG  32   0.883  11.541  -7.251
  270   2HH2  ARG  32          2HH2      ARG  32   0.792  13.245  -7.553
  271    H    LEU  33           H        LEU  33  -2.909   6.050  -5.509
  272    HA   LEU  33           HA       LEU  33  -4.738   4.595  -7.191
  273   1HB   LEU  33          2HB       LEU  33  -2.739   3.800  -5.656
  274   2HB   LEU  33          1HB       LEU  33  -4.008   3.649  -4.443
  275    HG   LEU  33           HG       LEU  33  -5.273   2.154  -5.882
  276   1HD1  LEU  33          1HD1      LEU  33  -3.242   3.016  -7.902
  277   2HD1  LEU  33          2HD1      LEU  33  -4.976   2.759  -8.095
  278   3HD1  LEU  33          3HD1      LEU  33  -3.886   1.378  -8.010
  279   1HD2  LEU  33          1HD2      LEU  33  -3.622   1.062  -4.510
  280   2HD2  LEU  33          2HD2      LEU  33  -2.336   1.468  -5.646
  281   3HD2  LEU  33          3HD2      LEU  33  -3.572   0.294  -6.097
  282    H    GLY  34           H        GLY  34  -5.607   6.968  -5.147
  283   1HA   GLY  34          2HA       GLY  34  -7.767   7.503  -4.366
  284   2HA   GLY  34          1HA       GLY  34  -8.301   5.891  -4.837
  285    H    ALA  35           H        ALA  35  -6.637   4.259  -3.359
  286    HA   ALA  35           HA       ALA  35  -7.868   4.126  -0.838
  287   1HB   ALA  35          1HB       ALA  35  -6.763   2.162  -1.210
  288   2HB   ALA  35          2HB       ALA  35  -5.482   2.952  -0.291
  289   3HB   ALA  35          3HB       ALA  35  -5.431   2.952  -2.054
  290    H    LYS  36           H        LYS  36  -7.416   4.969   1.184
  291    HA   LYS  36           HA       LYS  36  -5.941   7.441   1.332
  292   1HB   LYS  36          2HB       LYS  36  -7.286   5.638   3.330
  293   2HB   LYS  36          1HB       LYS  36  -6.245   6.942   3.901
  294   1HG   LYS  36          2HG       LYS  36  -7.573   8.599   2.729
  295   2HG   LYS  36          1HG       LYS  36  -8.535   7.340   1.955
  296   1HD   LYS  36          2HD       LYS  36  -9.898   8.034   3.748
  297   2HD   LYS  36          1HD       LYS  36  -9.111   6.586   4.373
  298   1HE   LYS  36          2HE       LYS  36  -7.484   7.916   5.580
  299   2HE   LYS  36          1HE       LYS  36  -8.075   9.399   4.832
  300   1HZ   LYS  36          1HZ       LYS  36  -9.242   7.803   6.974
  301   2HZ   LYS  36          2HZ       LYS  36 -10.323   8.509   5.872
  302   3HZ   LYS  36          3HZ       LYS  36  -9.243   9.484   6.750
  303    H    VAL  37           H        VAL  37  -3.956   7.830   2.567
  304    HA   VAL  37           HA       VAL  37  -2.261   5.381   2.863
  305    HB   VAL  37           HB       VAL  37  -0.352   6.736   2.138
  306   1HG1  VAL  37          1HG1      VAL  37  -2.612   7.163   0.169
  307   2HG1  VAL  37          2HG1      VAL  37  -1.896   5.579   0.466
  308   3HG1  VAL  37          3HG1      VAL  37  -0.907   6.885  -0.187
  309   1HG2  VAL  37          1HG2      VAL  37  -0.851   9.037   1.178
  310   2HG2  VAL  37          2HG2      VAL  37  -0.968   8.926   2.934
  311   3HG2  VAL  37          3HG2      VAL  37  -2.432   8.936   1.952
  312    H    THR  38           H        THR  38  -0.760   5.433   4.616
  313    HA   THR  38           HA       THR  38  -0.603   7.710   6.421
  314    HB   THR  38           HB       THR  38  -1.561   5.631   8.135
  315    HG1  THR  38           HG1      THR  38  -3.474   6.346   6.192
  316   1HG2  THR  38          1HG2      THR  38  -1.614   8.156   8.407
  317   2HG2  THR  38          2HG2      THR  38  -3.101   7.318   8.854
  318   3HG2  THR  38          3HG2      THR  38  -2.995   8.162   7.309
  319    H    ASP  39           H        ASP  39   0.304   6.465   8.713
  320    HA   ASP  39           HA       ASP  39   2.256   4.399   7.888
  321   1HB   ASP  39          2HB       ASP  39   4.149   5.690   8.841
  322   2HB   ASP  39          1HB       ASP  39   3.425   6.518   7.461
  323    H    SER  40           H        SER  40   0.032   5.469  10.086
  324    HA   SER  40           HA       SER  40   1.196   3.746  12.216
  325   1HB   SER  40          2HB       SER  40  -0.093   6.453  12.692
  326   2HB   SER  40          1HB       SER  40   0.494   5.355  13.937
  327    HG   SER  40           HG       SER  40   2.256   6.055  11.896
  328    H    VAL  41           H        VAL  41  -0.764   3.623  14.007
  329    HA   VAL  41           HA       VAL  41  -3.353   3.343  12.566
  330    HB   VAL  41           HB       VAL  41  -3.680   1.077  13.480
  331   1HG1  VAL  41          1HG1      VAL  41  -1.044   1.225  11.986
  332   2HG1  VAL  41          2HG1      VAL  41  -2.608   1.477  11.214
  333   3HG1  VAL  41          3HG1      VAL  41  -2.226  -0.082  11.943
  334   1HG2  VAL  41          1HG2      VAL  41  -0.821   1.435  14.447
  335   2HG2  VAL  41          2HG2      VAL  41  -1.681  -0.106  14.435
  336   3HG2  VAL  41          3HG2      VAL  41  -2.253   1.214  15.453
  337    H    SER  42           H        SER  42  -5.182   3.251  13.992
  338    HA   SER  42           HA       SER  42  -4.627   3.809  16.859
  339   1HB   SER  42          2HB       SER  42  -4.904   5.998  15.736
  340   2HB   SER  42          1HB       SER  42  -6.461   5.472  15.102
  341    HG   SER  42           HG       SER  42  -6.526   6.720  17.098
  342    H    ARG  43           H        ARG  43  -7.301   3.438  14.494
  343    HA   ARG  43           HA       ARG  43  -8.341   1.075  15.742
  344   1HB   ARG  43          2HB       ARG  43  -8.867   3.154  17.360
  345   2HB   ARG  43          1HB       ARG  43 -10.228   3.334  16.255
  346   1HG   ARG  43          2HG       ARG  43 -10.570   0.776  16.622
  347   2HG   ARG  43          1HG       ARG  43  -9.552   1.005  18.044
  348   1HD   ARG  43          2HD       ARG  43 -11.080   2.614  18.978
  349   2HD   ARG  43          1HD       ARG  43 -12.016   2.677  17.485
  350    HE   ARG  43           HE       ARG  43 -12.391   0.114  18.047
  351   1HH1  ARG  43          1HH2      ARG  43 -14.304   2.207  19.158
  352   2HH1  ARG  43          2HH2      ARG  43 -14.374   1.747  20.827
  353   1HH2  ARG  43          1HH1      ARG  43 -11.546  -0.251  20.668
  354   2HH2  ARG  43          2HH1      ARG  43 -12.812   0.356  21.681
  355    H    LYS  44           H        LYS  44  -7.925   2.599  13.087
  356    HA   LYS  44           HA       LYS  44 -10.205   1.464  11.718
  357   1HB   LYS  44          2HB       LYS  44 -10.925   3.793  12.808
  358   2HB   LYS  44          1HB       LYS  44 -10.106   4.441  11.388
  359   1HG   LYS  44          2HG       LYS  44 -11.523   3.111   9.910
  360   2HG   LYS  44          1HG       LYS  44 -12.289   2.336  11.297
  361   1HD   LYS  44          2HD       LYS  44 -13.782   4.071  10.582
  362   2HD   LYS  44          1HD       LYS  44 -13.009   4.655  12.055
  363   1HE   LYS  44          2HE       LYS  44 -11.675   5.285   9.455
  364   2HE   LYS  44          1HE       LYS  44 -13.149   6.168   9.851
  365   1HZ   LYS  44          1HZ       LYS  44 -11.853   7.470  11.076
  366   2HZ   LYS  44          2HZ       LYS  44 -10.531   6.406  10.976
  367   3HZ   LYS  44          3HZ       LYS  44 -11.718   6.182  12.171
  368    H    THR  45           H        THR  45  -7.185   1.724  11.698
  369    HA   THR  45           HA       THR  45  -6.922   2.061   8.775
  370    HB   THR  45           HB       THR  45  -5.026   3.554  10.600
  371    HG1  THR  45           HG1      THR  45  -7.030   4.470  10.925
  372   1HG2  THR  45          1HG2      THR  45  -4.010   4.164   8.682
  373   2HG2  THR  45          2HG2      THR  45  -5.543   4.601   7.931
  374   3HG2  THR  45          3HG2      THR  45  -4.982   2.930   7.880
  375    H    SER  46           H        SER  46  -6.758  -0.197  10.610
  376    HA   SER  46           HA       SER  46  -3.894  -0.779  10.904
  377   1HB   SER  46          2HB       SER  46  -5.629  -1.491  12.556
  378   2HB   SER  46          1HB       SER  46  -6.232  -2.637  11.367
  379    HG   SER  46           HG       SER  46  -3.537  -2.491  12.251
  380    H    TYR  47           H        TYR  47  -3.453  -0.611   8.626
  381    HA   TYR  47           HA       TYR  47  -3.639  -3.225   7.274
  382   1HB   TYR  47          2HB       TYR  47  -4.503  -0.679   5.862
  383   2HB   TYR  47          1HB       TYR  47  -4.494  -2.308   5.189
  384    HD1  TYR  47           HD1      TYR  47  -6.304   0.096   7.230
  385    HD2  TYR  47           HD2      TYR  47  -6.062  -4.046   6.113
  386    HE1  TYR  47           HE1      TYR  47  -8.600  -0.271   8.091
  387    HE2  TYR  47           HE2      TYR  47  -8.359  -4.412   6.975
  388    HH   TYR  47           HH       TYR  47  -9.864  -3.249   8.744
  389    H    LEU  48           H        LEU  48  -1.592  -3.621   6.484
  390    HA   LEU  48           HA       LEU  48   0.082  -1.236   5.815
  391   1HB   LEU  48          2HB       LEU  48   1.530  -1.897   7.404
  392   2HB   LEU  48          1HB       LEU  48   0.587  -3.345   7.726
  393    HG   LEU  48           HG       LEU  48   2.442  -3.233   5.332
  394   1HD1  LEU  48          1HD1      LEU  48   4.304  -3.720   6.586
  395   2HD1  LEU  48          2HD1      LEU  48   3.373  -4.411   7.913
  396   3HD1  LEU  48          3HD1      LEU  48   3.474  -2.661   7.723
  397   1HD2  LEU  48          1HD2      LEU  48   2.164  -5.691   6.917
  398   2HD2  LEU  48          2HD2      LEU  48   1.955  -5.449   5.183
  399   3HD2  LEU  48          3HD2      LEU  48   0.623  -5.112   6.289
  400    H    VAL  49           H        VAL  49   1.299  -1.367   3.953
  401    HA   VAL  49           HA       VAL  49   0.522  -3.532   2.084
  402    HB   VAL  49           HB       VAL  49   2.123  -1.974   0.582
  403   1HG1  VAL  49          1HG1      VAL  49  -0.163  -2.423   0.002
  404   2HG1  VAL  49          2HG1      VAL  49   0.031  -0.671   0.004
  405   3HG1  VAL  49          3HG1      VAL  49  -0.754  -1.474   1.364
  406   1HG2  VAL  49          1HG2      VAL  49   2.649  -0.524   2.579
  407   2HG2  VAL  49          2HG2      VAL  49   0.950  -0.051   2.618
  408   3HG2  VAL  49          3HG2      VAL  49   1.949   0.360   1.224
  409    H    VAL  50           H        VAL  50   1.826  -5.324   2.090
  410    HA   VAL  50           HA       VAL  50   4.235  -5.592   3.440
  411    HB   VAL  50           HB       VAL  50   3.366  -6.986   0.885
  412   1HG1  VAL  50          1HG1      VAL  50   5.682  -7.464   1.089
  413   2HG1  VAL  50          2HG1      VAL  50   4.886  -8.827   1.876
  414   3HG1  VAL  50          3HG1      VAL  50   5.595  -7.539   2.848
  415   1HG2  VAL  50          1HG2      VAL  50   3.178  -7.898   3.771
  416   2HG2  VAL  50          2HG2      VAL  50   2.462  -8.672   2.358
  417   3HG2  VAL  50          3HG2      VAL  50   1.850  -7.115   2.914
  418    H    GLY  51           H        GLY  51   6.447  -5.934   2.457
  419   1HA   GLY  51          2HA       GLY  51   6.999  -4.218   0.104
  420   2HA   GLY  51          1HA       GLY  51   7.758  -3.752   1.623
  421    H    GLU  52           H        GLU  52   9.289  -5.275   2.593
  422    HA   GLU  52           HA       GLU  52  10.547  -7.030   0.523
  423   1HB   GLU  52          2HB       GLU  52  11.688  -4.881   1.578
  424   2HB   GLU  52          1HB       GLU  52  12.062  -5.994   2.891
  425   1HG   GLU  52          2HG       GLU  52  13.151  -7.531   1.314
  426   2HG   GLU  52          1HG       GLU  52  12.724  -6.473  -0.031
  427    H    ASN  53           H        ASN  53  12.331  -7.760   2.981
  428    HA   ASN  53           HA       ASN  53  10.495  -9.841   4.108
  429   1HB   ASN  53          2HB       ASN  53  13.109 -10.118   2.779
  430   2HB   ASN  53          1HB       ASN  53  12.991 -10.980   4.315
  431   1HD2  ASN  53          1HD2      ASN  53  10.979 -10.450   1.357
  432   2HD2  ASN  53          2HD2      ASN  53  10.395 -12.042   1.296
  433    HA   PRO  54           HA       PRO  54  13.466  -8.790   7.676
  434   1HB   PRO  54          2HB       PRO  54  15.663  -7.231   7.230
  435   2HB   PRO  54          1HB       PRO  54  15.670  -8.990   7.007
  436   1HG   PRO  54          2HG       PRO  54  15.528  -6.827   4.986
  437   2HG   PRO  54          1HG       PRO  54  16.313  -8.412   4.898
  438   1HD   PRO  54          2HD       PRO  54  13.866  -7.797   3.732
  439   2HD   PRO  54          1HD       PRO  54  14.423  -9.437   4.120
  440    H    GLY  55           H        GLY  55  11.745  -6.850   5.881
  441   1HA   GLY  55          2HA       GLY  55  12.351  -4.179   6.667
  442   2HA   GLY  55          1HA       GLY  55  10.777  -4.738   6.112
  443    H    SER  56           H        SER  56  11.023  -2.834   8.152
  444    HA   SER  56           HA       SER  56  10.848  -4.051  10.780
  445   1HB   SER  56          2HB       SER  56  11.438  -1.653  10.420
  446   2HB   SER  56          1HB       SER  56   9.806  -1.361   9.827
  447    HG   SER  56           HG       SER  56   9.019  -1.965  11.852
  448    H    LYS  57           H        LYS  57   8.830  -4.101   8.127
  449    HA   LYS  57           HA       LYS  57   6.223  -3.776   9.186
  450   1HB   LYS  57          2HB       LYS  57   5.480  -5.123   7.296
  451   2HB   LYS  57          1HB       LYS  57   6.782  -4.060   6.767
  452   1HG   LYS  57          2HG       LYS  57   8.396  -5.932   7.089
  453   2HG   LYS  57          1HG       LYS  57   7.043  -6.989   7.496
  454   1HD   LYS  57          2HD       LYS  57   6.025  -6.358   5.252
  455   2HD   LYS  57          1HD       LYS  57   7.567  -5.598   4.858
  456   1HE   LYS  57          2HE       LYS  57   7.181  -8.507   5.627
  457   2HE   LYS  57          1HE       LYS  57   7.484  -7.907   3.997
  458   1HZ   LYS  57          1HZ       LYS  57   9.312  -8.254   6.202
  459   2HZ   LYS  57          2HZ       LYS  57   9.476  -6.771   5.390
  460   3HZ   LYS  57          3HZ       LYS  57   9.616  -8.231   4.535
  461    H    LEU  58           H        LEU  58   8.564  -6.261   9.733
  462    HA   LEU  58           HA       LEU  58   7.097  -8.552  10.279
  463   1HB   LEU  58          2HB       LEU  58   9.658  -7.880  10.688
  464   2HB   LEU  58          1HB       LEU  58   9.089  -7.732  12.350
  465    HG   LEU  58           HG       LEU  58   8.380 -10.177  10.745
  466   1HD1  LEU  58          1HD1      LEU  58  10.818  -9.931  10.507
  467   2HD1  LEU  58          2HD1      LEU  58  10.435 -11.269  11.590
  468   3HD1  LEU  58          3HD1      LEU  58  10.975  -9.727  12.252
  469   1HD2  LEU  58          1HD2      LEU  58   8.379  -9.285  13.573
  470   2HD2  LEU  58          2HD2      LEU  58   8.918 -10.944  13.311
  471   3HD2  LEU  58          3HD2      LEU  58   7.324 -10.438  12.755
  472    H    GLU  59           H        GLU  59   7.003  -5.527  12.017
  473    HA   GLU  59           HA       GLU  59   5.732  -6.642  14.395
  474   1HB   GLU  59          2HB       GLU  59   7.068  -4.505  14.385
  475   2HB   GLU  59          1HB       GLU  59   5.764  -3.756  13.464
  476   1HG   GLU  59          2HG       GLU  59   5.362  -3.216  15.767
  477   2HG   GLU  59          1HG       GLU  59   4.190  -4.462  15.337
  478    H    LYS  60           H        LYS  60   4.446  -4.350  11.921
  479    HA   LYS  60           HA       LYS  60   1.720  -5.046  12.694
  480   1HB   LYS  60          2HB       LYS  60   2.321  -2.788  11.829
  481   2HB   LYS  60          1HB       LYS  60   2.668  -3.511  10.256
  482   1HG   LYS  60          2HG       LYS  60   0.382  -4.236   9.998
  483   2HG   LYS  60          1HG       LYS  60  -0.005  -3.786  11.659
  484   1HD   LYS  60          2HD       LYS  60   0.489  -1.408  11.097
  485   2HD   LYS  60          1HD       LYS  60   0.766  -1.887   9.423
  486   1HE   LYS  60          2HE       LYS  60  -1.810  -1.937  10.988
  487   2HE   LYS  60          1HE       LYS  60  -1.486  -1.181   9.429
  488   1HZ   LYS  60          1HZ       LYS  60  -2.747  -3.202   9.137
  489   2HZ   LYS  60          2HZ       LYS  60  -1.577  -4.099   9.980
  490   3HZ   LYS  60          3HZ       LYS  60  -1.196  -3.401   8.479
  491    H    ALA  61           H        ALA  61   3.890  -5.902  10.021
  492    HA   ALA  61           HA       ALA  61   1.937  -7.267   8.441
  493   1HB   ALA  61          1HB       ALA  61   4.877  -7.947   8.635
  494   2HB   ALA  61          2HB       ALA  61   4.231  -6.626   7.661
  495   3HB   ALA  61          3HB       ALA  61   3.788  -8.291   7.290
  496    H    ARG  62           H        ARG  62   4.067  -8.428  11.100
  497    HA   ARG  62           HA       ARG  62   3.210 -11.171  10.883
  498   1HB   ARG  62          2HB       ARG  62   5.219 -10.505  12.183
  499   2HB   ARG  62          1HB       ARG  62   4.188  -9.640  13.322
  500   1HG   ARG  62          2HG       ARG  62   4.725 -11.828  14.247
  501   2HG   ARG  62          1HG       ARG  62   3.015 -11.791  13.829
  502   1HD   ARG  62          2HD       ARG  62   4.888 -12.723  11.709
  503   2HD   ARG  62          1HD       ARG  62   4.637 -13.805  13.078
  504    HE   ARG  62           HE       ARG  62   2.386 -12.772  11.395
  505   1HH1  ARG  62          1HH1      ARG  62   4.040 -15.535  11.423
  506   2HH1  ARG  62          2HH1      ARG  62   2.783 -16.565  12.023
  507   1HH2  ARG  62          1HH2      ARG  62   0.721 -13.944  12.970
  508   2HH2  ARG  62          2HH2      ARG  62   0.905 -15.664  12.898
  509    H    ALA  63           H        ALA  63   2.014  -8.294  12.520
  510    HA   ALA  63           HA       ALA  63  -0.021  -7.808  13.510
  511   1HB   ALA  63          1HB       ALA  63  -0.715 -10.044  11.633
  512   2HB   ALA  63          2HB       ALA  63  -1.173  -8.345  11.563
  513   3HB   ALA  63          3HB       ALA  63  -1.940  -9.416  12.735
  514    H    LEU  64           H        LEU  64  -1.348  -8.334  15.236
  515    HA   LEU  64           HA       LEU  64  -0.815 -10.935  16.613
  516   1HB   LEU  64          2HB       LEU  64  -1.084  -9.603  18.771
  517   2HB   LEU  64          1HB       LEU  64   0.398  -9.271  17.877
  518    HG   LEU  64           HG       LEU  64  -1.896  -7.584  17.092
  519   1HD1  LEU  64          1HD1      LEU  64  -2.338  -7.720  19.500
  520   2HD1  LEU  64          2HD1      LEU  64  -1.694  -6.130  19.096
  521   3HD1  LEU  64          3HD1      LEU  64  -0.652  -7.338  19.849
  522   1HD2  LEU  64          1HD2      LEU  64   0.962  -7.000  17.936
  523   2HD2  LEU  64          2HD2      LEU  64  -0.142  -5.847  17.188
  524   3HD2  LEU  64          3HD2      LEU  64   0.416  -7.249  16.277
  525    H    GLY  65           H        GLY  65  -2.932  -9.600  14.821
  526   1HA   GLY  65          2HA       GLY  65  -5.246 -10.833  15.351
  527   2HA   GLY  65          1HA       GLY  65  -5.310  -9.544  16.561
  528    H    VAL  66           H        VAL  66  -3.590  -7.950  14.569
  529    HA   VAL  66           HA       VAL  66  -5.847  -6.640  13.233
  530    HB   VAL  66           HB       VAL  66  -3.901  -5.125  12.393
  531   1HG1  VAL  66          1HG1      VAL  66  -3.829  -3.982  14.608
  532   2HG1  VAL  66          2HG1      VAL  66  -4.576  -5.404  15.338
  533   3HG1  VAL  66          3HG1      VAL  66  -5.465  -4.452  14.148
  534   1HG2  VAL  66          1HG2      VAL  66  -1.818  -5.307  13.513
  535   2HG2  VAL  66          2HG2      VAL  66  -2.209  -6.963  13.053
  536   3HG2  VAL  66          3HG2      VAL  66  -2.466  -6.425  14.713
  537    HA   PRO  67           HA       PRO  67  -4.976  -8.405   9.246
  538   1HB   PRO  67          2HB       PRO  67  -6.299  -6.601   7.683
  539   2HB   PRO  67          1HB       PRO  67  -7.120  -7.747   8.758
  540   1HG   PRO  67          2HG       PRO  67  -6.853  -4.859   9.000
  541   2HG   PRO  67          1HG       PRO  67  -7.951  -5.962   9.840
  542   1HD   PRO  67          2HD       PRO  67  -5.456  -4.804  10.809
  543   2HD   PRO  67          1HD       PRO  67  -6.658  -5.763  11.702
  544    H    THR  68           H        THR  68  -3.579  -8.308   7.503
  545    HA   THR  68           HA       THR  68  -2.087  -5.751   6.994
  546    HB   THR  68           HB       THR  68  -0.076  -7.143   6.579
  547    HG1  THR  68           HG1      THR  68  -0.836  -9.370   7.805
  548   1HG2  THR  68          1HG2      THR  68  -0.046  -6.313   8.754
  549   2HG2  THR  68          2HG2      THR  68   0.066  -8.048   9.044
  550   3HG2  THR  68          3HG2      THR  68  -1.479  -7.224   9.232
  551    H    LEU  69           H        LEU  69  -2.089  -5.203   4.785
  552    HA   LEU  69           HA       LEU  69  -3.207  -7.261   2.928
  553   1HB   LEU  69          2HB       LEU  69  -3.724  -4.430   3.332
  554   2HB   LEU  69          1HB       LEU  69  -3.278  -4.760   1.657
  555    HG   LEU  69           HG       LEU  69  -4.959  -6.698   1.754
  556   1HD1  LEU  69          1HD1      LEU  69  -5.785  -5.151   4.231
  557   2HD1  LEU  69          2HD1      LEU  69  -5.208  -6.817   4.184
  558   3HD1  LEU  69          3HD1      LEU  69  -6.759  -6.401   3.457
  559   1HD2  LEU  69          1HD2      LEU  69  -6.875  -5.170   1.347
  560   2HD2  LEU  69          2HD2      LEU  69  -5.409  -4.605   0.545
  561   3HD2  LEU  69          3HD2      LEU  69  -5.946  -3.841   2.042
  562    H    THR  70           H        THR  70  -1.951  -7.997   1.303
  563    HA   THR  70           HA       THR  70   0.813  -7.225   1.069
  564    HB   THR  70           HB       THR  70  -0.724  -8.679  -1.076
  565    HG1  THR  70           HG1      THR  70  -0.812 -10.437   0.164
  566   1HG2  THR  70          1HG2      THR  70   1.369  -9.868  -1.363
  567   2HG2  THR  70          2HG2      THR  70   2.042  -9.119   0.085
  568   3HG2  THR  70          3HG2      THR  70   1.717  -8.140  -1.345
  569    H    GLU  71           H        GLU  71   1.816  -5.909  -0.447
  570    HA   GLU  71           HA       GLU  71   0.258  -3.817  -1.678
  571   1HB   GLU  71          2HB       GLU  71   2.771  -3.842  -0.915
  572   2HB   GLU  71          1HB       GLU  71   3.067  -4.472  -2.535
  573   1HG   GLU  71          2HG       GLU  71   2.085  -2.536  -3.561
  574   2HG   GLU  71          1HG       GLU  71   1.463  -1.957  -2.016
  575    H    GLU  72           H        GLU  72   1.211  -6.975  -2.690
  576    HA   GLU  72           HA       GLU  72   1.412  -6.826  -5.465
  577   1HB   GLU  72          2HB       GLU  72   0.036  -8.870  -3.710
  578   2HB   GLU  72          1HB       GLU  72   0.186  -9.085  -5.455
  579   1HG   GLU  72          2HG       GLU  72   2.643  -8.374  -3.892
  580   2HG   GLU  72          1HG       GLU  72   2.044 -10.030  -3.805
  581    H    GLU  73           H        GLU  73  -1.644  -7.115  -3.615
  582    HA   GLU  73           HA       GLU  73  -3.431  -6.944  -5.799
  583   1HB   GLU  73          2HB       GLU  73  -3.937  -7.393  -3.308
  584   2HB   GLU  73          1HB       GLU  73  -3.962  -5.639  -3.123
  585   1HG   GLU  73          2HG       GLU  73  -5.666  -5.544  -4.979
  586   2HG   GLU  73          1HG       GLU  73  -5.728  -7.306  -4.936
  587    H    LEU  74           H        LEU  74  -1.933  -4.346  -3.882
  588    HA   LEU  74           HA       LEU  74  -3.258  -2.142  -5.070
  589   1HB   LEU  74          2HB       LEU  74  -1.975  -1.565  -3.208
  590   2HB   LEU  74          1HB       LEU  74  -0.594  -2.519  -3.733
  591    HG   LEU  74           HG       LEU  74  -1.334  -0.318  -5.563
  592   1HD1  LEU  74          1HD1      LEU  74  -0.295   1.407  -4.128
  593   2HD1  LEU  74          2HD1      LEU  74  -0.204   0.242  -2.807
  594   3HD1  LEU  74          3HD1      LEU  74  -1.773   0.772  -3.409
  595   1HD2  LEU  74          1HD2      LEU  74   0.913  -0.366  -6.031
  596   2HD2  LEU  74          2HD2      LEU  74   0.801  -1.966  -5.299
  597   3HD2  LEU  74          3HD2      LEU  74   1.365  -0.596  -4.343
  598    H    TYR  75           H        TYR  75  -0.283  -3.840  -6.075
  599    HA   TYR  75           HA       TYR  75   0.327  -2.164  -8.298
  600   1HB   TYR  75          2HB       TYR  75   1.086  -4.874  -7.379
  601   2HB   TYR  75          1HB       TYR  75   1.223  -4.615  -9.118
  602    HD1  TYR  75           HD1      TYR  75   2.644  -3.899  -5.865
  603    HD2  TYR  75           HD2      TYR  75   2.561  -2.634  -9.969
  604    HE1  TYR  75           HE1      TYR  75   4.741  -2.624  -5.514
  605    HE2  TYR  75           HE2      TYR  75   4.658  -1.358  -9.619
  606    HH   TYR  75           HH       TYR  75   5.818  -0.492  -6.725
  607    H    ARG  76           H        ARG  76  -1.984  -4.783  -7.905
  608    HA   ARG  76           HA       ARG  76  -2.510  -5.228 -10.696
  609   1HB   ARG  76          2HB       ARG  76  -4.298  -5.600  -8.272
  610   2HB   ARG  76          1HB       ARG  76  -4.686  -6.174  -9.892
  611   1HG   ARG  76          2HG       ARG  76  -2.525  -7.475  -9.867
  612   2HG   ARG  76          1HG       ARG  76  -2.342  -7.025  -8.171
  613   1HD   ARG  76          2HD       ARG  76  -4.360  -8.176  -7.558
  614   2HD   ARG  76          1HD       ARG  76  -4.805  -8.418  -9.248
  615    HE   ARG  76           HE       ARG  76  -2.469  -9.754  -9.189
  616   1HH1  ARG  76          1HH1      ARG  76  -5.286 -10.989  -8.694
  617   2HH1  ARG  76          2HH1      ARG  76  -4.938 -11.987  -7.322
  618   1HH2  ARG  76          1HH2      ARG  76  -1.903 -10.456  -6.645
  619   2HH2  ARG  76          2HH2      ARG  76  -3.024 -11.685  -6.164
  620    H    LEU  77           H        LEU  77  -4.819  -3.697  -8.439
  621    HA   LEU  77           HA       LEU  77  -6.312  -2.336 -10.381
  622   1HB   LEU  77          2HB       LEU  77  -5.717  -1.393  -7.555
  623   2HB   LEU  77          1HB       LEU  77  -6.999  -0.765  -8.581
  624    HG   LEU  77           HG       LEU  77  -8.066  -2.363  -7.195
  625   1HD1  LEU  77          1HD1      LEU  77  -8.942  -3.921  -8.732
  626   2HD1  LEU  77          2HD1      LEU  77  -7.417  -4.050  -9.609
  627   3HD1  LEU  77          3HD1      LEU  77  -8.394  -2.588  -9.749
  628   1HD2  LEU  77          1HD2      LEU  77  -5.646  -3.423  -6.733
  629   2HD2  LEU  77          2HD2      LEU  77  -6.242  -4.618  -7.885
  630   3HD2  LEU  77          3HD2      LEU  77  -7.134  -4.306  -6.396
  631    H    LEU  78           H        LEU  78  -3.259  -1.343  -8.887
  632    HA   LEU  78           HA       LEU  78  -3.261   1.346  -9.916
  633   1HB   LEU  78          2HB       LEU  78  -1.753   0.500  -8.089
  634   2HB   LEU  78          1HB       LEU  78  -0.854  -0.400  -9.309
  635    HG   LEU  78           HG       LEU  78  -1.242   2.397 -10.071
  636   1HD1  LEU  78          1HD1      LEU  78  -1.156   2.726  -7.621
  637   2HD1  LEU  78          2HD1      LEU  78   0.300   3.346  -8.399
  638   3HD1  LEU  78          3HD1      LEU  78   0.342   1.799  -7.552
  639   1HD2  LEU  78          1HD2      LEU  78   1.231   2.217 -10.384
  640   2HD2  LEU  78          2HD2      LEU  78   0.355   0.901 -11.167
  641   3HD2  LEU  78          3HD2      LEU  78   1.183   0.621  -9.635
  642    H    GLU  79           H        GLU  79  -1.205  -1.362 -11.004
  643    HA   GLU  79           HA       GLU  79  -0.348  -0.297 -13.426
  644   1HB   GLU  79          2HB       GLU  79  -1.051  -3.162 -12.741
  645   2HB   GLU  79          1HB       GLU  79  -0.282  -2.707 -14.262
  646   1HG   GLU  79          2HG       GLU  79   1.628  -1.782 -13.100
  647   2HG   GLU  79          1HG       GLU  79   0.838  -1.989 -11.537
  648    H    ALA  80           H        ALA  80  -3.541  -1.539 -12.664
  649    HA   ALA  80           HA       ALA  80  -4.397  -1.528 -15.482
  650   1HB   ALA  80          1HB       ALA  80  -6.644  -2.026 -14.510
  651   2HB   ALA  80          2HB       ALA  80  -5.951  -1.869 -12.895
  652   3HB   ALA  80          3HB       ALA  80  -5.409  -3.161 -13.966
  653    H    ARG  81           H        ARG  81  -5.622   0.158 -12.575
  654    HA   ARG  81           HA       ARG  81  -7.112   2.172 -13.737
  655   1HB   ARG  81          2HB       ARG  81  -5.353   2.168 -11.300
  656   2HB   ARG  81          1HB       ARG  81  -6.123   3.670 -11.807
  657   1HG   ARG  81          2HG       ARG  81  -7.839   1.231 -11.694
  658   2HG   ARG  81          1HG       ARG  81  -7.344   1.945 -10.160
  659   1HD   ARG  81          2HD       ARG  81  -9.410   3.006 -10.747
  660   2HD   ARG  81          1HD       ARG  81  -8.142   4.183 -11.080
  661    HE   ARG  81           HE       ARG  81  -8.561   3.922 -13.414
  662   1HH1  ARG  81          1HH2      ARG  81 -11.418   3.664 -12.456
  663   2HH1  ARG  81          2HH2      ARG  81 -11.941   2.244 -13.298
  664   1HH2  ARG  81          1HH1      ARG  81  -8.728   1.207 -14.088
  665   2HH2  ARG  81          2HH1      ARG  81 -10.418   0.853 -14.223
  666    H    THR  82           H        THR  82  -3.597   2.396 -13.101
  667    HA   THR  82           HA       THR  82  -3.279   4.894 -14.507
  668    HB   THR  82           HB       THR  82  -1.117   2.809 -14.152
  669    HG1  THR  82           HG1      THR  82  -1.531   2.955 -12.109
  670   1HG2  THR  82          1HG2      THR  82  -1.079   5.839 -14.051
  671   2HG2  THR  82          2HG2      THR  82  -0.617   4.873 -15.452
  672   3HG2  THR  82          3HG2      THR  82   0.323   4.773 -13.964
  673    H    GLY  83           H        GLY  83  -2.585   1.520 -15.389
  674   1HA   GLY  83          2HA       GLY  83  -2.860   0.501 -17.523
  675   2HA   GLY  83          1HA       GLY  83  -3.302   2.075 -18.187
  676    H    LYS  84           H        LYS  84  -0.435   1.966 -16.257
  677    HA   LYS  84           HA       LYS  84   1.313   1.608 -18.620
  678   1HB   LYS  84          2HB       LYS  84   0.874   4.025 -18.576
  679   2HB   LYS  84          1HB       LYS  84   1.305   4.092 -16.866
  680   1HG   LYS  84          2HG       LYS  84   3.590   3.525 -17.328
  681   2HG   LYS  84          1HG       LYS  84   3.216   3.109 -19.001
  682   1HD   LYS  84          2HD       LYS  84   2.552   5.874 -18.076
  683   2HD   LYS  84          1HD       LYS  84   4.250   5.487 -18.353
  684   1HE   LYS  84          2HE       LYS  84   3.732   4.741 -20.634
  685   2HE   LYS  84          1HE       LYS  84   2.019   5.063 -20.365
  686   1HZ   LYS  84          1HZ       LYS  84   3.506   6.835 -21.504
  687   2HZ   LYS  84          2HZ       LYS  84   3.978   7.207 -19.914
  688   3HZ   LYS  84          3HZ       LYS  84   2.345   7.318 -20.366
  689    H    LYS  85           H        LYS  85   3.382   0.865 -18.012
  690    HA   LYS  85           HA       LYS  85   3.594  -0.509 -15.518
  691   1HB   LYS  85          2HB       LYS  85   5.664   0.273 -17.581
  692   2HB   LYS  85          1HB       LYS  85   6.049  -0.704 -16.164
  693   1HG   LYS  85          2HG       LYS  85   4.701  -2.495 -16.872
  694   2HG   LYS  85          1HG       LYS  85   3.765  -1.479 -17.969
  695   1HD   LYS  85          2HD       LYS  85   6.705  -1.753 -18.462
  696   2HD   LYS  85          1HD       LYS  85   5.658  -3.105 -18.893
  697   1HE   LYS  85          2HE       LYS  85   4.258  -1.592 -20.254
  698   2HE   LYS  85          1HE       LYS  85   5.309  -0.240 -19.831
  699   1HZ   LYS  85          1HZ       LYS  85   7.167  -1.669 -20.768
  700   2HZ   LYS  85          2HZ       LYS  85   6.085  -0.981 -21.883
  701   3HZ   LYS  85          3HZ       LYS  85   5.947  -2.621 -21.461
  702    H    ALA  86           H        ALA  86   3.766   0.478 -13.561
  703    HA   ALA  86           HA       ALA  86   4.451   3.163 -13.079
  704   1HB   ALA  86          1HB       ALA  86   4.760   0.716 -11.313
  705   2HB   ALA  86          2HB       ALA  86   3.402   1.840 -11.348
  706   3HB   ALA  86          3HB       ALA  86   4.968   2.370 -10.735
  707    H    GLU  87           H        GLU  87   6.503   0.410 -13.691
  708    HA   GLU  87           HA       GLU  87   8.946   1.488 -12.614
  709   1HB   GLU  87          2HB       GLU  87   8.827  -0.401 -14.964
  710   2HB   GLU  87          1HB       GLU  87  10.047  -0.302 -13.694
  711   1HG   GLU  87          2HG       GLU  87   7.207  -1.330 -13.448
  712   2HG   GLU  87          1HG       GLU  87   8.704  -2.228 -13.195
  713    H    GLU  88           H        GLU  88   7.117   2.218 -15.449
  714    HA   GLU  88           HA       GLU  88   8.930   2.992 -17.388
  715   1HB   GLU  88          2HB       GLU  88   6.388   4.244 -16.403
  716   2HB   GLU  88          1HB       GLU  88   7.354   5.114 -17.595
  717   1HG   GLU  88          2HG       GLU  88   6.947   2.237 -18.170
  718   2HG   GLU  88          1HG       GLU  88   5.492   3.231 -18.243
  719    H    LEU  89           H        LEU  89   8.505   4.413 -14.238
  720    HA   LEU  89           HA       LEU  89  10.261   6.710 -14.868
  721   1HB   LEU  89          2HB       LEU  89   9.400   6.055 -12.070
  722   2HB   LEU  89          1HB       LEU  89   9.585   7.629 -12.843
  723    HG   LEU  89           HG       LEU  89   7.384   5.634 -13.470
  724   1HD1  LEU  89          1HD1      LEU  89   7.150   6.622 -11.221
  725   2HD1  LEU  89          2HD1      LEU  89   5.911   7.238 -12.314
  726   3HD1  LEU  89          3HD1      LEU  89   7.309   8.236 -11.912
  727   1HD2  LEU  89          1HD2      LEU  89   6.427   7.774 -14.571
  728   2HD2  LEU  89          2HD2      LEU  89   7.733   6.946 -15.417
  729   3HD2  LEU  89          3HD2      LEU  89   8.073   8.400 -14.480
  730    H    VAL  90           H        VAL  90  10.278   4.344 -12.180
  731    HA   VAL  90           HA       VAL  90  13.141   4.562 -11.836
  732    HB   VAL  90           HB       VAL  90  11.106   2.590 -10.765
  733   1HG1  VAL  90          1HG1      VAL  90  14.072   2.887 -10.243
  734   2HG1  VAL  90          2HG1      VAL  90  13.178   1.424 -10.657
  735   3HG1  VAL  90          3HG1      VAL  90  12.989   2.149  -9.062
  736   1HG2  VAL  90          1HG2      VAL  90  10.831   4.901  -9.977
  737   2HG2  VAL  90          2HG2      VAL  90  12.538   4.969  -9.534
  738   3HG2  VAL  90          3HG2      VAL  90  11.443   3.887  -8.671
  739    H    GLY  91           H        GLY  91  14.755   3.320 -12.714
  740   1HA   GLY  91          2HA       GLY  91  14.832   0.711 -13.510
  741   2HA   GLY  91          1HA       GLY  91  14.047   1.481 -14.891
  742    H    SER  92           H        SER  92  15.312   3.780 -15.301
  743    HA   SER  92           HA       SER  92  17.232   4.662 -16.318
  744   1HB   SER  92          2HB       SER  92  18.274   3.358 -13.814
  745   2HB   SER  92          1HB       SER  92  19.394   4.092 -14.957
  746    HG   SER  92           HG       SER  92  18.589   6.028 -14.523
  Start of MODEL    4
    1    HA   MET   1           HA       MET   1 -19.048   7.735  -9.903
    2   1HB   MET   1          2HB       MET   1 -19.508   6.652  -7.109
    3   2HB   MET   1          1HB       MET   1 -20.711   7.338  -8.202
    4   1HG   MET   1          2HG       MET   1 -19.909   5.418  -9.820
    5   2HG   MET   1          1HG       MET   1 -19.343   4.668  -8.328
    6   1HE   MET   1          1HE       MET   1 -21.150   3.049  -9.861
    7   2HE   MET   1          2HE       MET   1 -21.955   4.362 -10.716
    8   3HE   MET   1          3HE       MET   1 -22.903   3.247  -9.736
    9    H    GLU   2           H        GLU   2 -19.179   9.903  -9.505
   10    HA   GLU   2           HA       GLU   2 -18.677  12.000  -8.605
   11   1HB   GLU   2          2HB       GLU   2 -18.590  10.405  -6.023
   12   2HB   GLU   2          1HB       GLU   2 -18.645  12.164  -6.128
   13   1HG   GLU   2          2HG       GLU   2 -20.794  11.982  -7.391
   14   2HG   GLU   2          1HG       GLU   2 -20.755  10.235  -7.141
   15    H    LYS   3           H        LYS   3 -16.733  10.269  -6.206
   16    HA   LYS   3           HA       LYS   3 -14.377  11.826  -6.942
   17   1HB   LYS   3          2HB       LYS   3 -15.015   9.738  -4.873
   18   2HB   LYS   3          1HB       LYS   3 -13.333  10.148  -5.201
   19   1HG   LYS   3          2HG       LYS   3 -13.890  11.648  -3.490
   20   2HG   LYS   3          1HG       LYS   3 -14.135  12.621  -4.940
   21   1HD   LYS   3          2HD       LYS   3 -16.551  12.064  -4.895
   22   2HD   LYS   3          1HD       LYS   3 -16.299  11.130  -3.420
   23   1HE   LYS   3          2HE       LYS   3 -16.259  14.095  -3.820
   24   2HE   LYS   3          1HE       LYS   3 -16.946  13.152  -2.499
   25   1HZ   LYS   3          1HZ       LYS   3 -15.031  14.233  -1.666
   26   2HZ   LYS   3          2HZ       LYS   3 -14.084  13.753  -2.993
   27   3HZ   LYS   3          3HZ       LYS   3 -14.610  12.601  -1.860
   28    H    GLY   4           H        GLY   4 -15.738   9.394  -8.553
   29   1HA   GLY   4          2HA       GLY   4 -14.994   7.775 -10.042
   30   2HA   GLY   4          1HA       GLY   4 -13.499   8.709 -10.101
   31    H    GLY   5           H        GLY   5 -11.983   7.163  -9.933
   32   1HA   GLY   5          2HA       GLY   5 -10.608   5.532  -8.951
   33   2HA   GLY   5          1HA       GLY   5 -11.350   5.978  -7.415
   34    H    GLU   6           H        GLU   6 -10.784   3.343  -7.703
   35    HA   GLU   6           HA       GLU   6 -13.072   1.950  -7.098
   36   1HB   GLU   6          2HB       GLU   6 -12.936   2.449  -9.980
   37   2HB   GLU   6          1HB       GLU   6 -12.948   0.724  -9.617
   38   1HG   GLU   6          2HG       GLU   6 -15.070   0.775  -8.744
   39   2HG   GLU   6          1HG       GLU   6 -14.876   2.402  -8.091
   40    H    ALA   7           H        ALA   7 -10.130   1.841  -9.029
   41    HA   ALA   7           HA       ALA   7  -9.327  -0.741  -9.036
   42   1HB   ALA   7          1HB       ALA   7  -7.380   0.218  -9.614
   43   2HB   ALA   7          2HB       ALA   7  -7.106   0.703  -7.941
   44   3HB   ALA   7          3HB       ALA   7  -7.990   1.768  -9.034
   45    H    LEU   8           H        LEU   8  -8.056   1.139  -6.288
   46    HA   LEU   8           HA       LEU   8  -8.937  -1.050  -4.465
   47   1HB   LEU   8          2HB       LEU   8  -6.667  -0.784  -3.310
   48   2HB   LEU   8          1HB       LEU   8  -6.657  -1.618  -4.861
   49    HG   LEU   8           HG       LEU   8  -6.147   0.672  -5.914
   50   1HD1  LEU   8          1HD1      LEU   8  -4.780   1.978  -3.974
   51   2HD1  LEU   8          2HD1      LEU   8  -6.091   1.303  -3.007
   52   3HD1  LEU   8          3HD1      LEU   8  -6.454   2.350  -4.380
   53   1HD2  LEU   8          1HD2      LEU   8  -3.929  -0.120  -4.066
   54   2HD2  LEU   8          2HD2      LEU   8  -3.879   0.213  -5.797
   55   3HD2  LEU   8          3HD2      LEU   8  -4.530  -1.317  -5.212
   56    H    LYS   9           H        LYS   9  -9.065   2.151  -5.175
   57    HA   LYS   9           HA       LYS   9  -8.496   3.583  -2.845
   58   1HB   LYS   9          2HB       LYS   9 -10.197   5.194  -3.556
   59   2HB   LYS   9          1HB       LYS   9  -9.304   4.609  -4.958
   60   1HG   LYS   9          2HG       LYS   9 -11.304   4.104  -5.871
   61   2HG   LYS   9          1HG       LYS   9 -11.400   2.785  -4.704
   62   1HD   LYS   9          2HD       LYS   9 -12.433   4.400  -3.071
   63   2HD   LYS   9          1HD       LYS   9 -12.476   5.600  -4.364
   64   1HE   LYS   9          2HE       LYS   9 -13.974   4.264  -5.675
   65   2HE   LYS   9          1HE       LYS   9 -13.743   2.863  -4.629
   66   1HZ   LYS   9          1HZ       LYS   9 -15.805   3.901  -4.077
   67   2HZ   LYS   9          2HZ       LYS   9 -15.064   5.422  -3.912
   68   3HZ   LYS   9          3HZ       LYS   9 -14.720   4.182  -2.803
   69    H    GLY  10           H        GLY  10 -10.436   4.597  -1.438
   70   1HA   GLY  10          2HA       GLY  10 -12.161   4.229   0.123
   71   2HA   GLY  10          1HA       GLY  10 -12.567   2.746  -0.740
   72    H    LEU  11           H        LEU  11  -9.567   2.024  -0.445
   73    HA   LEU  11           HA       LEU  11  -9.887   0.752   2.222
   74   1HB   LEU  11          2HB       LEU  11  -8.047   0.226  -0.124
   75   2HB   LEU  11          1HB       LEU  11  -7.821  -0.550   1.442
   76    HG   LEU  11           HG       LEU  11 -10.547  -0.640   0.201
   77   1HD1  LEU  11          1HD1      LEU  11  -8.102  -2.101  -0.767
   78   2HD1  LEU  11          2HD1      LEU  11  -9.416  -1.390  -1.705
   79   3HD1  LEU  11          3HD1      LEU  11  -9.677  -2.895  -0.823
   80   1HD2  LEU  11          1HD2      LEU  11 -10.026  -1.528   2.495
   81   2HD2  LEU  11          2HD2      LEU  11  -8.918  -2.680   1.749
   82   3HD2  LEU  11          3HD2      LEU  11 -10.643  -2.759   1.392
   83    H    THR  12           H        THR  12  -7.954   0.663   3.623
   84    HA   THR  12           HA       THR  12  -6.355   3.186   3.446
   85    HB   THR  12           HB       THR  12  -7.464   1.687   5.835
   86    HG1  THR  12           HG1      THR  12  -7.657   4.387   4.990
   87   1HG2  THR  12          1HG2      THR  12  -6.261   3.671   7.064
   88   2HG2  THR  12          2HG2      THR  12  -5.226   3.688   5.637
   89   3HG2  THR  12          3HG2      THR  12  -5.333   2.236   6.632
   90    H    PHE  13           H        PHE  13  -4.178   2.882   3.325
   91    HA   PHE  13           HA       PHE  13  -3.118   0.166   4.001
   92   1HB   PHE  13          2HB       PHE  13  -2.347   2.127   1.832
   93   2HB   PHE  13          1HB       PHE  13  -1.257   0.841   2.346
   94    HD1  PHE  13           HD1      PHE  13  -2.947  -1.460   2.822
   95    HD2  PHE  13           HD2      PHE  13  -3.296   1.550  -0.228
   96    HE1  PHE  13           HE1      PHE  13  -4.156  -3.067   1.372
   97    HE2  PHE  13           HE2      PHE  13  -4.506  -0.062  -1.673
   98    HZ   PHE  13           HZ       PHE  13  -4.940  -2.366  -0.876
   99    H    VAL  14           H        VAL  14  -1.660   0.131   5.626
  100    HA   VAL  14           HA       VAL  14  -0.483   2.736   6.511
  101    HB   VAL  14           HB       VAL  14  -0.841   0.215   8.152
  102   1HG1  VAL  14          1HG1      VAL  14  -0.398   3.071   9.032
  103   2HG1  VAL  14          2HG1      VAL  14   0.899   1.889   8.862
  104   3HG1  VAL  14          3HG1      VAL  14  -0.381   1.627  10.044
  105   1HG2  VAL  14          1HG2      VAL  14  -2.860   1.108   9.030
  106   2HG2  VAL  14          2HG2      VAL  14  -3.000   1.362   7.292
  107   3HG2  VAL  14          3HG2      VAL  14  -2.547   2.700   8.345
  108    H    ILE  15           H        ILE  15   1.701   2.844   6.948
  109    HA   ILE  15           HA       ILE  15   3.343   0.497   6.079
  110    HB   ILE  15           HB       ILE  15   5.032   2.547   5.719
  111   1HG1  ILE  15          2HG1      ILE  15   2.295   3.753   5.189
  112   2HG1  ILE  15          1HG1      ILE  15   3.327   4.192   6.549
  113   1HG2  ILE  15          1HG2      ILE  15   4.067   0.823   4.079
  114   2HG2  ILE  15          2HG2      ILE  15   4.546   2.377   3.398
  115   3HG2  ILE  15          3HG2      ILE  15   2.843   2.034   3.704
  116   1HD1  ILE  15          1HD1      ILE  15   4.655   4.282   3.914
  117   2HD1  ILE  15          2HD1      ILE  15   4.720   5.432   5.247
  118   3HD1  ILE  15          3HD1      ILE  15   3.359   5.458   4.129
  119    H    THR  16           H        THR  16   4.687  -0.304   7.694
  120    HA   THR  16           HA       THR  16   4.586   0.835  10.307
  121    HB   THR  16           HB       THR  16   6.194  -1.311   8.968
  122    HG1  THR  16           HG1      THR  16   5.027  -2.436  10.777
  123   1HG2  THR  16          1HG2      THR  16   6.680  -0.008  11.605
  124   2HG2  THR  16          2HG2      THR  16   7.825  -0.749  10.487
  125   3HG2  THR  16          3HG2      THR  16   6.824  -1.763  11.522
  126    H    GLY  17           H        GLY  17   5.432   2.933  10.402
  127   1HA   GLY  17          2HA       GLY  17   7.057   4.654  10.089
  128   2HA   GLY  17          1HA       GLY  17   7.995   3.504  11.045
  129    H    GLU  18           H        GLU  18   6.831   3.048   7.741
  130    HA   GLU  18           HA       GLU  18   7.966   3.007   5.715
  131   1HB   GLU  18          2HB       GLU  18  10.569   3.506   7.176
  132   2HB   GLU  18          1HB       GLU  18  10.228   3.744   5.466
  133   1HG   GLU  18          2HG       GLU  18   8.325   5.352   6.513
  134   2HG   GLU  18          1HG       GLU  18   9.538   5.472   7.787
  135    H    LEU  19           H        LEU  19   7.932   1.005   4.975
  136    HA   LEU  19           HA       LEU  19   9.000  -1.246   6.480
  137   1HB   LEU  19          2HB       LEU  19   8.386  -1.535   3.570
  138   2HB   LEU  19          1HB       LEU  19   7.952  -2.584   4.915
  139    HG   LEU  19           HG       LEU  19   6.446  -0.504   5.621
  140   1HD1  LEU  19          1HD1      LEU  19   5.723  -0.014   2.903
  141   2HD1  LEU  19          2HD1      LEU  19   7.460   0.257   3.041
  142   3HD1  LEU  19          3HD1      LEU  19   6.345   1.140   4.083
  143   1HD2  LEU  19          1HD2      LEU  19   5.673  -2.807   5.016
  144   2HD2  LEU  19          2HD2      LEU  19   5.683  -2.330   3.319
  145   3HD2  LEU  19          3HD2      LEU  19   4.579  -1.547   4.450
  146    H    SER  20           H        SER  20  10.204  -2.772   4.415
  147    HA   SER  20           HA       SER  20  12.823  -1.425   4.183
  148   1HB   SER  20          2HB       SER  20  13.156  -3.674   4.711
  149   2HB   SER  20          1HB       SER  20  11.793  -4.213   3.739
  150    HG   SER  20           HG       SER  20  14.351  -3.336   2.890
  151    H    ARG  21           H        ARG  21  10.030  -1.292   2.493
  152    HA   ARG  21           HA       ARG  21  11.275  -1.267  -0.213
  153   1HB   ARG  21          2HB       ARG  21   8.597  -1.773   0.870
  154   2HB   ARG  21          1HB       ARG  21   8.569  -0.651  -0.488
  155   1HG   ARG  21          2HG       ARG  21   8.368  -2.937  -1.325
  156   2HG   ARG  21          1HG       ARG  21   9.929  -2.277  -1.810
  157   1HD   ARG  21          2HD       ARG  21   9.979  -3.611   0.813
  158   2HD   ARG  21          1HD       ARG  21   9.573  -4.688  -0.523
  159    HE   ARG  21           HE       ARG  21  12.154  -3.337  -0.114
  160   1HH1  ARG  21          1HH1      ARG  21   9.999  -4.407  -2.553
  161   2HH1  ARG  21          2HH1      ARG  21  11.231  -5.154  -3.514
  162   1HH2  ARG  21          1HH2      ARG  21  13.761  -4.554  -1.222
  163   2HH2  ARG  21          2HH2      ARG  21  13.357  -5.237  -2.761
  164    HA   PRO  22           HA       PRO  22  11.231   3.145  -0.497
  165   1HB   PRO  22          2HB       PRO  22  10.087   3.692  -2.924
  166   2HB   PRO  22          1HB       PRO  22  11.709   2.998  -2.744
  167   1HG   PRO  22          2HG       PRO  22   9.145   1.658  -3.422
  168   2HG   PRO  22          1HG       PRO  22  10.776   1.363  -4.046
  169   1HD   PRO  22          2HD       PRO  22   9.580  -0.218  -2.145
  170   2HD   PRO  22          1HD       PRO  22  11.340  -0.027  -2.293
  171    H    ARG  23           H        ARG  23   9.198   2.401   1.135
  172    HA   ARG  23           HA       ARG  23   6.555   2.916   0.720
  173   1HB   ARG  23          2HB       ARG  23   6.341   3.400   3.008
  174   2HB   ARG  23          1HB       ARG  23   7.832   2.465   2.924
  175   1HG   ARG  23          2HG       ARG  23   8.654   4.219   4.148
  176   2HG   ARG  23          1HG       ARG  23   8.848   4.945   2.555
  177   1HD   ARG  23          2HD       ARG  23   6.182   5.465   3.259
  178   2HD   ARG  23          1HD       ARG  23   7.101   5.746   4.736
  179    HE   ARG  23           HE       ARG  23   8.455   7.011   2.566
  180   1HH1  ARG  23          1HH2      ARG  23   5.758   7.873   1.776
  181   2HH1  ARG  23          2HH2      ARG  23   5.491   9.278   2.753
  182   1HH2  ARG  23          1HH1      ARG  23   8.034   8.535   4.990
  183   2HH2  ARG  23          2HH1      ARG  23   6.777   9.653   4.572
  184    H    GLU  24           H        GLU  24   8.993   5.297   0.194
  185    HA   GLU  24           HA       GLU  24   7.198   7.597   0.573
  186   1HB   GLU  24          2HB       GLU  24   9.607   7.894   0.933
  187   2HB   GLU  24          1HB       GLU  24   9.938   7.370  -0.717
  188   1HG   GLU  24          2HG       GLU  24   8.767   9.294  -1.625
  189   2HG   GLU  24          1HG       GLU  24   8.234   9.779  -0.015
  190    H    GLU  25           H        GLU  25   8.917   6.233  -2.208
  191    HA   GLU  25           HA       GLU  25   7.530   7.603  -4.254
  192   1HB   GLU  25          2HB       GLU  25   9.251   5.242  -4.082
  193   2HB   GLU  25          1HB       GLU  25   8.049   5.102  -5.364
  194   1HG   GLU  25          2HG       GLU  25  10.187   6.197  -6.106
  195   2HG   GLU  25          1HG       GLU  25   8.759   7.204  -6.343
  196    H    VAL  26           H        VAL  26   6.808   4.312  -2.998
  197    HA   VAL  26           HA       VAL  26   4.446   3.934  -4.523
  198    HB   VAL  26           HB       VAL  26   5.334   2.020  -3.424
  199   1HG1  VAL  26          1HG1      VAL  26   5.451   3.854  -1.096
  200   2HG1  VAL  26          2HG1      VAL  26   6.558   2.570  -1.579
  201   3HG1  VAL  26          3HG1      VAL  26   5.065   2.173  -0.730
  202   1HG2  VAL  26          1HG2      VAL  26   2.914   2.722  -1.746
  203   2HG2  VAL  26          2HG2      VAL  26   3.424   1.128  -2.300
  204   3HG2  VAL  26          3HG2      VAL  26   2.789   2.300  -3.453
  205    H    LYS  27           H        LYS  27   4.910   5.568  -1.381
  206    HA   LYS  27           HA       LYS  27   2.130   5.897  -0.785
  207   1HB   LYS  27          2HB       LYS  27   4.661   7.015   0.181
  208   2HB   LYS  27          1HB       LYS  27   3.336   8.173   0.240
  209   1HG   LYS  27          2HG       LYS  27   3.520   6.805   2.326
  210   2HG   LYS  27          1HG       LYS  27   1.964   6.628   1.520
  211   1HD   LYS  27          2HD       LYS  27   3.643   4.659   0.378
  212   2HD   LYS  27          1HD       LYS  27   3.947   4.599   2.108
  213   1HE   LYS  27          2HE       LYS  27   1.269   4.344   0.717
  214   2HE   LYS  27          1HE       LYS  27   2.108   3.105   1.646
  215   1HZ   LYS  27          1HZ       LYS  27   1.823   5.412   3.227
  216   2HZ   LYS  27          2HZ       LYS  27   1.171   3.863   3.481
  217   3HZ   LYS  27          3HZ       LYS  27   0.309   5.014   2.574
  218    H    ALA  28           H        ALA  28   4.299   7.638  -2.936
  219    HA   ALA  28           HA       ALA  28   2.594   9.931  -3.353
  220   1HB   ALA  28          1HB       ALA  28   5.085   9.616  -4.024
  221   2HB   ALA  28          2HB       ALA  28   4.036  10.471  -5.154
  222   3HB   ALA  28          3HB       ALA  28   4.451   8.782  -5.443
  223    H    LEU  29           H        LEU  29   2.821   6.706  -4.708
  224    HA   LEU  29           HA       LEU  29   0.709   7.251  -6.709
  225   1HB   LEU  29          2HB       LEU  29   2.786   5.269  -6.347
  226   2HB   LEU  29          1HB       LEU  29   1.228   4.466  -6.531
  227    HG   LEU  29           HG       LEU  29   2.323   4.823  -8.724
  228   1HD1  LEU  29          1HD1      LEU  29   0.039   6.769  -8.666
  229   2HD1  LEU  29          2HD1      LEU  29  -0.259   5.086  -8.235
  230   3HD1  LEU  29          3HD1      LEU  29   0.386   5.487  -9.826
  231   1HD2  LEU  29          1HD2      LEU  29   1.911   7.788  -8.382
  232   2HD2  LEU  29          2HD2      LEU  29   2.956   6.935  -9.518
  233   3HD2  LEU  29          3HD2      LEU  29   3.403   7.036  -7.816
  234    H    LEU  30           H        LEU  30   1.083   5.945  -3.508
  235    HA   LEU  30           HA       LEU  30  -1.325   4.374  -3.389
  236   1HB   LEU  30          2HB       LEU  30   0.753   4.496  -1.775
  237   2HB   LEU  30          1HB       LEU  30  -0.162   5.780  -0.994
  238    HG   LEU  30           HG       LEU  30  -0.609   3.629   0.097
  239   1HD1  LEU  30          1HD1      LEU  30  -2.462   5.429  -0.447
  240   2HD1  LEU  30          2HD1      LEU  30  -2.918   3.873   0.244
  241   3HD1  LEU  30          3HD1      LEU  30  -3.106   4.158  -1.485
  242   1HD2  LEU  30          1HD2      LEU  30  -2.059   2.526  -2.249
  243   2HD2  LEU  30          2HD2      LEU  30  -1.096   1.696  -1.026
  244   3HD2  LEU  30          3HD2      LEU  30  -0.298   2.517  -2.367
  245    H    ARG  31           H        ARG  31  -0.604   7.702  -2.254
  246    HA   ARG  31           HA       ARG  31  -3.260   8.305  -1.402
  247   1HB   ARG  31          2HB       ARG  31  -0.870   9.623  -1.299
  248   2HB   ARG  31          1HB       ARG  31  -1.696  10.541  -2.559
  249   1HG   ARG  31          2HG       ARG  31  -3.599  10.935  -1.083
  250   2HG   ARG  31          1HG       ARG  31  -2.879   9.918   0.164
  251   1HD   ARG  31          2HD       ARG  31  -2.322  12.117   0.834
  252   2HD   ARG  31          1HD       ARG  31  -0.860  11.532   0.041
  253    HE   ARG  31           HE       ARG  31  -1.669  12.794  -2.009
  254   1HH1  ARG  31          1HH1      ARG  31  -1.054  14.393   0.675
  255   2HH1  ARG  31          2HH1      ARG  31  -2.239  15.647   0.512
  256   1HH2  ARG  31          1HH2      ARG  31  -3.972  14.041  -2.027
  257   2HH2  ARG  31          2HH2      ARG  31  -3.890  15.447  -1.019
  258    H    ARG  32           H        ARG  32  -1.617   8.819  -4.498
  259    HA   ARG  32           HA       ARG  32  -3.741  10.139  -5.869
  260   1HB   ARG  32          2HB       ARG  32  -1.434   8.420  -6.763
  261   2HB   ARG  32          1HB       ARG  32  -2.643   8.944  -7.933
  262   1HG   ARG  32          2HG       ARG  32  -1.434  10.972  -6.078
  263   2HG   ARG  32          1HG       ARG  32  -0.512  10.435  -7.482
  264   1HD   ARG  32          2HD       ARG  32  -3.369  11.410  -7.691
  265   2HD   ARG  32          1HD       ARG  32  -1.983  12.488  -7.850
  266    HE   ARG  32           HE       ARG  32  -2.587  10.227  -9.708
  267   1HH1  ARG  32          1HH1      ARG  32  -2.860  13.216 -10.363
  268   2HH1  ARG  32          2HH1      ARG  32  -1.417  13.477 -11.284
  269   1HH2  ARG  32          1HH2      ARG  32   0.088  10.527 -10.257
  270   2HH2  ARG  32          2HH2      ARG  32   0.251  11.955 -11.225
  271    H    LEU  33           H        LEU  33  -3.108   6.741  -5.229
  272    HA   LEU  33           HA       LEU  33  -5.109   5.631  -6.953
  273   1HB   LEU  33          2HB       LEU  33  -3.160   4.673  -5.189
  274   2HB   LEU  33          1HB       LEU  33  -4.684   4.100  -4.522
  275    HG   LEU  33           HG       LEU  33  -4.099   2.419  -5.999
  276   1HD1  LEU  33          1HD1      LEU  33  -6.400   3.462  -6.466
  277   2HD1  LEU  33          2HD1      LEU  33  -5.737   2.389  -7.695
  278   3HD1  LEU  33          3HD1      LEU  33  -5.659   4.134  -7.918
  279   1HD2  LEU  33          1HD2      LEU  33  -3.099   2.747  -8.190
  280   2HD2  LEU  33          2HD2      LEU  33  -2.192   3.684  -7.004
  281   3HD2  LEU  33          3HD2      LEU  33  -3.343   4.489  -8.071
  282    H    GLY  34           H        GLY  34  -5.749   7.772  -4.682
  283   1HA   GLY  34          2HA       GLY  34  -7.796   8.367  -3.685
  284   2HA   GLY  34          1HA       GLY  34  -8.485   6.873  -4.317
  285    H    ALA  35           H        ALA  35  -6.346   5.216  -3.045
  286    HA   ALA  35           HA       ALA  35  -7.669   4.689  -0.559
  287   1HB   ALA  35          1HB       ALA  35  -6.544   2.814  -1.309
  288   2HB   ALA  35          2HB       ALA  35  -5.346   3.429  -0.170
  289   3HB   ALA  35          3HB       ALA  35  -5.166   3.744  -1.896
  290    H    LYS  36           H        LYS  36  -7.215   5.366   1.511
  291    HA   LYS  36           HA       LYS  36  -5.614   7.777   1.830
  292   1HB   LYS  36          2HB       LYS  36  -7.216   6.029   3.696
  293   2HB   LYS  36          1HB       LYS  36  -6.207   7.334   4.320
  294   1HG   LYS  36          2HG       LYS  36  -8.086   7.924   2.057
  295   2HG   LYS  36          1HG       LYS  36  -8.742   7.781   3.688
  296   1HD   LYS  36          2HD       LYS  36  -6.300   9.473   3.283
  297   2HD   LYS  36          1HD       LYS  36  -7.861  10.118   2.774
  298   1HE   LYS  36          2HE       LYS  36  -7.382   8.955   5.530
  299   2HE   LYS  36          1HE       LYS  36  -7.196  10.671   5.164
  300   1HZ   LYS  36          1HZ       LYS  36  -9.625   9.890   4.091
  301   2HZ   LYS  36          2HZ       LYS  36  -9.366  10.883   5.447
  302   3HZ   LYS  36          3HZ       LYS  36  -9.564   9.207   5.642
  303    H    VAL  37           H        VAL  37  -3.698   7.971   3.154
  304    HA   VAL  37           HA       VAL  37  -2.203   5.398   3.438
  305    HB   VAL  37           HB       VAL  37  -0.155   6.809   3.301
  306   1HG1  VAL  37          1HG1      VAL  37  -0.372   7.364   0.896
  307   2HG1  VAL  37          2HG1      VAL  37  -2.121   7.175   1.019
  308   3HG1  VAL  37          3HG1      VAL  37  -1.064   5.784   1.262
  309   1HG2  VAL  37          1HG2      VAL  37  -2.187   9.018   2.836
  310   2HG2  VAL  37          2HG2      VAL  37  -0.464   9.177   2.499
  311   3HG2  VAL  37          3HG2      VAL  37  -1.016   8.916   4.152
  312    H    THR  38           H        THR  38  -0.942   5.108   5.348
  313    HA   THR  38           HA       THR  38  -1.079   7.061   7.527
  314    HB   THR  38           HB       THR  38  -2.031   4.744   8.808
  315    HG1  THR  38           HG1      THR  38  -2.676   4.069   6.678
  316   1HG2  THR  38          1HG2      THR  38  -3.992   6.126   9.280
  317   2HG2  THR  38          2HG2      THR  38  -3.581   7.202   7.945
  318   3HG2  THR  38          3HG2      THR  38  -2.533   7.114   9.360
  319    H    ASP  39           H        ASP  39  -0.155   5.673   9.628
  320    HA   ASP  39           HA       ASP  39   1.862   3.719   8.710
  321   1HB   ASP  39          2HB       ASP  39   3.671   5.060   9.915
  322   2HB   ASP  39          1HB       ASP  39   3.113   5.731   8.383
  323    H    SER  40           H        SER  40  -0.360   4.685  11.003
  324    HA   SER  40           HA       SER  40   0.910   2.926  13.057
  325   1HB   SER  40          2HB       SER  40  -0.370   4.477  14.716
  326   2HB   SER  40          1HB       SER  40   1.156   5.043  14.045
  327    HG   SER  40           HG       SER  40  -0.247   6.684  13.710
  328    H    VAL  41           H        VAL  41  -0.979   2.483  14.798
  329    HA   VAL  41           HA       VAL  41  -3.550   1.984  13.385
  330    HB   VAL  41           HB       VAL  41  -3.596  -0.333  14.329
  331   1HG1  VAL  41          1HG1      VAL  41  -1.137   0.092  12.616
  332   2HG1  VAL  41          2HG1      VAL  41  -2.776   0.248  11.984
  333   3HG1  VAL  41          3HG1      VAL  41  -2.222  -1.297  12.627
  334   1HG2  VAL  41          1HG2      VAL  41  -2.025  -0.079  16.165
  335   2HG2  VAL  41          2HG2      VAL  41  -0.728   0.355  15.051
  336   3HG2  VAL  41          3HG2      VAL  41  -1.379  -1.284  15.051
  337    H    SER  42           H        SER  42  -5.345   1.784  14.839
  338    HA   SER  42           HA       SER  42  -4.800   2.207  17.725
  339   1HB   SER  42          2HB       SER  42  -6.382   4.120  17.794
  340   2HB   SER  42          1HB       SER  42  -4.972   4.474  16.801
  341    HG   SER  42           HG       SER  42  -7.547   3.645  15.929
  342    H    ARG  43           H        ARG  43  -7.175   1.637  15.141
  343    HA   ARG  43           HA       ARG  43  -8.434  -0.561  16.360
  344   1HB   ARG  43          2HB       ARG  43  -9.241   1.964  17.523
  345   2HB   ARG  43          1HB       ARG  43 -10.604   1.258  16.655
  346   1HG   ARG  43          2HG       ARG  43 -10.541  -0.734  17.940
  347   2HG   ARG  43          1HG       ARG  43  -8.924  -0.384  18.554
  348   1HD   ARG  43          2HD       ARG  43  -9.782   1.506  19.843
  349   2HD   ARG  43          1HD       ARG  43 -11.394   1.265  19.172
  350    HE   ARG  43           HE       ARG  43 -11.344  -0.997  20.351
  351   1HH1  ARG  43          1HH2      ARG  43 -10.976   1.823  21.931
  352   2HH1  ARG  43          2HH2      ARG  43 -10.095   1.209  23.290
  353   1HH2  ARG  43          1HH1      ARG  43  -9.504  -1.887  21.845
  354   2HH2  ARG  43          2HH1      ARG  43  -9.261  -0.890  23.241
  355    H    LYS  44           H        LYS  44  -9.681   2.414  14.871
  356    HA   LYS  44           HA       LYS  44 -11.124   0.946  12.805
  357   1HB   LYS  44          2HB       LYS  44 -10.550   3.887  13.244
  358   2HB   LYS  44          1HB       LYS  44 -11.464   3.293  11.856
  359   1HG   LYS  44          2HG       LYS  44 -13.177   2.380  13.252
  360   2HG   LYS  44          1HG       LYS  44 -12.201   2.593  14.706
  361   1HD   LYS  44          2HD       LYS  44 -12.319   5.031  14.459
  362   2HD   LYS  44          1HD       LYS  44 -13.243   4.850  12.967
  363   1HE   LYS  44          2HE       LYS  44 -15.104   3.884  14.131
  364   2HE   LYS  44          1HE       LYS  44 -14.167   3.707  15.614
  365   1HZ   LYS  44          1HZ       LYS  44 -13.920   6.206  15.530
  366   2HZ   LYS  44          2HZ       LYS  44 -15.465   5.612  15.916
  367   3HZ   LYS  44          3HZ       LYS  44 -15.143   6.198  14.354
  368    H    THR  45           H        THR  45  -7.909   1.448  13.198
  369    HA   THR  45           HA       THR  45  -7.426   1.349  10.252
  370    HB   THR  45           HB       THR  45  -5.436   2.746  12.006
  371    HG1  THR  45           HG1      THR  45  -6.669   4.413  12.294
  372   1HG2  THR  45          1HG2      THR  45  -5.145   2.192   9.528
  373   2HG2  THR  45          2HG2      THR  45  -4.886   3.877   9.978
  374   3HG2  THR  45          3HG2      THR  45  -6.399   3.391   9.214
  375    H    SER  46           H        SER  46  -6.863  -0.802  10.152
  376    HA   SER  46           HA       SER  46  -4.374  -1.593  11.539
  377   1HB   SER  46          2HB       SER  46  -6.499  -3.662  11.621
  378   2HB   SER  46          1HB       SER  46  -5.239  -3.298  12.793
  379    HG   SER  46           HG       SER  46  -7.596  -2.756  13.241
  380    H    TYR  47           H        TYR  47  -3.982  -1.164   9.134
  381    HA   TYR  47           HA       TYR  47  -3.954  -3.759   7.727
  382   1HB   TYR  47          2HB       TYR  47  -5.051  -1.306   6.321
  383   2HB   TYR  47          1HB       TYR  47  -4.998  -2.960   5.714
  384    HD1  TYR  47           HD1      TYR  47  -6.744  -0.595   7.903
  385    HD2  TYR  47           HD2      TYR  47  -6.514  -4.691   6.626
  386    HE1  TYR  47           HE1      TYR  47  -8.973  -1.031   8.898
  387    HE2  TYR  47           HE2      TYR  47  -8.742  -5.126   7.621
  388    HH   TYR  47           HH       TYR  47 -10.777  -2.560   8.762
  389    H    LEU  48           H        LEU  48  -1.945  -3.949   6.806
  390    HA   LEU  48           HA       LEU  48  -0.523  -1.418   6.107
  391   1HB   LEU  48          2HB       LEU  48   0.958  -1.856   7.749
  392   2HB   LEU  48          1HB       LEU  48   0.232  -3.425   8.066
  393    HG   LEU  48           HG       LEU  48   2.087  -3.038   5.703
  394   1HD1  LEU  48          1HD1      LEU  48   2.851  -2.566   8.345
  395   2HD1  LEU  48          2HD1      LEU  48   3.922  -2.952   7.000
  396   3HD1  LEU  48          3HD1      LEU  48   3.326  -4.238   8.050
  397   1HD2  LEU  48          1HD2      LEU  48   2.262  -5.545   7.113
  398   2HD2  LEU  48          2HD2      LEU  48   1.723  -5.253   5.461
  399   3HD2  LEU  48          3HD2      LEU  48   0.566  -5.189   6.790
  400    H    VAL  49           H        VAL  49   0.858  -1.542   4.320
  401    HA   VAL  49           HA       VAL  49   0.221  -3.743   2.441
  402    HB   VAL  49           HB       VAL  49   1.825  -2.219   0.964
  403   1HG1  VAL  49          1HG1      VAL  49  -0.118  -1.044   0.158
  404   2HG1  VAL  49          2HG1      VAL  49  -0.939  -1.246   1.703
  405   3HG1  VAL  49          3HG1      VAL  49  -0.644  -2.646   0.674
  406   1HG2  VAL  49          1HG2      VAL  49   1.840   0.098   1.592
  407   2HG2  VAL  49          2HG2      VAL  49   2.388  -0.799   3.006
  408   3HG2  VAL  49          3HG2      VAL  49   0.734  -0.192   2.935
  409    H    VAL  50           H        VAL  50   1.560  -5.534   2.604
  410    HA   VAL  50           HA       VAL  50   3.869  -5.714   4.100
  411    HB   VAL  50           HB       VAL  50   3.263  -7.183   1.512
  412   1HG1  VAL  50          1HG1      VAL  50   4.668  -8.985   2.736
  413   2HG1  VAL  50          2HG1      VAL  50   5.268  -7.651   3.721
  414   3HG1  VAL  50          3HG1      VAL  50   5.536  -7.651   1.978
  415   1HG2  VAL  50          1HG2      VAL  50   1.550  -7.244   3.419
  416   2HG2  VAL  50          2HG2      VAL  50   2.780  -8.082   4.363
  417   3HG2  VAL  50          3HG2      VAL  50   2.162  -8.808   2.880
  418    H    GLY  51           H        GLY  51   6.132  -6.070   3.295
  419   1HA   GLY  51          2HA       GLY  51   6.850  -4.196   1.080
  420   2HA   GLY  51          1HA       GLY  51   7.665  -4.065   2.636
  421    H    GLU  52           H        GLU  52   9.526  -5.168   2.825
  422    HA   GLU  52           HA       GLU  52  10.169  -7.221   0.772
  423   1HB   GLU  52          2HB       GLU  52  11.623  -5.130   1.350
  424   2HB   GLU  52          1HB       GLU  52  12.121  -6.067   2.757
  425   1HG   GLU  52          2HG       GLU  52  12.728  -7.952   1.188
  426   2HG   GLU  52          1HG       GLU  52  12.416  -6.854  -0.156
  427    H    ASN  53           H        ASN  53  12.314  -7.744   3.138
  428    HA   ASN  53           HA       ASN  53  10.623  -9.792   4.516
  429   1HB   ASN  53          2HB       ASN  53  13.192 -10.055   3.077
  430   2HB   ASN  53          1HB       ASN  53  13.157 -10.832   4.661
  431   1HD2  ASN  53          1HD2      ASN  53  12.994 -13.017   3.899
  432   2HD2  ASN  53          2HD2      ASN  53  11.646 -13.593   3.044
  433    HA   PRO  54           HA       PRO  54  13.789  -8.372   7.796
  434   1HB   PRO  54          2HB       PRO  54  15.848  -6.724   7.077
  435   2HB   PRO  54          1HB       PRO  54  15.951  -8.492   6.985
  436   1HG   PRO  54          2HG       PRO  54  15.492  -6.510   4.822
  437   2HG   PRO  54          1HG       PRO  54  16.419  -8.018   4.796
  438   1HD   PRO  54          2HD       PRO  54  13.882  -7.761   3.748
  439   2HD   PRO  54          1HD       PRO  54  14.576  -9.296   4.311
  440    H    GLY  55           H        GLY  55  12.080  -6.507   5.718
  441   1HA   GLY  55          2HA       GLY  55  12.519  -3.821   6.522
  442   2HA   GLY  55          1HA       GLY  55  11.000  -4.439   5.881
  443    H    SER  56           H        SER  56  10.985  -2.507   7.839
  444    HA   SER  56           HA       SER  56  10.737  -3.637  10.500
  445   1HB   SER  56          2HB       SER  56  11.255  -1.215   9.938
  446   2HB   SER  56          1HB       SER  56   9.565  -1.040   9.479
  447    HG   SER  56           HG       SER  56  10.584  -1.847  12.008
  448    H    LYS  57           H        LYS  57   8.753  -3.680   7.742
  449    HA   LYS  57           HA       LYS  57   6.147  -3.481   8.859
  450   1HB   LYS  57          2HB       LYS  57   5.362  -4.467   6.860
  451   2HB   LYS  57          1HB       LYS  57   6.848  -3.656   6.379
  452   1HG   LYS  57          2HG       LYS  57   6.729  -6.589   7.146
  453   2HG   LYS  57          1HG       LYS  57   6.591  -6.010   5.487
  454   1HD   LYS  57          2HD       LYS  57   8.806  -4.737   5.988
  455   2HD   LYS  57          1HD       LYS  57   8.961  -5.860   7.338
  456   1HE   LYS  57          2HE       LYS  57   8.489  -6.741   4.481
  457   2HE   LYS  57          1HE       LYS  57  10.088  -6.629   5.213
  458   1HZ   LYS  57          1HZ       LYS  57   7.991  -8.127   6.616
  459   2HZ   LYS  57          2HZ       LYS  57   9.675  -8.362   6.617
  460   3HZ   LYS  57          3HZ       LYS  57   8.748  -8.849   5.279
  461    H    LEU  58           H        LEU  58   8.558  -5.920   9.199
  462    HA   LEU  58           HA       LEU  58   7.110  -8.270   9.648
  463   1HB   LEU  58          2HB       LEU  58   9.655  -7.133  10.680
  464   2HB   LEU  58          1HB       LEU  58   8.968  -8.467  11.607
  465    HG   LEU  58           HG       LEU  58   9.167  -8.681   8.612
  466   1HD1  LEU  58          1HD1      LEU  58  11.384  -9.149  10.627
  467   2HD1  LEU  58          2HD1      LEU  58  11.417  -8.066   9.235
  468   3HD1  LEU  58          3HD1      LEU  58  11.397  -9.812   8.992
  469   1HD2  LEU  58          1HD2      LEU  58   9.334 -10.694  10.881
  470   2HD2  LEU  58          2HD2      LEU  58   9.317 -11.079   9.160
  471   3HD2  LEU  58          3HD2      LEU  58   7.894 -10.365   9.918
  472    H    GLU  59           H        GLU  59   7.075  -5.357  11.512
  473    HA   GLU  59           HA       GLU  59   6.120  -6.579  13.978
  474   1HB   GLU  59          2HB       GLU  59   6.414  -3.775  12.946
  475   2HB   GLU  59          1HB       GLU  59   5.412  -4.065  14.369
  476   1HG   GLU  59          2HG       GLU  59   7.695  -3.567  15.079
  477   2HG   GLU  59          1HG       GLU  59   7.327  -5.254  15.436
  478    H    LYS  60           H        LYS  60   4.453  -4.384  11.663
  479    HA   LYS  60           HA       LYS  60   1.865  -5.305  12.687
  480   1HB   LYS  60          2HB       LYS  60   2.221  -2.960  11.923
  481   2HB   LYS  60          1HB       LYS  60   2.461  -3.559  10.282
  482   1HG   LYS  60          2HG       LYS  60   0.209  -4.393  10.161
  483   2HG   LYS  60          1HG       LYS  60  -0.044  -4.140  11.888
  484   1HD   LYS  60          2HD       LYS  60   0.020  -1.747  11.629
  485   2HD   LYS  60          1HD       LYS  60   0.555  -1.887   9.954
  486   1HE   LYS  60          2HE       LYS  60  -1.584  -3.003   9.378
  487   2HE   LYS  60          1HE       LYS  60  -2.122  -2.808  11.046
  488   1HZ   LYS  60          1HZ       LYS  60  -2.071  -0.901   8.919
  489   2HZ   LYS  60          2HZ       LYS  60  -1.292  -0.317  10.311
  490   3HZ   LYS  60          3HZ       LYS  60  -2.903  -0.848  10.396
  491    H    ALA  61           H        ALA  61   3.909  -5.921   9.879
  492    HA   ALA  61           HA       ALA  61   1.945  -7.272   8.294
  493   1HB   ALA  61          1HB       ALA  61   4.892  -7.924   8.319
  494   2HB   ALA  61          2HB       ALA  61   4.240  -6.487   7.531
  495   3HB   ALA  61          3HB       ALA  61   3.754  -8.091   6.982
  496    H    ARG  62           H        ARG  62   4.209  -8.474  10.813
  497    HA   ARG  62           HA       ARG  62   3.326 -11.225  10.471
  498   1HB   ARG  62          2HB       ARG  62   4.692 -11.751  12.300
  499   2HB   ARG  62          1HB       ARG  62   5.494 -10.319  11.665
  500   1HG   ARG  62          2HG       ARG  62   4.263  -8.923  13.315
  501   2HG   ARG  62          1HG       ARG  62   3.523 -10.382  13.973
  502   1HD   ARG  62          2HD       ARG  62   5.782 -11.273  14.491
  503   2HD   ARG  62          1HD       ARG  62   6.494  -9.774  13.893
  504    HE   ARG  62           HE       ARG  62   4.526  -9.222  15.929
  505   1HH1  ARG  62          1HH1      ARG  62   6.455 -11.467  16.899
  506   2HH1  ARG  62          2HH1      ARG  62   7.610 -10.515  17.769
  507   1HH2  ARG  62          1HH2      ARG  62   6.560  -7.509  16.399
  508   2HH2  ARG  62          2HH2      ARG  62   7.669  -8.276  17.486
  509    H    ALA  63           H        ALA  63   2.382  -8.425  12.354
  510    HA   ALA  63           HA       ALA  63   0.489  -7.953  13.606
  511   1HB   ALA  63          1HB       ALA  63  -0.480 -10.070  11.706
  512   2HB   ALA  63          2HB       ALA  63  -0.836  -8.344  11.722
  513   3HB   ALA  63          3HB       ALA  63  -1.559  -9.405  12.931
  514    H    LEU  64           H        LEU  64  -0.807  -8.618  15.362
  515    HA   LEU  64           HA       LEU  64  -0.092 -11.263  16.560
  516   1HB   LEU  64          2HB       LEU  64   1.020  -9.216  17.637
  517   2HB   LEU  64          1HB       LEU  64  -0.599  -8.716  18.128
  518    HG   LEU  64           HG       LEU  64  -0.743 -11.196  19.036
  519   1HD1  LEU  64          1HD1      LEU  64   1.450 -11.876  18.120
  520   2HD1  LEU  64          2HD1      LEU  64   1.443 -11.977  19.880
  521   3HD1  LEU  64          3HD1      LEU  64   2.238 -10.623  19.079
  522   1HD2  LEU  64          1HD2      LEU  64   0.833  -8.984  20.395
  523   2HD2  LEU  64          2HD2      LEU  64   0.122 -10.371  21.222
  524   3HD2  LEU  64          3HD2      LEU  64  -0.920  -9.186  20.433
  525    H    GLY  65           H        GLY  65  -2.389 -10.107  14.930
  526   1HA   GLY  65          2HA       GLY  65  -4.580 -11.476  15.587
  527   2HA   GLY  65          1HA       GLY  65  -4.650 -10.217  16.828
  528    H    VAL  66           H        VAL  66  -3.205  -8.425  14.850
  529    HA   VAL  66           HA       VAL  66  -5.632  -7.312  13.632
  530    HB   VAL  66           HB       VAL  66  -4.089  -5.472  12.896
  531   1HG1  VAL  66          1HG1      VAL  66  -3.713  -4.599  15.143
  532   2HG1  VAL  66          2HG1      VAL  66  -3.842  -6.220  15.825
  533   3HG1  VAL  66          3HG1      VAL  66  -5.256  -5.452  15.103
  534   1HG2  VAL  66          1HG2      VAL  66  -2.035  -7.138  14.394
  535   2HG2  VAL  66          2HG2      VAL  66  -1.775  -5.502  13.792
  536   3HG2  VAL  66          3HG2      VAL  66  -2.041  -6.825  12.658
  537    HA   PRO  67           HA       PRO  67  -4.836  -9.021   9.621
  538   1HB   PRO  67          2HB       PRO  67  -6.374  -7.359   8.099
  539   2HB   PRO  67          1HB       PRO  67  -7.046  -8.580   9.193
  540   1HG   PRO  67          2HG       PRO  67  -6.947  -5.659   9.475
  541   2HG   PRO  67          1HG       PRO  67  -8.057  -6.830  10.197
  542   1HD   PRO  67          2HD       PRO  67  -5.826  -5.578  11.460
  543   2HD   PRO  67          1HD       PRO  67  -6.854  -6.864  12.124
  544    H    THR  68           H        THR  68  -3.555  -8.766   7.789
  545    HA   THR  68           HA       THR  68  -2.270  -6.094   7.325
  546    HB   THR  68           HB       THR  68  -0.192  -7.351   6.772
  547    HG1  THR  68           HG1      THR  68  -1.893  -9.403   6.933
  548   1HG2  THR  68          1HG2      THR  68  -1.463  -7.543   9.488
  549   2HG2  THR  68          2HG2      THR  68  -0.164  -6.485   8.941
  550   3HG2  THR  68          3HG2      THR  68   0.149  -8.199   9.214
  551    H    LEU  69           H        LEU  69  -2.472  -5.433   5.175
  552    HA   LEU  69           HA       LEU  69  -3.519  -7.436   3.246
  553   1HB   LEU  69          2HB       LEU  69  -3.674  -4.470   3.526
  554   2HB   LEU  69          1HB       LEU  69  -3.680  -5.122   1.888
  555    HG   LEU  69           HG       LEU  69  -5.487  -6.293   3.995
  556   1HD1  LEU  69          1HD1      LEU  69  -6.105  -3.909   2.221
  557   2HD1  LEU  69          2HD1      LEU  69  -5.901  -3.852   3.973
  558   3HD1  LEU  69          3HD1      LEU  69  -7.254  -4.739   3.272
  559   1HD2  LEU  69          1HD2      LEU  69  -5.627  -6.037   0.971
  560   2HD2  LEU  69          2HD2      LEU  69  -6.844  -6.822   1.978
  561   3HD2  LEU  69          3HD2      LEU  69  -5.220  -7.499   1.868
  562    H    THR  70           H        THR  70  -2.191  -8.254   1.720
  563    HA   THR  70           HA       THR  70   0.579  -7.634   1.545
  564    HB   THR  70           HB       THR  70  -0.959  -8.770  -0.777
  565    HG1  THR  70           HG1      THR  70  -0.538  -9.890   1.776
  566   1HG2  THR  70          1HG2      THR  70   1.015 -10.135  -1.039
  567   2HG2  THR  70          2HG2      THR  70   1.643  -9.614   0.524
  568   3HG2  THR  70          3HG2      THR  70   1.546  -8.469  -0.813
  569    H    GLU  71           H        GLU  71   1.752  -6.324   0.100
  570    HA   GLU  71           HA       GLU  71   0.306  -4.069  -1.066
  571   1HB   GLU  71          2HB       GLU  71   2.763  -4.178  -0.076
  572   2HB   GLU  71          1HB       GLU  71   3.179  -4.655  -1.723
  573   1HG   GLU  71          2HG       GLU  71   2.269  -2.628  -2.637
  574   2HG   GLU  71          1HG       GLU  71   1.514  -2.199  -1.103
  575    H    GLU  72           H        GLU  72   1.381  -7.166  -2.086
  576    HA   GLU  72           HA       GLU  72   1.819  -6.950  -4.828
  577   1HB   GLU  72          2HB       GLU  72   0.586  -9.023  -3.081
  578   2HB   GLU  72          1HB       GLU  72   0.282  -9.177  -4.811
  579   1HG   GLU  72          2HG       GLU  72   2.294 -10.413  -4.338
  580   2HG   GLU  72          1HG       GLU  72   2.777  -8.940  -5.176
  581    H    GLU  73           H        GLU  73  -1.333  -7.029  -3.156
  582    HA   GLU  73           HA       GLU  73  -2.955  -6.815  -5.506
  583   1HB   GLU  73          2HB       GLU  73  -3.751  -7.405  -3.167
  584   2HB   GLU  73          1HB       GLU  73  -3.610  -5.693  -2.765
  585   1HG   GLU  73          2HG       GLU  73  -5.168  -5.156  -4.635
  586   2HG   GLU  73          1HG       GLU  73  -5.355  -6.882  -4.946
  587    H    LEU  74           H        LEU  74  -1.476  -4.374  -3.379
  588    HA   LEU  74           HA       LEU  74  -2.648  -2.060  -4.530
  589   1HB   LEU  74          2HB       LEU  74  -1.411  -1.667  -2.561
  590   2HB   LEU  74          1HB       LEU  74  -0.019  -2.572  -3.144
  591    HG   LEU  74           HG       LEU  74   0.352  -0.801  -4.879
  592   1HD1  LEU  74          1HD1      LEU  74  -1.821   0.156  -5.134
  593   2HD1  LEU  74          2HD1      LEU  74  -0.838   1.410  -4.380
  594   3HD1  LEU  74          3HD1      LEU  74  -1.965   0.468  -3.405
  595   1HD2  LEU  74          1HD2      LEU  74   1.722  -0.571  -2.974
  596   2HD2  LEU  74          2HD2      LEU  74   0.365  -0.135  -1.937
  597   3HD2  LEU  74          3HD2      LEU  74   0.971   1.015  -3.129
  598    H    TYR  75           H        TYR  75   0.327  -3.821  -5.426
  599    HA   TYR  75           HA       TYR  75   1.017  -2.128  -7.641
  600   1HB   TYR  75          2HB       TYR  75   1.634  -5.043  -7.069
  601   2HB   TYR  75          1HB       TYR  75   2.340  -4.140  -8.407
  602    HD1  TYR  75           HD1      TYR  75   3.263  -1.695  -7.624
  603    HD2  TYR  75           HD2      TYR  75   2.926  -5.184  -5.137
  604    HE1  TYR  75           HE1      TYR  75   4.997  -0.783  -6.104
  605    HE2  TYR  75           HE2      TYR  75   4.658  -4.269  -3.618
  606    HH   TYR  75           HH       TYR  75   5.531  -1.207  -3.460
  607    H    ARG  76           H        ARG  76  -1.105  -4.903  -7.277
  608    HA   ARG  76           HA       ARG  76  -1.553  -5.435 -10.055
  609   1HB   ARG  76          2HB       ARG  76  -2.230  -6.905  -8.093
  610   2HB   ARG  76          1HB       ARG  76  -3.585  -5.806  -7.837
  611   1HG   ARG  76          2HG       ARG  76  -4.295  -6.209 -10.206
  612   2HG   ARG  76          1HG       ARG  76  -3.011  -7.410 -10.346
  613   1HD   ARG  76          2HD       ARG  76  -5.179  -7.526  -8.233
  614   2HD   ARG  76          1HD       ARG  76  -5.278  -8.372  -9.776
  615    HE   ARG  76           HE       ARG  76  -3.718  -9.217  -7.504
  616   1HH1  ARG  76          1HH1      ARG  76  -4.599  -9.980 -10.631
  617   2HH1  ARG  76          2HH1      ARG  76  -3.181 -10.902 -11.004
  618   1HH2  ARG  76          1HH2      ARG  76  -1.501  -9.987  -8.112
  619   2HH2  ARG  76          2HH2      ARG  76  -1.428 -10.906  -9.579
  620    H    LEU  77           H        LEU  77  -4.040  -4.017  -7.914
  621    HA   LEU  77           HA       LEU  77  -5.561  -2.812  -9.928
  622   1HB   LEU  77          2HB       LEU  77  -5.121  -2.091  -7.032
  623   2HB   LEU  77          1HB       LEU  77  -6.170  -1.112  -8.051
  624    HG   LEU  77           HG       LEU  77  -7.469  -2.826  -6.847
  625   1HD1  LEU  77          1HD1      LEU  77  -8.824  -3.277  -8.638
  626   2HD1  LEU  77          2HD1      LEU  77  -7.499  -3.902  -9.618
  627   3HD1  LEU  77          3HD1      LEU  77  -7.728  -2.161  -9.454
  628   1HD2  LEU  77          1HD2      LEU  77  -5.490  -4.463  -6.803
  629   2HD2  LEU  77          2HD2      LEU  77  -5.960  -4.906  -8.443
  630   3HD2  LEU  77          3HD2      LEU  77  -7.079  -5.161  -7.106
  631    H    LEU  78           H        LEU  78  -2.639  -1.583  -8.351
  632    HA   LEU  78           HA       LEU  78  -2.766   1.081  -9.414
  633   1HB   LEU  78          2HB       LEU  78  -1.245   0.395  -7.572
  634   2HB   LEU  78          1HB       LEU  78  -0.317  -0.569  -8.717
  635    HG   LEU  78           HG       LEU  78  -0.767   2.263  -9.487
  636   1HD1  LEU  78          1HD1      LEU  78  -0.317   2.737  -7.205
  637   2HD1  LEU  78          2HD1      LEU  78   1.252   2.875  -7.997
  638   3HD1  LEU  78          3HD1      LEU  78   0.853   1.424  -7.077
  639   1HD2  LEU  78          1HD2      LEU  78   0.635   0.984 -10.916
  640   2HD2  LEU  78          2HD2      LEU  78   1.484   0.245  -9.560
  641   3HD2  LEU  78          3HD2      LEU  78   1.758   1.942  -9.951
  642    H    GLU  79           H        GLU  79  -0.646  -1.603 -10.478
  643    HA   GLU  79           HA       GLU  79   0.217  -0.526 -12.903
  644   1HB   GLU  79          2HB       GLU  79  -0.413  -3.387 -12.148
  645   2HB   GLU  79          1HB       GLU  79   0.294  -2.963 -13.707
  646   1HG   GLU  79          2HG       GLU  79   2.237  -2.007 -12.661
  647   2HG   GLU  79          1HG       GLU  79   1.500  -2.107 -11.062
  648    H    ALA  80           H        ALA  80  -2.934  -1.803 -12.102
  649    HA   ALA  80           HA       ALA  80  -3.832  -1.876 -14.909
  650   1HB   ALA  80          1HB       ALA  80  -5.442  -2.069 -12.337
  651   2HB   ALA  80          2HB       ALA  80  -4.778  -3.447 -13.215
  652   3HB   ALA  80          3HB       ALA  80  -6.026  -2.446 -13.958
  653    H    ARG  81           H        ARG  81  -5.029  -0.129 -12.035
  654    HA   ARG  81           HA       ARG  81  -6.523   1.872 -13.192
  655   1HB   ARG  81          2HB       ARG  81  -5.738   1.500 -10.683
  656   2HB   ARG  81          1HB       ARG  81  -4.553   2.737 -11.098
  657   1HG   ARG  81          2HG       ARG  81  -7.519   3.077 -11.604
  658   2HG   ARG  81          1HG       ARG  81  -6.739   3.600 -10.112
  659   1HD   ARG  81          2HD       ARG  81  -5.059   4.742 -11.874
  660   2HD   ARG  81          1HD       ARG  81  -6.520   4.728 -12.861
  661    HE   ARG  81           HE       ARG  81  -7.041   5.756 -10.202
  662   1HH1  ARG  81          1HH2      ARG  81  -4.888   6.739 -12.594
  663   2HH1  ARG  81          2HH2      ARG  81  -5.573   8.315 -12.805
  664   1HH2  ARG  81          1HH1      ARG  81  -8.312   7.686 -10.775
  665   2HH2  ARG  81          2HH1      ARG  81  -7.511   8.851 -11.774
  666    H    THR  82           H        THR  82  -2.968   1.983 -12.774
  667    HA   THR  82           HA       THR  82  -2.622   4.473 -14.182
  668    HB   THR  82           HB       THR  82  -0.240   3.778 -14.351
  669    HG1  THR  82           HG1      THR  82  -1.379   1.340 -13.523
  670   1HG2  THR  82          1HG2      THR  82  -0.977   4.790 -12.265
  671   2HG2  THR  82          2HG2      THR  82   0.155   3.488 -11.899
  672   3HG2  THR  82          3HG2      THR  82  -1.577   3.237 -11.685
  673    H    GLY  83           H        GLY  83  -2.178   1.088 -15.175
  674   1HA   GLY  83          2HA       GLY  83  -2.754   0.136 -17.288
  675   2HA   GLY  83          1HA       GLY  83  -3.090   1.757 -17.899
  676    H    LYS  84           H        LYS  84  -0.112   1.389 -16.191
  677    HA   LYS  84           HA       LYS  84   1.436   0.804 -18.635
  678   1HB   LYS  84          2HB       LYS  84   0.976   3.338 -18.488
  679   2HB   LYS  84          1HB       LYS  84   2.019   3.326 -17.066
  680   1HG   LYS  84          2HG       LYS  84   3.827   3.402 -18.404
  681   2HG   LYS  84          1HG       LYS  84   3.362   1.853 -19.104
  682   1HD   LYS  84          2HD       LYS  84   2.058   4.409 -20.032
  683   2HD   LYS  84          1HD       LYS  84   3.609   3.895 -20.696
  684   1HE   LYS  84          2HE       LYS  84   2.623   1.737 -21.359
  685   2HE   LYS  84          1HE       LYS  84   1.071   2.235 -20.684
  686   1HZ   LYS  84          1HZ       LYS  84   2.499   3.711 -22.826
  687   2HZ   LYS  84          2HZ       LYS  84   0.923   3.998 -22.257
  688   3HZ   LYS  84          3HZ       LYS  84   1.274   2.574 -23.115
  689    H    LYS  85           H        LYS  85   3.676   0.275 -18.092
  690    HA   LYS  85           HA       LYS  85   3.957  -1.154 -15.641
  691   1HB   LYS  85          2HB       LYS  85   6.482  -1.049 -16.270
  692   2HB   LYS  85          1HB       LYS  85   5.382  -1.892 -17.358
  693   1HG   LYS  85          2HG       LYS  85   5.239   0.088 -18.797
  694   2HG   LYS  85          1HG       LYS  85   6.273   0.991 -17.688
  695   1HD   LYS  85          2HD       LYS  85   8.039  -0.804 -18.058
  696   2HD   LYS  85          1HD       LYS  85   7.020  -1.420 -19.361
  697   1HE   LYS  85          2HE       LYS  85   7.050   0.991 -20.279
  698   2HE   LYS  85          1HE       LYS  85   8.395   1.262 -19.171
  699   1HZ   LYS  85          1HZ       LYS  85   9.318   0.604 -21.224
  700   2HZ   LYS  85          2HZ       LYS  85   8.238  -0.698 -21.389
  701   3HZ   LYS  85          3HZ       LYS  85   9.452  -0.741 -20.200
  702    H    ALA  86           H        ALA  86   3.624   0.088 -13.809
  703    HA   ALA  86           HA       ALA  86   4.554   2.725 -13.339
  704   1HB   ALA  86          1HB       ALA  86   4.128   0.488 -11.334
  705   2HB   ALA  86          2HB       ALA  86   2.890   1.605 -11.907
  706   3HB   ALA  86          3HB       ALA  86   4.241   2.204 -10.944
  707    H    GLU  87           H        GLU  87   6.164  -0.395 -12.941
  708    HA   GLU  87           HA       GLU  87   8.462   0.644 -11.521
  709   1HB   GLU  87          2HB       GLU  87   8.147  -1.872 -13.190
  710   2HB   GLU  87          1HB       GLU  87   9.505  -1.530 -12.119
  711   1HG   GLU  87          2HG       GLU  87   7.910  -1.359 -10.208
  712   2HG   GLU  87          1HG       GLU  87   6.599  -1.812 -11.297
  713    H    GLU  88           H        GLU  88   7.603   0.282 -14.916
  714    HA   GLU  88           HA       GLU  88   8.694   0.976 -16.871
  715   1HB   GLU  88          2HB       GLU  88  10.218   2.818 -14.998
  716   2HB   GLU  88          1HB       GLU  88   9.978   3.033 -16.731
  717   1HG   GLU  88          2HG       GLU  88   7.512   3.156 -16.336
  718   2HG   GLU  88          1HG       GLU  88   7.819   3.072 -14.602
  719    H    LEU  89           H        LEU  89   9.881  -1.130 -15.020
  720    HA   LEU  89           HA       LEU  89  12.571  -1.201 -16.310
  721   1HB   LEU  89          2HB       LEU  89  12.850  -0.440 -13.966
  722   2HB   LEU  89          1HB       LEU  89  11.982  -1.868 -13.405
  723    HG   LEU  89           HG       LEU  89  13.726  -3.302 -14.483
  724   1HD1  LEU  89          1HD1      LEU  89  14.640  -1.967 -16.202
  725   2HD1  LEU  89          2HD1      LEU  89  15.915  -1.995 -14.984
  726   3HD1  LEU  89          3HD1      LEU  89  14.867  -0.585 -15.131
  727   1HD2  LEU  89          1HD2      LEU  89  15.443  -2.894 -12.793
  728   2HD2  LEU  89          2HD2      LEU  89  13.852  -2.634 -12.078
  729   3HD2  LEU  89          3HD2      LEU  89  14.846  -1.253 -12.543
  730    H    VAL  90           H        VAL  90   9.851  -2.907 -14.859
  731    HA   VAL  90           HA       VAL  90  10.890  -5.472 -15.991
  732    HB   VAL  90           HB       VAL  90   8.621  -5.108 -14.013
  733   1HG1  VAL  90          1HG1      VAL  90  10.294  -7.485 -14.885
  734   2HG1  VAL  90          2HG1      VAL  90   8.575  -7.236 -15.193
  735   3HG1  VAL  90          3HG1      VAL  90   9.145  -7.518 -13.548
  736   1HG2  VAL  90          1HG2      VAL  90  10.369  -5.906 -12.340
  737   2HG2  VAL  90          2HG2      VAL  90  10.589  -4.257 -12.923
  738   3HG2  VAL  90          3HG2      VAL  90  11.586  -5.559 -13.569
  739    H    GLY  91           H        GLY  91   9.956  -6.131 -17.855
  740   1HA   GLY  91          2HA       GLY  91   7.230  -6.350 -18.410
  741   2HA   GLY  91          1HA       GLY  91   7.680  -4.748 -18.995
  742    H    SER  92           H        SER  92   6.867  -6.256 -20.973
  743    HA   SER  92           HA       SER  92   8.915  -7.982 -22.114
  744   1HB   SER  92          2HB       SER  92   6.606  -8.403 -22.704
  745   2HB   SER  92          1HB       SER  92   6.397  -6.748 -23.269
  746    HG   SER  92           HG       SER  92   8.445  -8.297 -24.380
  Start of MODEL    5
    1    HA   MET   1           HA       MET   1 -26.532   4.994  -7.624
    2   1HB   MET   1          2HB       MET   1 -27.117   3.545  -9.537
    3   2HB   MET   1          1HB       MET   1 -25.717   2.528  -9.199
    4   1HG   MET   1          2HG       MET   1 -26.633   1.968  -6.988
    5   2HG   MET   1          1HG       MET   1 -28.019   3.018  -7.284
    6   1HE   MET   1          1HE       MET   1 -29.585  -0.510  -7.443
    7   2HE   MET   1          2HE       MET   1 -29.584   1.080  -6.683
    8   3HE   MET   1          3HE       MET   1 -28.225  -0.012  -6.428
    9    H    GLU   2           H        GLU   2 -24.069   2.460  -8.156
   10    HA   GLU   2           HA       GLU   2 -22.731   3.074  -5.624
   11   1HB   GLU   2          2HB       GLU   2 -24.869   1.720  -5.079
   12   2HB   GLU   2          1HB       GLU   2 -24.047   0.363  -5.846
   13   1HG   GLU   2          2HG       GLU   2 -22.156   0.611  -4.284
   14   2HG   GLU   2          1HG       GLU   2 -22.962   1.984  -3.522
   15    H    LYS   3           H        LYS   3 -23.158   1.051  -8.459
   16    HA   LYS   3           HA       LYS   3 -20.506  -0.204  -8.121
   17   1HB   LYS   3          2HB       LYS   3 -22.540  -0.417 -10.365
   18   2HB   LYS   3          1HB       LYS   3 -21.075  -1.388 -10.220
   19   1HG   LYS   3          2HG       LYS   3 -22.977  -1.320  -7.902
   20   2HG   LYS   3          1HG       LYS   3 -23.394  -2.300  -9.308
   21   1HD   LYS   3          2HD       LYS   3 -21.276  -3.509  -9.142
   22   2HD   LYS   3          1HD       LYS   3 -20.769  -2.483  -7.800
   23   1HE   LYS   3          2HE       LYS   3 -22.589  -3.319  -6.414
   24   2HE   LYS   3          1HE       LYS   3 -23.231  -4.253  -7.765
   25   1HZ   LYS   3          1HZ       LYS   3 -20.800  -5.207  -7.749
   26   2HZ   LYS   3          2HZ       LYS   3 -22.006  -5.844  -6.735
   27   3HZ   LYS   3          3HZ       LYS   3 -20.864  -4.746  -6.118
   28    H    GLY   4           H        GLY   4 -21.186   2.791  -8.779
   29   1HA   GLY   4          2HA       GLY   4 -20.389   3.569 -11.315
   30   2HA   GLY   4          1HA       GLY   4 -19.962   4.480  -9.867
   31    H    GLY   5           H        GLY   5 -18.359   2.179  -8.803
   32   1HA   GLY   5          2HA       GLY   5 -16.362   1.104 -10.271
   33   2HA   GLY   5          1HA       GLY   5 -15.886   2.802 -10.291
   34    H    GLU   6           H        GLU   6 -14.064   1.315  -9.164
   35    HA   GLU   6           HA       GLU   6 -14.084   2.129  -6.360
   36   1HB   GLU   6          2HB       GLU   6 -15.262  -0.266  -6.714
   37   2HB   GLU   6          1HB       GLU   6 -13.582  -0.798  -6.684
   38   1HG   GLU   6          2HG       GLU   6 -15.035   0.783  -4.545
   39   2HG   GLU   6          1HG       GLU   6 -14.414  -0.862  -4.415
   40    H    ALA   7           H        ALA   7 -12.468  -0.275  -8.463
   41    HA   ALA   7           HA       ALA   7 -10.238  -0.425  -9.156
   42   1HB   ALA   7          1HB       ALA   7  -8.901   1.505  -9.255
   43   2HB   ALA   7          2HB       ALA   7  -9.624   2.205  -7.809
   44   3HB   ALA   7          3HB       ALA   7 -10.532   2.165  -9.318
   45    H    LEU   8           H        LEU   8  -8.769   1.407  -6.664
   46    HA   LEU   8           HA       LEU   8  -8.657  -0.948  -4.851
   47   1HB   LEU   8          2HB       LEU   8  -6.194  -0.137  -4.480
   48   2HB   LEU   8          1HB       LEU   8  -6.551  -1.135  -5.880
   49    HG   LEU   8           HG       LEU   8  -5.096   0.904  -6.318
   50   1HD1  LEU   8          1HD1      LEU   8  -5.765   0.493  -8.411
   51   2HD1  LEU   8          2HD1      LEU   8  -7.137   1.570  -8.162
   52   3HD1  LEU   8          3HD1      LEU   8  -7.298  -0.153  -7.829
   53   1HD2  LEU   8          1HD2      LEU   8  -7.729   2.311  -5.770
   54   2HD2  LEU   8          2HD2      LEU   8  -6.393   3.051  -6.632
   55   3HD2  LEU   8          3HD2      LEU   8  -6.191   2.567  -4.949
   56    H    LYS   9           H        LYS   9 -10.087   1.711  -4.947
   57    HA   LYS   9           HA       LYS   9  -8.848   3.248  -2.759
   58   1HB   LYS   9          2HB       LYS   9 -11.297   3.627  -4.488
   59   2HB   LYS   9          1HB       LYS   9 -10.996   4.645  -3.080
   60   1HG   LYS   9          2HG       LYS   9  -9.270   5.746  -4.079
   61   2HG   LYS   9          1HG       LYS   9  -8.673   4.293  -4.878
   62   1HD   LYS   9          2HD       LYS   9  -9.450   5.598  -6.675
   63   2HD   LYS   9          1HD       LYS   9 -10.800   4.508  -6.365
   64   1HE   LYS   9          2HE       LYS   9 -11.724   6.720  -6.577
   65   2HE   LYS   9          1HE       LYS   9 -11.777   6.305  -4.865
   66   1HZ   LYS   9          1HZ       LYS   9  -9.748   7.542  -4.518
   67   2HZ   LYS   9          2HZ       LYS   9 -10.916   8.543  -5.238
   68   3HZ   LYS   9          3HZ       LYS   9  -9.646   7.908  -6.171
   69    H    GLY  10           H        GLY  10 -10.698   4.039  -1.090
   70   1HA   GLY  10          2HA       GLY  10 -12.267   3.436   0.575
   71   2HA   GLY  10          1HA       GLY  10 -12.568   1.934  -0.302
   72    H    LEU  11           H        LEU  11  -9.371   1.926  -0.204
   73    HA   LEU  11           HA       LEU  11  -9.267   0.496   2.422
   74   1HB   LEU  11          2HB       LEU  11  -7.560   0.109  -0.059
   75   2HB   LEU  11          1HB       LEU  11  -7.417  -0.812   1.437
   76    HG   LEU  11           HG       LEU  11  -9.991  -0.676  -0.153
   77   1HD1  LEU  11          1HD1      LEU  11  -7.797  -2.769  -0.269
   78   2HD1  LEU  11          2HD1      LEU  11  -8.227  -1.655  -1.566
   79   3HD1  LEU  11          3HD1      LEU  11  -9.372  -2.894  -1.053
   80   1HD2  LEU  11          1HD2      LEU  11  -8.929  -2.425   2.083
   81   2HD2  LEU  11          2HD2      LEU  11 -10.354  -2.850   1.134
   82   3HD2  LEU  11          3HD2      LEU  11 -10.352  -1.383   2.112
   83    H    THR  12           H        THR  12  -7.452   0.836   3.742
   84    HA   THR  12           HA       THR  12  -5.974   3.363   3.162
   85    HB   THR  12           HB       THR  12  -6.690   1.964   5.750
   86    HG1  THR  12           HG1      THR  12  -8.302   3.269   5.369
   87   1HG2  THR  12          1HG2      THR  12  -5.543   4.155   6.673
   88   2HG2  THR  12          2HG2      THR  12  -4.654   4.089   5.152
   89   3HG2  THR  12          3HG2      THR  12  -4.559   2.743   6.288
   90    H    PHE  13           H        PHE  13  -3.755   3.304   3.091
   91    HA   PHE  13           HA       PHE  13  -2.451   0.654   3.579
   92   1HB   PHE  13          2HB       PHE  13  -1.975   2.753   1.455
   93   2HB   PHE  13          1HB       PHE  13  -0.784   1.508   1.822
   94    HD1  PHE  13           HD1      PHE  13  -3.475   2.283  -0.272
   95    HD2  PHE  13           HD2      PHE  13  -1.891  -0.966   2.053
   96    HE1  PHE  13           HE1      PHE  13  -4.727   0.663  -1.674
   97    HE2  PHE  13           HE2      PHE  13  -3.141  -2.582   0.646
   98    HZ   PHE  13           HZ       PHE  13  -4.564  -1.764  -1.218
   99    H    VAL  14           H        VAL  14  -0.979   0.712   5.201
  100    HA   VAL  14           HA       VAL  14   0.168   3.376   5.950
  101    HB   VAL  14           HB       VAL  14  -0.224   1.040   7.822
  102   1HG1  VAL  14          1HG1      VAL  14   0.019   3.991   8.402
  103   2HG1  VAL  14          2HG1      VAL  14   1.396   2.891   8.394
  104   3HG1  VAL  14          3HG1      VAL  14   0.091   2.662   9.554
  105   1HG2  VAL  14          1HG2      VAL  14  -2.438   1.614   7.048
  106   2HG2  VAL  14          2HG2      VAL  14  -2.091   3.337   7.176
  107   3HG2  VAL  14          3HG2      VAL  14  -2.231   2.357   8.633
  108    H    ILE  15           H        ILE  15   2.320   3.449   6.608
  109    HA   ILE  15           HA       ILE  15   4.010   1.103   5.821
  110    HB   ILE  15           HB       ILE  15   5.200   3.805   6.296
  111   1HG1  ILE  15          2HG1      ILE  15   3.059   4.188   4.951
  112   2HG1  ILE  15          1HG1      ILE  15   4.550   4.729   4.191
  113   1HG2  ILE  15          1HG2      ILE  15   6.568   1.867   5.647
  114   2HG2  ILE  15          2HG2      ILE  15   6.617   3.124   4.416
  115   3HG2  ILE  15          3HG2      ILE  15   5.624   1.690   4.169
  116   1HD1  ILE  15          1HD1      ILE  15   3.924   1.942   3.547
  117   2HD1  ILE  15          2HD1      ILE  15   4.313   3.284   2.471
  118   3HD1  ILE  15          3HD1      ILE  15   2.658   3.057   3.036
  119    H    THR  16           H        THR  16   4.879   0.007   7.673
  120    HA   THR  16           HA       THR  16   4.433   1.057  10.289
  121    HB   THR  16           HB       THR  16   6.033  -1.199   9.118
  122    HG1  THR  16           HG1      THR  16   3.857  -1.039  10.932
  123   1HG2  THR  16          1HG2      THR  16   6.305  -1.851  11.629
  124   2HG2  THR  16          2HG2      THR  16   6.105  -0.124  11.920
  125   3HG2  THR  16          3HG2      THR  16   7.433  -0.701  10.917
  126    H    GLY  17           H        GLY  17   5.475   2.979  10.803
  127   1HA   GLY  17          2HA       GLY  17   7.269   4.536  10.937
  128   2HA   GLY  17          1HA       GLY  17   8.041   3.156  11.723
  129    H    GLU  18           H        GLU  18   7.030   3.152   8.377
  130    HA   GLU  18           HA       GLU  18   8.200   3.259   6.393
  131   1HB   GLU  18          2HB       GLU  18  10.677   3.802   8.057
  132   2HB   GLU  18          1HB       GLU  18  10.568   3.909   6.308
  133   1HG   GLU  18          2HG       GLU  18   8.452   5.488   7.107
  134   2HG   GLU  18          1HG       GLU  18   9.659   5.819   8.349
  135    H    LEU  19           H        LEU  19   8.242   1.331   5.458
  136    HA   LEU  19           HA       LEU  19   9.276  -1.033   6.781
  137   1HB   LEU  19          2HB       LEU  19   8.090  -0.409   4.091
  138   2HB   LEU  19          1HB       LEU  19   8.989  -1.910   4.280
  139    HG   LEU  19           HG       LEU  19   7.537  -2.374   6.324
  140   1HD1  LEU  19          1HD1      LEU  19   5.395  -1.174   6.425
  141   2HD1  LEU  19          2HD1      LEU  19   5.893  -0.152   5.078
  142   3HD1  LEU  19          3HD1      LEU  19   6.736  -0.047   6.623
  143   1HD2  LEU  19          1HD2      LEU  19   6.316  -2.164   3.554
  144   2HD2  LEU  19          2HD2      LEU  19   5.578  -3.061   4.881
  145   3HD2  LEU  19          3HD2      LEU  19   7.145  -3.558   4.244
  146    H    SER  20           H        SER  20  10.734  -2.343   4.755
  147    HA   SER  20           HA       SER  20  13.223  -0.699   4.659
  148   1HB   SER  20          2HB       SER  20  13.561  -2.897   5.619
  149   2HB   SER  20          1HB       SER  20  12.732  -3.670   4.271
  150    HG   SER  20           HG       SER  20  15.151  -2.178   4.155
  151    H    ARG  21           H        ARG  21  11.454   0.276   2.931
  152    HA   ARG  21           HA       ARG  21  12.594  -0.404   0.282
  153   1HB   ARG  21          2HB       ARG  21  10.094  -0.377  -0.571
  154   2HB   ARG  21          1HB       ARG  21  10.769  -1.862   0.091
  155   1HG   ARG  21          2HG       ARG  21   9.330  -1.843   1.833
  156   2HG   ARG  21          1HG       ARG  21   9.653  -0.145   2.176
  157   1HD   ARG  21          2HD       ARG  21   7.262  -0.664   1.502
  158   2HD   ARG  21          1HD       ARG  21   8.057   0.582   0.540
  159    HE   ARG  21           HE       ARG  21   7.966  -2.241  -0.434
  160   1HH1  ARG  21          1HH1      ARG  21   6.236   0.626  -0.585
  161   2HH1  ARG  21          2HH1      ARG  21   6.250   0.752  -2.313
  162   1HH2  ARG  21          1HH2      ARG  21   8.472  -1.874  -2.750
  163   2HH2  ARG  21          2HH2      ARG  21   7.515  -0.663  -3.538
  164    HA   PRO  22           HA       PRO  22  12.025   3.934  -0.467
  165   1HB   PRO  22          2HB       PRO  22  11.038   4.078  -3.022
  166   2HB   PRO  22          1HB       PRO  22  12.720   3.659  -2.648
  167   1HG   PRO  22          2HG       PRO  22  10.429   1.869  -3.313
  168   2HG   PRO  22          1HG       PRO  22  12.113   1.799  -3.865
  169   1HD   PRO  22          2HD       PRO  22  11.184   0.182  -1.897
  170   2HD   PRO  22          1HD       PRO  22  12.857   0.777  -1.912
  171    H    ARG  23           H        ARG  23   9.821   2.653   0.868
  172    HA   ARG  23           HA       ARG  23   7.236   3.029   0.048
  173   1HB   ARG  23          2HB       ARG  23   6.617   3.127   2.318
  174   2HB   ARG  23          1HB       ARG  23   8.157   2.268   2.329
  175   1HG   ARG  23          2HG       ARG  23   8.866   4.980   2.457
  176   2HG   ARG  23          1HG       ARG  23   7.478   4.833   3.532
  177   1HD   ARG  23          2HD       ARG  23   9.203   4.276   4.970
  178   2HD   ARG  23          1HD       ARG  23   8.758   2.682   4.374
  179    HE   ARG  23           HE       ARG  23  10.861   2.563   3.328
  180   1HH1  ARG  23          1HH1      ARG  23  12.044   4.449   5.256
  181   2HH1  ARG  23          2HH1      ARG  23  12.669   5.705   4.240
  182   1HH2  ARG  23          1HH2      ARG  23  10.795   4.771   1.477
  183   2HH2  ARG  23          2HH2      ARG  23  11.961   5.889   2.103
  184    H    GLU  24           H        GLU  24   9.495   5.589   0.234
  185    HA   GLU  24           HA       GLU  24   7.494   7.683   0.766
  186   1HB   GLU  24          2HB       GLU  24  10.370   7.856  -0.210
  187   2HB   GLU  24          1HB       GLU  24   9.367   9.241   0.225
  188   1HG   GLU  24          2HG       GLU  24  10.064   6.961   2.101
  189   2HG   GLU  24          1HG       GLU  24  10.874   8.528   2.085
  190    H    GLU  25           H        GLU  25   9.589   6.809  -1.957
  191    HA   GLU  25           HA       GLU  25   8.403   8.392  -3.967
  192   1HB   GLU  25          2HB       GLU  25   9.597   5.607  -4.183
  193   2HB   GLU  25          1HB       GLU  25   9.204   6.622  -5.571
  194   1HG   GLU  25          2HG       GLU  25  10.974   7.646  -3.352
  195   2HG   GLU  25          1HG       GLU  25  11.639   6.690  -4.677
  196    H    VAL  26           H        VAL  26   7.574   5.031  -3.048
  197    HA   VAL  26           HA       VAL  26   5.325   4.808  -4.796
  198    HB   VAL  26           HB       VAL  26   6.575   2.975  -3.397
  199   1HG1  VAL  26          1HG1      VAL  26   5.934   4.176  -1.225
  200   2HG1  VAL  26          2HG1      VAL  26   5.643   2.439  -1.273
  201   3HG1  VAL  26          3HG1      VAL  26   4.303   3.564  -1.491
  202   1HG2  VAL  26          1HG2      VAL  26   4.610   1.522  -3.557
  203   2HG2  VAL  26          2HG2      VAL  26   4.666   2.592  -4.958
  204   3HG2  VAL  26          3HG2      VAL  26   3.548   2.928  -3.635
  205    H    LYS  27           H        LYS  27   5.730   6.294  -1.633
  206    HA   LYS  27           HA       LYS  27   2.994   6.450  -0.854
  207   1HB   LYS  27          2HB       LYS  27   5.351   7.319   0.245
  208   2HB   LYS  27          1HB       LYS  27   4.633   8.842  -0.266
  209   1HG   LYS  27          2HG       LYS  27   3.774   8.528   1.909
  210   2HG   LYS  27          1HG       LYS  27   2.470   7.968   0.864
  211   1HD   LYS  27          2HD       LYS  27   3.825   5.651   1.127
  212   2HD   LYS  27          1HD       LYS  27   4.269   6.409   2.657
  213   1HE   LYS  27          2HE       LYS  27   1.437   6.018   1.639
  214   2HE   LYS  27          1HE       LYS  27   2.211   5.068   2.904
  215   1HZ   LYS  27          1HZ       LYS  27   1.306   7.859   2.969
  216   2HZ   LYS  27          2HZ       LYS  27   2.618   7.400   3.945
  217   3HZ   LYS  27          3HZ       LYS  27   1.112   6.636   4.129
  218    H    ALA  28           H        ALA  28   4.940   8.462  -3.027
  219    HA   ALA  28           HA       ALA  28   2.914  10.483  -3.432
  220   1HB   ALA  28          1HB       ALA  28   5.166   9.654  -5.292
  221   2HB   ALA  28          2HB       ALA  28   5.341  10.805  -3.968
  222   3HB   ALA  28          3HB       ALA  28   4.285  11.181  -5.329
  223    H    LEU  29           H        LEU  29   3.754   7.427  -4.980
  224    HA   LEU  29           HA       LEU  29   1.718   7.728  -7.078
  225   1HB   LEU  29          2HB       LEU  29   3.935   5.944  -6.493
  226   2HB   LEU  29          1HB       LEU  29   2.487   5.020  -6.882
  227    HG   LEU  29           HG       LEU  29   2.203   6.357  -8.954
  228   1HD1  LEU  29          1HD1      LEU  29   4.735   7.672  -7.942
  229   2HD1  LEU  29          2HD1      LEU  29   3.217   8.445  -8.398
  230   3HD1  LEU  29          3HD1      LEU  29   4.252   7.738  -9.637
  231   1HD2  LEU  29          1HD2      LEU  29   4.966   5.133  -8.642
  232   2HD2  LEU  29          2HD2      LEU  29   4.127   5.401 -10.170
  233   3HD2  LEU  29          3HD2      LEU  29   3.488   4.242  -9.005
  234    H    LEU  30           H        LEU  30   1.957   6.392  -3.865
  235    HA   LEU  30           HA       LEU  30  -0.381   4.682  -4.044
  236   1HB   LEU  30          2HB       LEU  30   1.505   4.379  -2.406
  237   2HB   LEU  30          1HB       LEU  30   0.961   5.834  -1.578
  238    HG   LEU  30           HG       LEU  30  -1.182   4.804  -1.071
  239   1HD1  LEU  30          1HD1      LEU  30  -1.746   3.447  -2.887
  240   2HD1  LEU  30          2HD1      LEU  30  -1.307   2.250  -1.670
  241   3HD1  LEU  30          3HD1      LEU  30  -0.158   2.682  -2.934
  242   1HD2  LEU  30          1HD2      LEU  30   0.076   4.126   0.704
  243   2HD2  LEU  30          2HD2      LEU  30   1.374   3.524  -0.326
  244   3HD2  LEU  30          3HD2      LEU  30  -0.054   2.531  -0.037
  245    H    ARG  31           H        ARG  31   0.242   7.873  -2.525
  246    HA   ARG  31           HA       ARG  31  -2.437   8.337  -1.665
  247   1HB   ARG  31          2HB       ARG  31  -0.194   9.675  -1.230
  248   2HB   ARG  31          1HB       ARG  31  -0.712  10.598  -2.640
  249   1HG   ARG  31          2HG       ARG  31  -2.915  10.992  -1.525
  250   2HG   ARG  31          1HG       ARG  31  -2.304  10.163  -0.093
  251   1HD   ARG  31          2HD       ARG  31  -1.701  12.283   0.527
  252   2HD   ARG  31          1HD       ARG  31  -0.296  11.940  -0.480
  253    HE   ARG  31           HE       ARG  31  -2.322  13.900  -1.058
  254   1HH1  ARG  31          1HH1      ARG  31   0.578  13.556  -2.127
  255   2HH1  ARG  31          2HH1      ARG  31   0.258  13.410  -3.824
  256   1HH2  ARG  31          1HH2      ARG  31  -3.132  12.822  -3.407
  257   2HH2  ARG  31          2HH2      ARG  31  -1.839  12.997  -4.547
  258    H    ARG  32           H        ARG  32  -0.758   9.148  -4.656
  259    HA   ARG  32           HA       ARG  32  -2.920  10.489  -5.977
  260   1HB   ARG  32          2HB       ARG  32  -0.486  10.356  -6.756
  261   2HB   ARG  32          1HB       ARG  32  -0.863   8.742  -7.360
  262   1HG   ARG  32          2HG       ARG  32  -2.447   9.572  -8.921
  263   2HG   ARG  32          1HG       ARG  32  -2.533  11.143  -8.121
  264   1HD   ARG  32          2HD       ARG  32  -0.024  10.076  -9.443
  265   2HD   ARG  32          1HD       ARG  32  -1.177  11.141 -10.250
  266    HE   ARG  32           HE       ARG  32  -0.578  12.496  -7.916
  267   1HH1  ARG  32          1HH1      ARG  32   0.291  13.506 -10.590
  268   2HH1  ARG  32          2HH1      ARG  32   2.014  13.553 -10.422
  269   1HH2  ARG  32          1HH2      ARG  32   2.061  11.497  -7.630
  270   2HH2  ARG  32          2HH2      ARG  32   3.017  12.415  -8.746
  271    H    LEU  33           H        LEU  33  -2.128   7.115  -5.513
  272    HA   LEU  33           HA       LEU  33  -3.906   5.949  -7.407
  273   1HB   LEU  33          2HB       LEU  33  -2.010   4.888  -5.962
  274   2HB   LEU  33          1HB       LEU  33  -3.271   4.673  -4.753
  275    HG   LEU  33           HG       LEU  33  -4.602   3.362  -6.294
  276   1HD1  LEU  33          1HD1      LEU  33  -3.317   2.747  -8.529
  277   2HD1  LEU  33          2HD1      LEU  33  -2.569   4.322  -8.272
  278   3HD1  LEU  33          3HD1      LEU  33  -4.320   4.194  -8.442
  279   1HD2  LEU  33          1HD2      LEU  33  -1.699   2.597  -6.028
  280   2HD2  LEU  33          2HD2      LEU  33  -2.851   1.521  -6.820
  281   3HD2  LEU  33          3HD2      LEU  33  -3.088   1.979  -5.134
  282    H    GLY  34           H        GLY  34  -4.951   8.059  -5.232
  283   1HA   GLY  34          2HA       GLY  34  -7.124   8.493  -4.457
  284   2HA   GLY  34          1HA       GLY  34  -7.643   6.991  -5.216
  285    H    ALA  35           H        ALA  35  -5.906   5.194  -3.815
  286    HA   ALA  35           HA       ALA  35  -7.426   4.628  -1.507
  287   1HB   ALA  35          1HB       ALA  35  -5.639   3.070  -0.908
  288   2HB   ALA  35          2HB       ALA  35  -4.527   3.886  -2.007
  289   3HB   ALA  35          3HB       ALA  35  -5.916   3.009  -2.648
  290    H    LYS  36           H        LYS  36  -7.167   5.114   0.683
  291    HA   LYS  36           HA       LYS  36  -5.764   7.590   1.306
  292   1HB   LYS  36          2HB       LYS  36  -7.930   6.845   2.384
  293   2HB   LYS  36          1HB       LYS  36  -7.007   5.612   3.244
  294   1HG   LYS  36          2HG       LYS  36  -5.588   7.374   4.246
  295   2HG   LYS  36          1HG       LYS  36  -6.521   8.606   3.397
  296   1HD   LYS  36          2HD       LYS  36  -7.930   6.618   5.163
  297   2HD   LYS  36          1HD       LYS  36  -7.134   8.020   5.880
  298   1HE   LYS  36          2HE       LYS  36  -8.436   9.502   4.354
  299   2HE   LYS  36          1HE       LYS  36  -9.281   8.082   3.737
  300   1HZ   LYS  36          1HZ       LYS  36 -10.668   8.895   5.393
  301   2HZ   LYS  36          2HZ       LYS  36  -9.383   9.256   6.443
  302   3HZ   LYS  36          3HZ       LYS  36  -9.832   7.641   6.171
  303    H    VAL  37           H        VAL  37  -3.894   7.798   2.672
  304    HA   VAL  37           HA       VAL  37  -2.423   5.241   3.150
  305    HB   VAL  37           HB       VAL  37  -0.356   6.349   2.528
  306   1HG1  VAL  37          1HG1      VAL  37  -0.707   6.506   0.187
  307   2HG1  VAL  37          2HG1      VAL  37  -2.355   7.098   0.392
  308   3HG1  VAL  37          3HG1      VAL  37  -1.972   5.415   0.753
  309   1HG2  VAL  37          1HG2      VAL  37  -0.466   8.693   1.590
  310   2HG2  VAL  37          2HG2      VAL  37  -0.789   8.599   3.320
  311   3HG2  VAL  37          3HG2      VAL  37  -2.124   8.791   2.184
  312    H    THR  38           H        THR  38  -0.781   5.433   4.887
  313    HA   THR  38           HA       THR  38  -0.912   7.697   6.720
  314    HB   THR  38           HB       THR  38  -1.648   5.306   8.237
  315    HG1  THR  38           HG1      THR  38  -3.534   6.361   6.404
  316   1HG2  THR  38          1HG2      THR  38  -2.962   8.021   7.948
  317   2HG2  THR  38          2HG2      THR  38  -1.656   7.647   9.073
  318   3HG2  THR  38          3HG2      THR  38  -3.225   6.866   9.256
  319    H    ASP  39           H        ASP  39   0.143   6.553   8.981
  320    HA   ASP  39           HA       ASP  39   2.312   4.715   8.192
  321   1HB   ASP  39          2HB       ASP  39   4.027   6.319   9.198
  322   2HB   ASP  39          1HB       ASP  39   3.372   6.786   7.628
  323    H    SER  40           H        SER  40   0.153   5.929  10.504
  324    HA   SER  40           HA       SER  40   1.553   4.427  12.673
  325   1HB   SER  40          2HB       SER  40   1.446   6.907  13.065
  326   2HB   SER  40          1HB       SER  40  -0.312   6.800  13.003
  327    HG   SER  40           HG       SER  40   1.454   5.526  14.827
  328    H    VAL  41           H        VAL  41  -0.297   3.911  14.444
  329    HA   VAL  41           HA       VAL  41  -2.830   3.153  13.100
  330    HB   VAL  41           HB       VAL  41  -2.597   0.815  14.069
  331   1HG1  VAL  41          1HG1      VAL  41  -1.435   0.004  12.157
  332   2HG1  VAL  41          2HG1      VAL  41  -0.454   1.462  12.035
  333   3HG1  VAL  41          3HG1      VAL  41  -2.172   1.519  11.640
  334   1HG2  VAL  41          1HG2      VAL  41   0.304   1.690  14.297
  335   2HG2  VAL  41          2HG2      VAL  41  -0.294   0.050  14.538
  336   3HG2  VAL  41          3HG2      VAL  41  -0.766   1.332  15.652
  337    H    SER  42           H        SER  42  -4.550   2.829  14.555
  338    HA   SER  42           HA       SER  42  -3.995   3.199  17.458
  339   1HB   SER  42          2HB       SER  42  -5.863   4.871  17.558
  340   2HB   SER  42          1HB       SER  42  -4.479   5.443  16.635
  341    HG   SER  42           HG       SER  42  -5.600   4.730  14.742
  342    H    ARG  43           H        ARG  43  -6.458   2.591  14.953
  343    HA   ARG  43           HA       ARG  43  -7.366   0.143  16.088
  344   1HB   ARG  43          2HB       ARG  43  -8.323   1.486  17.885
  345   2HB   ARG  43          1HB       ARG  43  -9.039   2.602  16.724
  346   1HG   ARG  43          2HG       ARG  43 -10.747   1.046  17.542
  347   2HG   ARG  43          1HG       ARG  43 -10.436   0.745  15.834
  348   1HD   ARG  43          2HD       ARG  43  -9.333  -1.259  16.244
  349   2HD   ARG  43          1HD       ARG  43  -8.851  -0.781  17.872
  350    HE   ARG  43           HE       ARG  43 -11.742  -1.105  17.539
  351   1HH1  ARG  43          1HH2      ARG  43  -9.814  -1.607  19.949
  352   2HH1  ARG  43          2HH2      ARG  43 -10.019  -3.317  20.135
  353   1HH2  ARG  43          1HH1      ARG  43 -11.546  -3.738  17.051
  354   2HH2  ARG  43          2HH1      ARG  43 -10.999  -4.522  18.495
  355    H    LYS  44           H        LYS  44  -9.015   2.971  14.685
  356    HA   LYS  44           HA       LYS  44 -10.455   1.517  12.699
  357   1HB   LYS  44          2HB       LYS  44  -9.507   4.386  12.442
  358   2HB   LYS  44          1HB       LYS  44 -10.925   3.654  11.686
  359   1HG   LYS  44          2HG       LYS  44 -11.585   3.115  14.197
  360   2HG   LYS  44          1HG       LYS  44 -10.506   4.468  14.542
  361   1HD   LYS  44          2HD       LYS  44 -11.854   5.711  12.686
  362   2HD   LYS  44          1HD       LYS  44 -13.066   4.458  12.954
  363   1HE   LYS  44          2HE       LYS  44 -11.904   6.222  15.133
  364   2HE   LYS  44          1HE       LYS  44 -13.463   6.488  14.353
  365   1HZ   LYS  44          1HZ       LYS  44 -14.408   4.875  15.539
  366   2HZ   LYS  44          2HZ       LYS  44 -13.047   4.965  16.553
  367   3HZ   LYS  44          3HZ       LYS  44 -13.112   3.804  15.315
  368    H    THR  45           H        THR  45  -7.189   2.791  12.764
  369    HA   THR  45           HA       THR  45  -6.767   1.811   9.967
  370    HB   THR  45           HB       THR  45  -4.930   3.656  11.509
  371    HG1  THR  45           HG1      THR  45  -6.970   4.626  11.332
  372   1HG2  THR  45          1HG2      THR  45  -5.347   3.144   8.552
  373   2HG2  THR  45          2HG2      THR  45  -4.019   2.508   9.519
  374   3HG2  THR  45          3HG2      THR  45  -4.160   4.245   9.248
  375    H    SER  46           H        SER  46  -5.577  -0.037   9.794
  376    HA   SER  46           HA       SER  46  -3.330  -0.597  11.558
  377   1HB   SER  46          2HB       SER  46  -4.263  -2.623  12.570
  378   2HB   SER  46          1HB       SER  46  -5.214  -1.212  13.009
  379    HG   SER  46           HG       SER  46  -6.310  -1.999  10.837
  380    H    TYR  47           H        TYR  47  -3.906  -0.422   8.728
  381    HA   TYR  47           HA       TYR  47  -3.373  -3.223   7.831
  382   1HB   TYR  47          2HB       TYR  47  -4.371  -0.824   6.261
  383   2HB   TYR  47          1HB       TYR  47  -4.051  -2.418   5.577
  384    HD1  TYR  47           HD1      TYR  47  -6.162  -0.548   7.995
  385    HD2  TYR  47           HD2      TYR  47  -5.592  -4.234   5.862
  386    HE1  TYR  47           HE1      TYR  47  -8.421  -1.298   8.687
  387    HE2  TYR  47           HE2      TYR  47  -7.853  -4.982   6.553
  388    HH   TYR  47           HH       TYR  47 -10.001  -3.916   7.268
  389    H    LEU  48           H        LEU  48  -1.410  -3.657   6.873
  390    HA   LEU  48           HA       LEU  48   0.410  -1.323   6.427
  391   1HB   LEU  48          2HB       LEU  48   1.503  -2.392   8.152
  392   2HB   LEU  48          1HB       LEU  48   0.824  -3.964   7.751
  393    HG   LEU  48           HG       LEU  48   2.628  -2.946   5.653
  394   1HD1  LEU  48          1HD1      LEU  48   3.653  -1.973   7.748
  395   2HD1  LEU  48          2HD1      LEU  48   4.678  -3.126   6.898
  396   3HD1  LEU  48          3HD1      LEU  48   3.817  -3.620   8.355
  397   1HD2  LEU  48          1HD2      LEU  48   1.773  -5.275   5.826
  398   2HD2  LEU  48          2HD2      LEU  48   2.611  -5.453   7.367
  399   3HD2  LEU  48          3HD2      LEU  48   3.535  -5.221   5.883
  400    H    VAL  49           H        VAL  49   1.239  -1.130   4.423
  401    HA   VAL  49           HA       VAL  49   0.522  -3.117   2.370
  402    HB   VAL  49           HB       VAL  49   2.380  -1.142   1.397
  403   1HG1  VAL  49          1HG1      VAL  49   0.900  -1.812  -0.211
  404   2HG1  VAL  49          2HG1      VAL  49   0.015  -0.395   0.348
  405   3HG1  VAL  49          3HG1      VAL  49  -0.428  -2.000   0.930
  406   1HG2  VAL  49          1HG2      VAL  49   0.060  -0.012   2.995
  407   2HG2  VAL  49          2HG2      VAL  49   1.100   0.912   1.910
  408   3HG2  VAL  49          3HG2      VAL  49   1.772   0.192   3.370
  409    H    VAL  50           H        VAL  50   1.836  -4.922   2.269
  410    HA   VAL  50           HA       VAL  50   4.302  -5.231   3.512
  411    HB   VAL  50           HB       VAL  50   3.346  -6.501   0.925
  412   1HG1  VAL  50          1HG1      VAL  50   5.663  -6.974   1.003
  413   2HG1  VAL  50          2HG1      VAL  50   4.919  -8.376   1.772
  414   3HG1  VAL  50          3HG1      VAL  50   5.660  -7.118   2.761
  415   1HG2  VAL  50          1HG2      VAL  50   2.516  -8.271   2.344
  416   2HG2  VAL  50          2HG2      VAL  50   1.912  -6.750   3.001
  417   3HG2  VAL  50          3HG2      VAL  50   3.278  -7.560   3.766
  418    H    GLY  51           H        GLY  51   6.478  -5.471   2.450
  419   1HA   GLY  51          2HA       GLY  51   6.930  -3.664   0.146
  420   2HA   GLY  51          1HA       GLY  51   7.731  -3.244   1.659
  421    H    GLU  52           H        GLU  52   9.764  -3.981   1.818
  422    HA   GLU  52           HA       GLU  52  10.775  -5.990  -0.052
  423   1HB   GLU  52          2HB       GLU  52  11.929  -3.830   0.949
  424   2HB   GLU  52          1HB       GLU  52  12.384  -4.930   2.248
  425   1HG   GLU  52          2HG       GLU  52  14.172  -5.299   0.847
  426   2HG   GLU  52          1HG       GLU  52  13.057  -6.476   0.154
  427    H    ASN  53           H        ASN  53  12.701  -6.697   2.337
  428    HA   ASN  53           HA       ASN  53  10.962  -8.861   3.447
  429   1HB   ASN  53          2HB       ASN  53  12.453 -10.092   2.179
  430   2HB   ASN  53          1HB       ASN  53  13.758  -8.928   2.377
  431   1HD2  ASN  53          1HD2      ASN  53  11.800 -11.213   4.379
  432   2HD2  ASN  53          2HD2      ASN  53  13.084 -11.651   5.398
  433    HA   PRO  54           HA       PRO  54  13.793  -7.587   7.075
  434   1HB   PRO  54          2HB       PRO  54  15.673  -5.640   6.728
  435   2HB   PRO  54          1HB       PRO  54  15.992  -7.354   6.409
  436   1HG   PRO  54          2HG       PRO  54  15.456  -5.145   4.509
  437   2HG   PRO  54          1HG       PRO  54  16.513  -6.554   4.340
  438   1HD   PRO  54          2HD       PRO  54  13.995  -6.324   3.196
  439   2HD   PRO  54          1HD       PRO  54  14.834  -7.858   3.496
  440    H    GLY  55           H        GLY  55  11.683  -5.926   5.469
  441   1HA   GLY  55          2HA       GLY  55  11.847  -3.224   6.431
  442   2HA   GLY  55          1HA       GLY  55  10.396  -3.998   5.806
  443    H    SER  56           H        SER  56  10.631  -2.230   8.104
  444    HA   SER  56           HA       SER  56  10.520  -3.681  10.573
  445   1HB   SER  56          2HB       SER  56  10.805  -1.201  10.372
  446   2HB   SER  56          1HB       SER  56   9.129  -1.083   9.849
  447    HG   SER  56           HG       SER  56   9.624  -2.517  12.179
  448    H    LYS  57           H        LYS  57   8.506  -3.767   7.912
  449    HA   LYS  57           HA       LYS  57   5.876  -3.810   8.864
  450   1HB   LYS  57          2HB       LYS  57   5.364  -5.251   6.983
  451   2HB   LYS  57          1HB       LYS  57   6.613  -4.121   6.476
  452   1HG   LYS  57          2HG       LYS  57   8.336  -5.866   6.996
  453   2HG   LYS  57          1HG       LYS  57   7.027  -6.998   7.334
  454   1HD   LYS  57          2HD       LYS  57   6.152  -6.496   4.995
  455   2HD   LYS  57          1HD       LYS  57   7.679  -5.663   4.699
  456   1HE   LYS  57          2HE       LYS  57   8.937  -7.689   5.134
  457   2HE   LYS  57          1HE       LYS  57   7.475  -8.539   5.635
  458   1HZ   LYS  57          1HZ       LYS  57   7.557  -7.314   2.972
  459   2HZ   LYS  57          2HZ       LYS  57   6.714  -8.690   3.504
  460   3HZ   LYS  57          3HZ       LYS  57   8.387  -8.773   3.219
  461    H    LEU  58           H        LEU  58   8.438  -6.137   9.381
  462    HA   LEU  58           HA       LEU  58   7.120  -8.479  10.036
  463   1HB   LEU  58          2HB       LEU  58   9.436  -7.141  11.454
  464   2HB   LEU  58          1HB       LEU  58   8.910  -8.788  11.809
  465    HG   LEU  58           HG       LEU  58   9.430  -8.014   8.955
  466   1HD1  LEU  58          1HD1      LEU  58  11.416  -7.229  10.203
  467   2HD1  LEU  58          2HD1      LEU  58  11.798  -8.637   9.212
  468   3HD1  LEU  58          3HD1      LEU  58  11.570  -8.820  10.951
  469   1HD2  LEU  58          1HD2      LEU  58   9.776 -10.554  10.583
  470   2HD2  LEU  58          2HD2      LEU  58  10.100 -10.410   8.855
  471   3HD2  LEU  58          3HD2      LEU  58   8.457 -10.210   9.465
  472    H    GLU  59           H        GLU  59   6.994  -5.458  11.808
  473    HA   GLU  59           HA       GLU  59   5.835  -6.678  14.205
  474   1HB   GLU  59          2HB       GLU  59   6.277  -3.841  13.275
  475   2HB   GLU  59          1HB       GLU  59   5.304  -4.184  14.704
  476   1HG   GLU  59          2HG       GLU  59   7.585  -3.789  15.423
  477   2HG   GLU  59          1HG       GLU  59   7.231  -5.504  15.628
  478    H    LYS  60           H        LYS  60   4.471  -4.287  11.887
  479    HA   LYS  60           HA       LYS  60   1.774  -4.961  12.725
  480   1HB   LYS  60          2HB       LYS  60   2.530  -2.727  11.740
  481   2HB   LYS  60          1HB       LYS  60   2.528  -3.530  10.169
  482   1HG   LYS  60          2HG       LYS  60   0.252  -3.584  10.058
  483   2HG   LYS  60          1HG       LYS  60   0.087  -3.993  11.765
  484   1HD   LYS  60          2HD       LYS  60  -0.771  -1.859  11.824
  485   2HD   LYS  60          1HD       LYS  60   0.932  -1.473  12.069
  486   1HE   LYS  60          2HE       LYS  60  -0.036  -1.687   9.251
  487   2HE   LYS  60          1HE       LYS  60  -0.529  -0.269  10.173
  488   1HZ   LYS  60          1HZ       LYS  60   2.261  -1.203   9.773
  489   2HZ   LYS  60          2HZ       LYS  60   1.799   0.139  10.707
  490   3HZ   LYS  60          3HZ       LYS  60   1.543   0.141   9.028
  491    H    ALA  61           H        ALA  61   3.860  -5.897  10.027
  492    HA   ALA  61           HA       ALA  61   1.868  -7.243   8.487
  493   1HB   ALA  61          1HB       ALA  61   4.261  -6.662   7.795
  494   2HB   ALA  61          2HB       ALA  61   3.641  -8.229   7.280
  495   3HB   ALA  61          3HB       ALA  61   4.743  -8.126   8.653
  496    H    ARG  62           H        ARG  62   4.004  -8.434  11.144
  497    HA   ARG  62           HA       ARG  62   3.093 -11.149  10.985
  498   1HB   ARG  62          2HB       ARG  62   4.338  -9.458  13.141
  499   2HB   ARG  62          1HB       ARG  62   3.673 -11.035  13.558
  500   1HG   ARG  62          2HG       ARG  62   5.058 -12.045  11.725
  501   2HG   ARG  62          1HG       ARG  62   5.815 -10.470  11.487
  502   1HD   ARG  62          2HD       ARG  62   5.936 -12.235  13.942
  503   2HD   ARG  62          1HD       ARG  62   7.276 -11.684  12.937
  504    HE   ARG  62           HE       ARG  62   6.687  -9.342  13.804
  505   1HH1  ARG  62          1HH1      ARG  62   4.573 -11.299  15.371
  506   2HH1  ARG  62          2HH1      ARG  62   5.127 -10.970  16.979
  507   1HH2  ARG  62          1HH2      ARG  62   7.989  -9.310  15.937
  508   2HH2  ARG  62          2HH2      ARG  62   7.061  -9.844  17.299
  509    H    ALA  63           H        ALA  63   1.915  -8.249  12.615
  510    HA   ALA  63           HA       ALA  63  -0.042  -7.879  13.875
  511   1HB   ALA  63          1HB       ALA  63  -0.516  -8.662  11.156
  512   2HB   ALA  63          2HB       ALA  63  -1.405  -7.500  12.138
  513   3HB   ALA  63          3HB       ALA  63  -1.860  -9.202  12.156
  514    H    LEU  64           H        LEU  64  -0.091  -9.063  15.796
  515    HA   LEU  64           HA       LEU  64  -0.847 -11.907  15.733
  516   1HB   LEU  64          2HB       LEU  64  -0.892 -11.458  18.333
  517   2HB   LEU  64          1HB       LEU  64   0.648 -11.556  17.489
  518    HG   LEU  64           HG       LEU  64   0.750  -9.101  17.343
  519   1HD1  LEU  64          1HD1      LEU  64  -0.974  -7.821  18.741
  520   2HD1  LEU  64          2HD1      LEU  64  -1.949  -9.290  18.703
  521   3HD1  LEU  64          3HD1      LEU  64  -1.550  -8.457  17.201
  522   1HD2  LEU  64          1HD2      LEU  64   0.103 -10.065  20.148
  523   2HD2  LEU  64          2HD2      LEU  64   1.057  -8.640  19.739
  524   3HD2  LEU  64          3HD2      LEU  64   1.662 -10.248  19.345
  525    H    GLY  65           H        GLY  65  -2.738  -9.915  14.661
  526   1HA   GLY  65          2HA       GLY  65  -5.181 -10.866  15.449
  527   2HA   GLY  65          1HA       GLY  65  -4.860  -9.600  16.637
  528    H    VAL  66           H        VAL  66  -3.299  -8.004  14.678
  529    HA   VAL  66           HA       VAL  66  -5.581  -6.611  13.496
  530    HB   VAL  66           HB       VAL  66  -3.355  -5.282  12.558
  531   1HG1  VAL  66          1HG1      VAL  66  -5.262  -4.272  13.722
  532   2HG1  VAL  66          2HG1      VAL  66  -3.753  -3.750  14.470
  533   3HG1  VAL  66          3HG1      VAL  66  -4.737  -4.992  15.244
  534   1HG2  VAL  66          1HG2      VAL  66  -2.648  -6.184  15.358
  535   2HG2  VAL  66          2HG2      VAL  66  -1.644  -5.304  14.207
  536   3HG2  VAL  66          3HG2      VAL  66  -2.010  -7.006  13.935
  537    HA   PRO  67           HA       PRO  67  -4.957  -8.188   9.387
  538   1HB   PRO  67          2HB       PRO  67  -6.287  -6.272   7.972
  539   2HB   PRO  67          1HB       PRO  67  -7.102  -7.435   9.032
  540   1HG   PRO  67          2HG       PRO  67  -6.691  -4.569   9.393
  541   2HG   PRO  67          1HG       PRO  67  -7.824  -5.656  10.205
  542   1HD   PRO  67          2HD       PRO  67  -5.278  -4.660  11.185
  543   2HD   PRO  67          1HD       PRO  67  -6.479  -5.655  12.037
  544    H    THR  68           H        THR  68  -3.577  -8.040   7.615
  545    HA   THR  68           HA       THR  68  -2.092  -5.462   7.187
  546    HB   THR  68           HB       THR  68  -0.096  -6.839   6.650
  547    HG1  THR  68           HG1      THR  68  -0.456  -9.104   7.615
  548   1HG2  THR  68          1HG2      THR  68   0.044  -7.865   9.098
  549   2HG2  THR  68          2HG2      THR  68  -1.428  -6.925   9.323
  550   3HG2  THR  68          3HG2      THR  68   0.064  -6.122   8.837
  551    H    LEU  69           H        LEU  69  -2.059  -4.818   4.981
  552    HA   LEU  69           HA       LEU  69  -3.350  -6.722   3.090
  553   1HB   LEU  69          2HB       LEU  69  -3.925  -4.086   3.649
  554   2HB   LEU  69          1HB       LEU  69  -2.932  -3.949   2.199
  555    HG   LEU  69           HG       LEU  69  -5.223  -5.915   2.374
  556   1HD1  LEU  69          1HD1      LEU  69  -5.296  -3.039   1.408
  557   2HD1  LEU  69          2HD1      LEU  69  -6.147  -3.686   2.811
  558   3HD1  LEU  69          3HD1      LEU  69  -6.592  -4.215   1.188
  559   1HD2  LEU  69          1HD2      LEU  69  -3.615  -4.646   0.140
  560   2HD2  LEU  69          2HD2      LEU  69  -5.118  -5.522  -0.148
  561   3HD2  LEU  69          3HD2      LEU  69  -3.731  -6.358   0.548
  562    H    THR  70           H        THR  70  -2.098  -7.675   1.601
  563    HA   THR  70           HA       THR  70   0.699  -7.216   1.321
  564    HB   THR  70           HB       THR  70  -1.002  -8.388  -0.870
  565    HG1  THR  70           HG1      THR  70  -0.334  -9.533   1.636
  566   1HG2  THR  70          1HG2      THR  70   1.631  -9.311   0.306
  567   2HG2  THR  70          2HG2      THR  70   1.524  -8.169  -1.034
  568   3HG2  THR  70          3HG2      THR  70   0.901  -9.808  -1.221
  569    H    GLU  71           H        GLU  71   1.876  -5.995  -0.158
  570    HA   GLU  71           HA       GLU  71   0.493  -3.772  -1.450
  571   1HB   GLU  71          2HB       GLU  71   2.809  -3.655  -0.405
  572   2HB   GLU  71          1HB       GLU  71   3.395  -4.576  -1.790
  573   1HG   GLU  71          2HG       GLU  71   2.766  -2.850  -3.324
  574   2HG   GLU  71          1HG       GLU  71   1.828  -2.005  -2.095
  575    H    GLU  72           H        GLU  72   1.532  -6.944  -2.363
  576    HA   GLU  72           HA       GLU  72   1.973  -6.693  -5.132
  577   1HB   GLU  72          2HB       GLU  72   0.885  -8.860  -3.376
  578   2HB   GLU  72          1HB       GLU  72   0.713  -9.045  -5.120
  579   1HG   GLU  72          2HG       GLU  72   2.798 -10.082  -4.483
  580   2HG   GLU  72          1HG       GLU  72   3.185  -8.587  -5.335
  581    H    GLU  73           H        GLU  73  -1.143  -7.222  -3.447
  582    HA   GLU  73           HA       GLU  73  -2.827  -7.140  -5.720
  583   1HB   GLU  73          2HB       GLU  73  -3.539  -7.721  -3.375
  584   2HB   GLU  73          1HB       GLU  73  -3.460  -6.005  -2.975
  585   1HG   GLU  73          2HG       GLU  73  -5.030  -5.716  -5.056
  586   2HG   GLU  73          1HG       GLU  73  -5.366  -7.431  -4.815
  587    H    LEU  74           H        LEU  74  -1.391  -4.535  -3.810
  588    HA   LEU  74           HA       LEU  74  -2.830  -2.351  -4.955
  589   1HB   LEU  74          2HB       LEU  74  -1.324  -2.253  -2.923
  590   2HB   LEU  74          1HB       LEU  74   0.054  -2.314  -4.021
  591    HG   LEU  74           HG       LEU  74  -1.450  -0.317  -5.153
  592   1HD1  LEU  74          1HD1      LEU  74  -1.655   0.033  -2.149
  593   2HD1  LEU  74          2HD1      LEU  74  -3.004  -0.450  -3.177
  594   3HD1  LEU  74          3HD1      LEU  74  -2.255   1.132  -3.390
  595   1HD2  LEU  74          1HD2      LEU  74   0.528   0.190  -2.918
  596   2HD2  LEU  74          2HD2      LEU  74   0.265   1.147  -4.375
  597   3HD2  LEU  74          3HD2      LEU  74   1.030  -0.437  -4.489
  598    H    TYR  75           H        TYR  75   0.186  -3.974  -5.946
  599    HA   TYR  75           HA       TYR  75   0.781  -2.223  -8.136
  600   1HB   TYR  75          2HB       TYR  75   1.537  -5.054  -7.442
  601   2HB   TYR  75          1HB       TYR  75   1.981  -4.381  -9.009
  602    HD1  TYR  75           HD1      TYR  75   2.847  -4.593  -5.540
  603    HD2  TYR  75           HD2      TYR  75   3.207  -2.098  -9.019
  604    HE1  TYR  75           HE1      TYR  75   4.764  -3.417  -4.498
  605    HE2  TYR  75           HE2      TYR  75   5.124  -0.921  -7.976
  606    HH   TYR  75           HH       TYR  75   6.156  -0.540  -5.928
  607    H    ARG  76           H        ARG  76  -1.332  -5.015  -7.801
  608    HA   ARG  76           HA       ARG  76  -1.796  -5.479 -10.590
  609   1HB   ARG  76          2HB       ARG  76  -2.418  -7.022  -8.672
  610   2HB   ARG  76          1HB       ARG  76  -3.770  -5.944  -8.336
  611   1HG   ARG  76          2HG       ARG  76  -4.632  -7.690  -9.735
  612   2HG   ARG  76          1HG       ARG  76  -4.482  -6.264 -10.759
  613   1HD   ARG  76          2HD       ARG  76  -2.808  -7.179 -12.017
  614   2HD   ARG  76          1HD       ARG  76  -2.078  -7.996 -10.635
  615    HE   ARG  76           HE       ARG  76  -3.269  -9.911 -11.281
  616   1HH1  ARG  76          1HH2      ARG  76  -3.933  -7.995 -13.767
  617   2HH1  ARG  76          2HH2      ARG  76  -5.599  -8.423 -13.973
  618   1HH2  ARG  76          1HH1      ARG  76  -5.828 -10.067 -10.930
  619   2HH2  ARG  76          2HH1      ARG  76  -6.672  -9.595 -12.368
  620    H    LEU  77           H        LEU  77  -4.290  -4.177  -8.389
  621    HA   LEU  77           HA       LEU  77  -5.803  -2.923 -10.394
  622   1HB   LEU  77          2HB       LEU  77  -5.637  -1.643  -7.676
  623   2HB   LEU  77          1HB       LEU  77  -7.047  -1.934  -8.694
  624    HG   LEU  77           HG       LEU  77  -5.462  -4.062  -7.219
  625   1HD1  LEU  77          1HD1      LEU  77  -7.914  -2.510  -6.624
  626   2HD1  LEU  77          2HD1      LEU  77  -6.776  -3.285  -5.524
  627   3HD1  LEU  77          3HD1      LEU  77  -8.019  -4.244  -6.328
  628   1HD2  LEU  77          1HD2      LEU  77  -7.719  -4.164  -9.216
  629   2HD2  LEU  77          2HD2      LEU  77  -7.546  -5.430  -8.001
  630   3HD2  LEU  77          3HD2      LEU  77  -6.250  -5.138  -9.160
  631    H    LEU  78           H        LEU  78  -2.815  -1.877  -8.944
  632    HA   LEU  78           HA       LEU  78  -3.022   0.922  -9.660
  633   1HB   LEU  78          2HB       LEU  78  -1.379   0.309  -8.010
  634   2HB   LEU  78          1HB       LEU  78  -0.662  -0.892  -9.082
  635    HG   LEU  78           HG       LEU  78  -0.173   1.095 -10.669
  636   1HD1  LEU  78          1HD1      LEU  78  -1.500   2.828  -9.713
  637   2HD1  LEU  78          2HD1      LEU  78   0.165   3.238  -9.303
  638   3HD1  LEU  78          3HD1      LEU  78  -0.886   2.506  -8.091
  639   1HD2  LEU  78          1HD2      LEU  78   1.865   1.716  -9.276
  640   2HD2  LEU  78          2HD2      LEU  78   1.633  -0.012  -9.539
  641   3HD2  LEU  78          3HD2      LEU  78   1.192   0.711  -7.992
  642    H    GLU  79           H        GLU  79  -0.827  -1.514 -11.055
  643    HA   GLU  79           HA       GLU  79  -0.212  -0.218 -13.439
  644   1HB   GLU  79          2HB       GLU  79   0.364  -2.680 -12.427
  645   2HB   GLU  79          1HB       GLU  79  -0.714  -3.124 -13.748
  646   1HG   GLU  79          2HG       GLU  79   1.606  -1.218 -14.127
  647   2HG   GLU  79          1HG       GLU  79   1.774  -2.961 -14.332
  648    H    ALA  80           H        ALA  80  -3.209  -1.872 -12.619
  649    HA   ALA  80           HA       ALA  80  -4.211  -1.796 -15.381
  650   1HB   ALA  80          1HB       ALA  80  -6.373  -2.497 -14.289
  651   2HB   ALA  80          2HB       ALA  80  -5.558  -2.402 -12.728
  652   3HB   ALA  80          3HB       ALA  80  -5.023  -3.573 -13.932
  653    H    ARG  81           H        ARG  81  -5.466  -0.358 -12.360
  654    HA   ARG  81           HA       ARG  81  -7.144   1.588 -13.396
  655   1HB   ARG  81          2HB       ARG  81  -6.764   1.192 -10.959
  656   2HB   ARG  81          1HB       ARG  81  -5.225   2.043 -11.086
  657   1HG   ARG  81          2HG       ARG  81  -7.542   3.508 -12.198
  658   2HG   ARG  81          1HG       ARG  81  -7.603   3.249 -10.456
  659   1HD   ARG  81          2HD       ARG  81  -6.200   4.997 -10.227
  660   2HD   ARG  81          1HD       ARG  81  -4.947   4.013 -10.981
  661    HE   ARG  81           HE       ARG  81  -5.238   5.256 -12.974
  662   1HH1  ARG  81          1HH1      ARG  81  -6.007   7.561 -11.225
  663   2HH1  ARG  81          2HH1      ARG  81  -7.521   8.051 -11.909
  664   1HH2  ARG  81          1HH2      ARG  81  -7.981   5.099 -13.670
  665   2HH2  ARG  81          2HH2      ARG  81  -8.639   6.658 -13.296
  666    H    THR  82           H        THR  82  -3.640   2.014 -12.802
  667    HA   THR  82           HA       THR  82  -3.481   4.608 -14.042
  668    HB   THR  82           HB       THR  82  -1.270   2.543 -13.826
  669    HG1  THR  82           HG1      THR  82  -2.077   2.779 -11.800
  670   1HG2  THR  82          1HG2      THR  82  -0.765   4.529 -15.204
  671   2HG2  THR  82          2HG2      THR  82   0.175   4.534 -13.714
  672   3HG2  THR  82          3HG2      THR  82  -1.239   5.576 -13.866
  673    H    GLY  83           H        GLY  83  -2.553   1.373 -15.202
  674   1HA   GLY  83          2HA       GLY  83  -2.930   0.492 -17.394
  675   2HA   GLY  83          1HA       GLY  83  -3.418   2.100 -17.931
  676    H    LYS  84           H        LYS  84  -0.509   1.997 -16.079
  677    HA   LYS  84           HA       LYS  84   1.188   1.810 -18.507
  678   1HB   LYS  84          2HB       LYS  84   0.703   4.200 -18.305
  679   2HB   LYS  84          1HB       LYS  84   1.148   4.173 -16.599
  680   1HG   LYS  84          2HG       LYS  84   3.435   3.823 -17.076
  681   2HG   LYS  84          1HG       LYS  84   3.101   3.293 -18.724
  682   1HD   LYS  84          2HD       LYS  84   2.106   5.997 -18.204
  683   2HD   LYS  84          1HD       LYS  84   3.849   5.864 -17.967
  684   1HE   LYS  84          2HE       LYS  84   3.974   4.712 -20.216
  685   2HE   LYS  84          1HE       LYS  84   2.276   5.128 -20.450
  686   1HZ   LYS  84          1HZ       LYS  84   4.047   7.287 -19.629
  687   2HZ   LYS  84          2HZ       LYS  84   2.747   7.302 -20.722
  688   3HZ   LYS  84          3HZ       LYS  84   4.260   6.701 -21.206
  689    H    LYS  85           H        LYS  85   3.360   1.206 -17.983
  690    HA   LYS  85           HA       LYS  85   3.677  -0.423 -15.668
  691   1HB   LYS  85          2HB       LYS  85   6.204  -0.176 -16.283
  692   2HB   LYS  85          1HB       LYS  85   5.127  -0.974 -17.427
  693   1HG   LYS  85          2HG       LYS  85   4.982   0.979 -18.802
  694   2HG   LYS  85          1HG       LYS  85   5.731   1.990 -17.567
  695   1HD   LYS  85          2HD       LYS  85   7.401   1.497 -19.254
  696   2HD   LYS  85          1HD       LYS  85   7.818   0.605 -17.791
  697   1HE   LYS  85          2HE       LYS  85   7.247  -1.445 -18.708
  698   2HE   LYS  85          1HE       LYS  85   6.071  -0.741 -19.818
  699   1HZ   LYS  85          1HZ       LYS  85   8.643  -1.470 -20.413
  700   2HZ   LYS  85          2HZ       LYS  85   8.701   0.225 -20.321
  701   3HZ   LYS  85          3HZ       LYS  85   7.611  -0.535 -21.380
  702    H    ALA  86           H        ALA  86   3.271   0.688 -13.748
  703    HA   ALA  86           HA       ALA  86   4.212   3.281 -13.068
  704   1HB   ALA  86          1HB       ALA  86   3.819   2.585 -10.718
  705   2HB   ALA  86          2HB       ALA  86   3.654   0.913 -11.254
  706   3HB   ALA  86          3HB       ALA  86   2.479   2.124 -11.768
  707    H    GLU  87           H        GLU  87   5.711   0.084 -12.661
  708    HA   GLU  87           HA       GLU  87   7.969   0.931 -11.133
  709   1HB   GLU  87          2HB       GLU  87   7.772  -1.332 -13.149
  710   2HB   GLU  87          1HB       GLU  87   9.036  -1.151 -11.933
  711   1HG   GLU  87          2HG       GLU  87   7.626  -2.535 -10.752
  712   2HG   GLU  87          1HG       GLU  87   6.904  -0.988 -10.309
  713    H    GLU  88           H        GLU  88   7.261   1.058 -14.570
  714    HA   GLU  88           HA       GLU  88   8.432   1.997 -16.365
  715   1HB   GLU  88          2HB       GLU  88   8.209   3.988 -14.844
  716   2HB   GLU  88          1HB       GLU  88   9.801   3.613 -14.191
  717   1HG   GLU  88          2HG       GLU  88  10.561   3.640 -16.696
  718   2HG   GLU  88          1HG       GLU  88   9.067   4.540 -16.960
  719    H    LEU  89           H        LEU  89  11.217   2.684 -14.392
  720    HA   LEU  89           HA       LEU  89  13.057   1.338 -16.041
  721   1HB   LEU  89          2HB       LEU  89  13.398   3.055 -14.078
  722   2HB   LEU  89          1HB       LEU  89  13.576   1.604 -13.094
  723    HG   LEU  89           HG       LEU  89  15.169   0.965 -15.215
  724   1HD1  LEU  89          1HD1      LEU  89  15.483   3.952 -14.769
  725   2HD1  LEU  89          2HD1      LEU  89  14.822   3.208 -16.225
  726   3HD1  LEU  89          3HD1      LEU  89  16.508   2.939 -15.785
  727   1HD2  LEU  89          1HD2      LEU  89  15.798   0.785 -12.856
  728   2HD2  LEU  89          2HD2      LEU  89  15.925   2.539 -12.732
  729   3HD2  LEU  89          3HD2      LEU  89  17.062   1.642 -13.737
  730    H    VAL  90           H        VAL  90  10.801  -0.060 -13.918
  731    HA   VAL  90           HA       VAL  90  10.430  -2.277 -13.274
  732    HB   VAL  90           HB       VAL  90  12.732  -2.982 -15.120
  733   1HG1  VAL  90          1HG1      VAL  90  10.291  -4.515 -14.174
  734   2HG1  VAL  90          2HG1      VAL  90  11.951  -4.795 -13.650
  735   3HG1  VAL  90          3HG1      VAL  90  11.488  -5.114 -15.321
  736   1HG2  VAL  90          1HG2      VAL  90   9.902  -2.156 -15.666
  737   2HG2  VAL  90          2HG2      VAL  90  10.602  -3.437 -16.656
  738   3HG2  VAL  90          3HG2      VAL  90  11.360  -1.846 -16.610
  739    H    GLY  91           H        GLY  91  11.006  -2.363 -11.148
  740   1HA   GLY  91          2HA       GLY  91  13.667  -3.448 -10.493
  741   2HA   GLY  91          1HA       GLY  91  13.307  -1.866  -9.800
  742    H    SER  92           H        SER  92  10.629  -2.107  -9.181
  743    HA   SER  92           HA       SER  92   9.274  -2.826  -7.411
  744   1HB   SER  92          2HB       SER  92   8.619  -5.058  -7.551
  745   2HB   SER  92          1HB       SER  92   9.339  -4.818  -9.139
  746    HG   SER  92           HG       SER  92  10.030  -6.562  -7.286
  Start of MODEL    6
    1    HA   MET   1           HA       MET   1 -14.048  -5.182 -12.641
    2   1HB   MET   1          2HB       MET   1 -16.912  -4.195 -12.458
    3   2HB   MET   1          1HB       MET   1 -15.900  -3.999 -13.888
    4   1HG   MET   1          2HG       MET   1 -15.684  -6.392 -14.150
    5   2HG   MET   1          1HG       MET   1 -16.479  -6.680 -12.603
    6   1HE   MET   1          1HE       MET   1 -19.471  -7.949 -14.358
    7   2HE   MET   1          2HE       MET   1 -18.582  -7.855 -12.840
    8   3HE   MET   1          3HE       MET   1 -17.763  -8.401 -14.302
    9    H    GLU   2           H        GLU   2 -12.546  -3.577 -12.555
   10    HA   GLU   2           HA       GLU   2 -13.059  -1.122 -11.022
   11   1HB   GLU   2          2HB       GLU   2 -10.678  -2.015 -12.680
   12   2HB   GLU   2          1HB       GLU   2 -10.729  -0.535 -11.723
   13   1HG   GLU   2          2HG       GLU   2  -9.927  -1.802 -10.025
   14   2HG   GLU   2          1HG       GLU   2 -11.562  -2.452  -9.909
   15    H    LYS   3           H        LYS   3 -14.613   0.078 -12.145
   16    HA   LYS   3           HA       LYS   3 -14.303   0.550 -15.035
   17   1HB   LYS   3          2HB       LYS   3 -16.523   0.345 -13.611
   18   2HB   LYS   3          1HB       LYS   3 -16.243   2.059 -13.308
   19   1HG   LYS   3          2HG       LYS   3 -17.564   2.083 -15.253
   20   2HG   LYS   3          1HG       LYS   3 -15.928   2.229 -15.891
   21   1HD   LYS   3          2HD       LYS   3 -15.853  -0.082 -16.497
   22   2HD   LYS   3          1HD       LYS   3 -17.307  -0.445 -15.567
   23   1HE   LYS   3          2HE       LYS   3 -17.913  -0.330 -17.915
   24   2HE   LYS   3          1HE       LYS   3 -18.594   1.075 -17.096
   25   1HZ   LYS   3          1HZ       LYS   3 -15.921   1.266 -18.300
   26   2HZ   LYS   3          2HZ       LYS   3 -17.079   2.483 -18.045
   27   3HZ   LYS   3          3HZ       LYS   3 -17.285   1.360 -19.303
   28    H    GLY   4           H        GLY   4 -12.613   1.672 -12.536
   29   1HA   GLY   4          2HA       GLY   4 -11.102   3.509 -12.536
   30   2HA   GLY   4          1HA       GLY   4 -11.986   4.206 -13.895
   31    H    GLY   5           H        GLY   5 -11.628   4.189 -10.467
   32   1HA   GLY   5          2HA       GLY   5 -12.717   6.587  -9.827
   33   2HA   GLY   5          1HA       GLY   5 -14.162   5.580  -9.946
   34    H    GLU   6           H        GLU   6 -12.308   3.261  -9.082
   35    HA   GLU   6           HA       GLU   6 -12.041   3.947  -6.191
   36   1HB   GLU   6          2HB       GLU   6 -13.526   1.583  -7.381
   37   2HB   GLU   6          1HB       GLU   6 -13.009   1.645  -5.698
   38   1HG   GLU   6          2HG       GLU   6 -15.224   2.442  -5.618
   39   2HG   GLU   6          1HG       GLU   6 -14.256   3.916  -5.609
   40    H    ALA   7           H        ALA   7 -11.833   0.777  -7.701
   41    HA   ALA   7           HA       ALA   7  -9.966  -0.494  -8.351
   42   1HB   ALA   7          1HB       ALA   7  -8.814   1.838  -8.728
   43   2HB   ALA   7          2HB       ALA   7  -7.812   0.404  -8.521
   44   3HB   ALA   7          3HB       ALA   7  -8.051   1.511  -7.172
   45    H    LEU   8           H        LEU   8  -8.401   1.082  -5.585
   46    HA   LEU   8           HA       LEU   8  -9.084  -1.329  -3.951
   47   1HB   LEU   8          2HB       LEU   8  -6.856  -0.738  -2.741
   48   2HB   LEU   8          1HB       LEU   8  -6.770  -1.582  -4.282
   49    HG   LEU   8           HG       LEU   8  -6.369   0.570  -5.441
   50   1HD1  LEU   8          1HD1      LEU   8  -7.340   2.295  -4.230
   51   2HD1  LEU   8          2HD1      LEU   8  -5.672   2.451  -3.682
   52   3HD1  LEU   8          3HD1      LEU   8  -6.855   1.617  -2.676
   53   1HD2  LEU   8          1HD2      LEU   8  -4.631  -0.554  -3.326
   54   2HD2  LEU   8          2HD2      LEU   8  -4.189   1.064  -3.866
   55   3HD2  LEU   8          3HD2      LEU   8  -4.284  -0.257  -5.029
   56    H    LYS   9           H        LYS   9  -9.480   1.930  -4.372
   57    HA   LYS   9           HA       LYS   9  -9.219   3.231  -1.954
   58   1HB   LYS   9          2HB       LYS   9 -10.218   4.045  -4.206
   59   2HB   LYS   9          1HB       LYS   9 -11.762   3.499  -3.554
   60   1HG   LYS   9          2HG       LYS   9 -11.671   5.038  -1.751
   61   2HG   LYS   9          1HG       LYS   9  -9.951   5.346  -1.989
   62   1HD   LYS   9          2HD       LYS   9 -10.427   6.446  -4.134
   63   2HD   LYS   9          1HD       LYS   9 -12.146   6.099  -3.944
   64   1HE   LYS   9          2HE       LYS   9 -10.544   7.722  -1.950
   65   2HE   LYS   9          1HE       LYS   9 -11.481   8.439  -3.261
   66   1HZ   LYS   9          1HZ       LYS   9 -12.993   6.512  -1.799
   67   2HZ   LYS   9          2HZ       LYS   9 -13.359   8.135  -2.146
   68   3HZ   LYS   9          3HZ       LYS   9 -12.419   7.745  -0.786
   69    H    GLY  10           H        GLY  10 -11.182   3.882  -0.492
   70   1HA   GLY  10          2HA       GLY  10 -13.045   3.243   0.862
   71   2HA   GLY  10          1HA       GLY  10 -13.041   1.660   0.079
   72    H    LEU  11           H        LEU  11  -9.933   1.936   0.649
   73    HA   LEU  11           HA       LEU  11 -10.075   1.018   3.496
   74   1HB   LEU  11          2HB       LEU  11  -8.769  -0.237   1.099
   75   2HB   LEU  11          1HB       LEU  11  -8.017  -0.436   2.683
   76    HG   LEU  11           HG       LEU  11 -10.964  -0.930   2.427
   77   1HD1  LEU  11          1HD1      LEU  11  -8.783  -2.864   1.583
   78   2HD1  LEU  11          2HD1      LEU  11 -10.039  -2.186   0.548
   79   3HD1  LEU  11          3HD1      LEU  11 -10.471  -3.305   1.841
   80   1HD2  LEU  11          1HD2      LEU  11  -9.837  -0.978   4.633
   81   2HD2  LEU  11          2HD2      LEU  11  -8.733  -2.219   4.041
   82   3HD2  LEU  11          3HD2      LEU  11 -10.453  -2.572   4.202
   83    H    THR  12           H        THR  12  -7.685   0.948   4.366
   84    HA   THR  12           HA       THR  12  -6.246   3.399   3.435
   85    HB   THR  12           HB       THR  12  -6.945   2.548   6.257
   86    HG1  THR  12           HG1      THR  12  -8.408   3.847   4.980
   87   1HG2  THR  12          1HG2      THR  12  -5.605   4.638   6.879
   88   2HG2  THR  12          2HG2      THR  12  -4.906   4.548   5.263
   89   3HG2  THR  12          3HG2      THR  12  -4.661   3.227   6.405
   90    H    PHE  13           H        PHE  13  -3.964   3.298   3.669
   91    HA   PHE  13           HA       PHE  13  -2.879   0.593   4.358
   92   1HB   PHE  13          2HB       PHE  13  -2.119   2.503   2.137
   93   2HB   PHE  13          1HB       PHE  13  -1.059   1.197   2.661
   94    HD1  PHE  13           HD1      PHE  13  -3.889   2.082   0.626
   95    HD2  PHE  13           HD2      PHE  13  -2.016  -1.205   2.663
   96    HE1  PHE  13           HE1      PHE  13  -5.148   0.480  -0.788
   97    HE2  PHE  13           HE2      PHE  13  -3.271  -2.801   1.243
   98    HZ   PHE  13           HZ       PHE  13  -4.841  -1.956  -0.481
   99    H    VAL  14           H        VAL  14  -1.107   0.594   5.740
  100    HA   VAL  14           HA       VAL  14   0.067   3.252   6.447
  101    HB   VAL  14           HB       VAL  14  -1.405   1.366   8.155
  102   1HG1  VAL  14          1HG1      VAL  14   0.802   0.727   8.940
  103   2HG1  VAL  14          2HG1      VAL  14   0.049   1.767  10.147
  104   3HG1  VAL  14          3HG1      VAL  14   1.281   2.418   9.070
  105   1HG2  VAL  14          1HG2      VAL  14  -1.507   4.016   7.653
  106   2HG2  VAL  14          2HG2      VAL  14  -0.514   4.025   9.110
  107   3HG2  VAL  14          3HG2      VAL  14  -2.117   3.296   9.141
  108    H    ILE  15           H        ILE  15   2.215   3.145   7.322
  109    HA   ILE  15           HA       ILE  15   3.658   0.600   6.678
  110    HB   ILE  15           HB       ILE  15   5.562   2.627   6.540
  111   1HG1  ILE  15          2HG1      ILE  15   3.484   4.187   6.504
  112   2HG1  ILE  15          1HG1      ILE  15   4.716   4.425   5.268
  113   1HG2  ILE  15          1HG2      ILE  15   4.020   1.023   4.523
  114   2HG2  ILE  15          2HG2      ILE  15   5.717   0.899   4.983
  115   3HG2  ILE  15          3HG2      ILE  15   5.175   2.235   3.971
  116   1HD1  ILE  15          1HD1      ILE  15   3.349   3.712   3.579
  117   2HD1  ILE  15          2HD1      ILE  15   2.072   4.164   4.704
  118   3HD1  ILE  15          3HD1      ILE  15   2.578   2.482   4.579
  119    H    THR  16           H        THR  16   4.764  -0.247   8.418
  120    HA   THR  16           HA       THR  16   4.559   0.939  11.007
  121    HB   THR  16           HB       THR  16   6.106  -1.373   9.844
  122    HG1  THR  16           HG1      THR  16   3.788  -1.282  10.558
  123   1HG2  THR  16          1HG2      THR  16   7.704  -0.965  11.432
  124   2HG2  THR  16          2HG2      THR  16   6.517  -1.718  12.495
  125   3HG2  THR  16          3HG2      THR  16   6.631   0.038  12.409
  126    H    GLY  17           H        GLY  17   5.436   3.103  10.671
  127   1HA   GLY  17          2HA       GLY  17   7.134   4.715  10.832
  128   2HA   GLY  17          1HA       GLY  17   8.115   3.438  11.552
  129    H    GLU  18           H        GLU  18   8.993   1.819   9.889
  130    HA   GLU  18           HA       GLU  18   9.446   2.935   7.209
  131   1HB   GLU  18          2HB       GLU  18  11.582   2.644   9.310
  132   2HB   GLU  18          1HB       GLU  18  11.991   2.411   7.612
  133   1HG   GLU  18          2HG       GLU  18  10.853   4.664   7.179
  134   2HG   GLU  18          1HG       GLU  18  10.870   4.892   8.926
  135    H    LEU  19           H        LEU  19   8.544   1.134   6.250
  136    HA   LEU  19           HA       LEU  19   8.861  -1.548   7.173
  137   1HB   LEU  19          2HB       LEU  19   7.765  -0.213   4.795
  138   2HB   LEU  19          1HB       LEU  19   8.428  -1.811   4.460
  139    HG   LEU  19           HG       LEU  19   7.079  -2.744   6.313
  140   1HD1  LEU  19          1HD1      LEU  19   6.467  -1.236   7.887
  141   2HD1  LEU  19          2HD1      LEU  19   5.129  -0.863   6.803
  142   3HD1  LEU  19          3HD1      LEU  19   6.591   0.119   6.768
  143   1HD2  LEU  19          1HD2      LEU  19   5.587  -1.171   4.195
  144   2HD2  LEU  19          2HD2      LEU  19   4.838  -2.405   5.207
  145   3HD2  LEU  19          3HD2      LEU  19   6.130  -2.846   4.090
  146    H    SER  20           H        SER  20  11.206   0.484   5.861
  147    HA   SER  20           HA       SER  20  13.461  -0.046   5.416
  148   1HB   SER  20          2HB       SER  20  12.645  -2.913   4.883
  149   2HB   SER  20          1HB       SER  20  14.254  -2.286   5.212
  150    HG   SER  20           HG       SER  20  13.351  -3.222   7.073
  151    H    ARG  21           H        ARG  21  11.431   0.904   3.706
  152    HA   ARG  21           HA       ARG  21  12.639   0.301   1.087
  153   1HB   ARG  21          2HB       ARG  21  10.066  -0.770   1.947
  154   2HB   ARG  21          1HB       ARG  21   9.870   0.288   0.552
  155   1HG   ARG  21          2HG       ARG  21  11.687  -0.980  -0.611
  156   2HG   ARG  21          1HG       ARG  21  11.753  -2.080   0.765
  157   1HD   ARG  21          2HD       ARG  21  10.341  -3.053  -0.974
  158   2HD   ARG  21          1HD       ARG  21   9.342  -2.617   0.410
  159    HE   ARG  21           HE       ARG  21   8.399  -0.819  -0.880
  160   1HH1  ARG  21          1HH1      ARG  21   9.015  -3.235  -2.867
  161   2HH1  ARG  21          2HH1      ARG  21   9.457  -2.315  -4.267
  162   1HH2  ARG  21          1HH2      ARG  21   9.766   0.669  -2.534
  163   2HH2  ARG  21          2HH2      ARG  21   9.885  -0.106  -4.077
  164    HA   PRO  22           HA       PRO  22  11.612   4.562   0.413
  165   1HB   PRO  22          2HB       PRO  22  10.479   4.713  -2.070
  166   2HB   PRO  22          1HB       PRO  22  12.202   4.396  -1.809
  167   1HG   PRO  22          2HG       PRO  22  10.010   2.504  -2.476
  168   2HG   PRO  22          1HG       PRO  22  11.693   2.529  -3.029
  169   1HD   PRO  22          2HD       PRO  22  10.769   0.841  -1.063
  170   2HD   PRO  22          1HD       PRO  22  12.457   1.378  -1.180
  171    H    ARG  23           H        ARG  23   9.640   3.139   1.876
  172    HA   ARG  23           HA       ARG  23   6.987   3.236   1.252
  173   1HB   ARG  23          2HB       ARG  23   6.569   3.883   3.677
  174   2HB   ARG  23          1HB       ARG  23   7.616   2.486   3.422
  175   1HG   ARG  23          2HG       ARG  23   9.480   3.569   4.193
  176   2HG   ARG  23          1HG       ARG  23   8.984   5.121   3.522
  177   1HD   ARG  23          2HD       ARG  23   7.724   3.835   5.963
  178   2HD   ARG  23          1HD       ARG  23   8.962   5.090   6.023
  179    HE   ARG  23           HE       ARG  23   6.645   5.846   4.418
  180   1HH1  ARG  23          1HH2      ARG  23   5.609   5.099   7.159
  181   2HH1  ARG  23          2HH2      ARG  23   5.712   6.614   7.994
  182   1HH2  ARG  23          1HH1      ARG  23   7.840   8.053   5.666
  183   2HH2  ARG  23          2HH1      ARG  23   6.976   8.286   7.148
  184    H    GLU  24           H        GLU  24   8.994   6.056   1.353
  185    HA   GLU  24           HA       GLU  24   6.753   7.914   1.778
  186   1HB   GLU  24          2HB       GLU  24   9.577   8.444   0.790
  187   2HB   GLU  24          1HB       GLU  24   8.415   9.666   1.304
  188   1HG   GLU  24          2HG       GLU  24   9.052   7.446   3.209
  189   2HG   GLU  24          1HG       GLU  24  10.248   8.724   2.991
  190    H    GLU  25           H        GLU  25   8.907   7.026  -0.880
  191    HA   GLU  25           HA       GLU  25   7.626   8.516  -2.936
  192   1HB   GLU  25          2HB       GLU  25   9.049   7.462  -4.391
  193   2HB   GLU  25          1HB       GLU  25   9.839   6.970  -2.895
  194   1HG   GLU  25          2HG       GLU  25   8.605   4.839  -2.926
  195   2HG   GLU  25          1HG       GLU  25   7.762   5.335  -4.393
  196    H    VAL  26           H        VAL  26   7.096   5.081  -2.031
  197    HA   VAL  26           HA       VAL  26   4.894   4.721  -3.837
  198    HB   VAL  26           HB       VAL  26   6.125   2.812  -2.883
  199   1HG1  VAL  26          1HG1      VAL  26   4.764   3.465  -0.258
  200   2HG1  VAL  26          2HG1      VAL  26   6.427   3.926  -0.620
  201   3HG1  VAL  26          3HG1      VAL  26   5.977   2.222  -0.563
  202   1HG2  VAL  26          1HG2      VAL  26   3.669   2.657  -3.579
  203   2HG2  VAL  26          2HG2      VAL  26   3.274   2.739  -1.862
  204   3HG2  VAL  26          3HG2      VAL  26   4.237   1.398  -2.482
  205    H    LYS  27           H        LYS  27   5.143   6.034  -0.583
  206    HA   LYS  27           HA       LYS  27   2.381   5.879   0.139
  207   1HB   LYS  27          2HB       LYS  27   4.732   7.467   1.013
  208   2HB   LYS  27          1HB       LYS  27   3.163   8.197   1.338
  209   1HG   LYS  27          2HG       LYS  27   3.730   5.315   2.042
  210   2HG   LYS  27          1HG       LYS  27   4.139   6.628   3.146
  211   1HD   LYS  27          2HD       LYS  27   2.009   6.358   3.900
  212   2HD   LYS  27          1HD       LYS  27   1.575   7.296   2.472
  213   1HE   LYS  27          2HE       LYS  27   0.751   5.472   1.355
  214   2HE   LYS  27          1HE       LYS  27   1.935   4.372   2.056
  215   1HZ   LYS  27          1HZ       LYS  27   0.273   5.360   4.094
  216   2HZ   LYS  27          2HZ       LYS  27   0.454   3.758   3.557
  217   3HZ   LYS  27          3HZ       LYS  27  -0.705   4.773   2.840
  218    H    ALA  28           H        ALA  28   4.232   8.341  -1.644
  219    HA   ALA  28           HA       ALA  28   2.052  10.175  -2.004
  220   1HB   ALA  28          1HB       ALA  28   3.422  11.162  -3.763
  221   2HB   ALA  28          2HB       ALA  28   4.415   9.708  -3.853
  222   3HB   ALA  28          3HB       ALA  28   4.469  10.723  -2.413
  223    H    LEU  29           H        LEU  29   3.089   7.271  -3.681
  224    HA   LEU  29           HA       LEU  29   1.187   7.650  -5.894
  225   1HB   LEU  29          2HB       LEU  29   3.438   5.926  -5.322
  226   2HB   LEU  29          1HB       LEU  29   2.046   4.948  -5.785
  227    HG   LEU  29           HG       LEU  29   1.742   6.532  -7.759
  228   1HD1  LEU  29          1HD1      LEU  29   3.855   7.753  -8.409
  229   2HD1  LEU  29          2HD1      LEU  29   4.479   7.412  -6.795
  230   3HD1  LEU  29          3HD1      LEU  29   3.045   8.418  -6.992
  231   1HD2  LEU  29          1HD2      LEU  29   2.746   4.290  -8.001
  232   2HD2  LEU  29          2HD2      LEU  29   4.327   4.947  -7.580
  233   3HD2  LEU  29          3HD2      LEU  29   3.534   5.444  -9.076
  234    H    LEU  30           H        LEU  30   1.291   6.094  -2.773
  235    HA   LEU  30           HA       LEU  30  -0.925   4.297  -3.159
  236   1HB   LEU  30          2HB       LEU  30   0.923   4.874  -1.112
  237   2HB   LEU  30          1HB       LEU  30  -0.655   5.237  -0.424
  238    HG   LEU  30           HG       LEU  30   0.117   2.642  -1.783
  239   1HD1  LEU  30          1HD1      LEU  30  -0.305   3.390   1.122
  240   2HD1  LEU  30          2HD1      LEU  30   1.186   2.808   0.379
  241   3HD1  LEU  30          3HD1      LEU  30  -0.199   1.729   0.543
  242   1HD2  LEU  30          1HD2      LEU  30  -2.246   3.117  -2.117
  243   2HD2  LEU  30          2HD2      LEU  30  -2.436   3.560  -0.421
  244   3HD2  LEU  30          3HD2      LEU  30  -2.100   1.886  -0.864
  245    H    ARG  31           H        ARG  31  -0.692   7.502  -1.572
  246    HA   ARG  31           HA       ARG  31  -3.474   7.790  -1.029
  247   1HB   ARG  31          2HB       ARG  31  -1.636   9.247  -0.098
  248   2HB   ARG  31          1HB       ARG  31  -1.517  10.018  -1.680
  249   1HG   ARG  31          2HG       ARG  31  -3.698  10.934  -1.527
  250   2HG   ARG  31          1HG       ARG  31  -4.150   9.853  -0.207
  251   1HD   ARG  31          2HD       ARG  31  -3.632  12.254   0.473
  252   2HD   ARG  31          1HD       ARG  31  -2.738  11.009   1.344
  253    HE   ARG  31           HE       ARG  31  -1.466  12.306  -1.019
  254   1HH1  ARG  31          1HH1      ARG  31  -1.431  14.059   1.411
  255   2HH1  ARG  31          2HH1      ARG  31   0.052  13.593   2.175
  256   1HH2  ARG  31          1HH2      ARG  31   0.364  10.649   0.366
  257   2HH2  ARG  31          2HH2      ARG  31   1.072  11.664   1.578
  258    H    ARG  32           H        ARG  32  -1.521   8.752  -3.805
  259    HA   ARG  32           HA       ARG  32  -3.484  10.086  -5.344
  260   1HB   ARG  32          2HB       ARG  32  -1.065   9.864  -5.979
  261   2HB   ARG  32          1HB       ARG  32  -1.374   8.185  -6.420
  262   1HG   ARG  32          2HG       ARG  32  -3.073   8.940  -8.063
  263   2HG   ARG  32          1HG       ARG  32  -2.716  10.617  -7.644
  264   1HD   ARG  32          2HD       ARG  32  -0.524  10.489  -8.538
  265   2HD   ARG  32          1HD       ARG  32  -0.551   8.726  -8.570
  266    HE   ARG  32           HE       ARG  32  -1.737   8.823 -10.620
  267   1HH1  ARG  32          1HH1      ARG  32  -0.212  11.341 -11.150
  268   2HH1  ARG  32          2HH1      ARG  32  -1.475  12.455 -11.558
  269   1HH2  ARG  32          1HH2      ARG  32  -3.998  10.486 -10.220
  270   2HH2  ARG  32          2HH2      ARG  32  -3.620  11.971 -11.028
  271    H    LEU  33           H        LEU  33  -2.935   6.662  -4.793
  272    HA   LEU  33           HA       LEU  33  -4.794   5.708  -6.776
  273   1HB   LEU  33          2HB       LEU  33  -2.849   4.499  -5.444
  274   2HB   LEU  33          1HB       LEU  33  -4.145   4.130  -4.312
  275    HG   LEU  33           HG       LEU  33  -5.352   2.869  -5.905
  276   1HD1  LEU  33          1HD1      LEU  33  -5.455   4.197  -7.845
  277   2HD1  LEU  33          2HD1      LEU  33  -4.456   2.841  -8.363
  278   3HD1  LEU  33          3HD1      LEU  33  -3.701   4.374  -7.932
  279   1HD2  LEU  33          1HD2      LEU  33  -2.560   2.286  -6.861
  280   2HD2  LEU  33          2HD2      LEU  33  -3.852   1.158  -6.461
  281   3HD2  LEU  33          3HD2      LEU  33  -2.989   2.000  -5.175
  282    H    GLY  34           H        GLY  34  -5.669   7.693  -4.485
  283   1HA   GLY  34          2HA       GLY  34  -7.877   8.134  -3.744
  284   2HA   GLY  34          1HA       GLY  34  -8.344   6.513  -4.246
  285    H    ALA  35           H        ALA  35  -6.741   4.856  -2.791
  286    HA   ALA  35           HA       ALA  35  -7.947   4.716  -0.268
  287   1HB   ALA  35          1HB       ALA  35  -5.349   3.637  -1.339
  288   2HB   ALA  35          2HB       ALA  35  -6.831   2.768  -0.941
  289   3HB   ALA  35          3HB       ALA  35  -5.793   3.376   0.347
  290    H    LYS  36           H        LYS  36  -7.305   5.330   1.847
  291    HA   LYS  36           HA       LYS  36  -5.844   7.855   1.999
  292   1HB   LYS  36          2HB       LYS  36  -7.856   6.941   3.466
  293   2HB   LYS  36          1HB       LYS  36  -6.555   6.250   4.435
  294   1HG   LYS  36          2HG       LYS  36  -6.594   8.294   5.457
  295   2HG   LYS  36          1HG       LYS  36  -5.593   8.766   4.084
  296   1HD   LYS  36          2HD       LYS  36  -7.886   9.209   2.894
  297   2HD   LYS  36          1HD       LYS  36  -8.529   9.252   4.536
  298   1HE   LYS  36          2HE       LYS  36  -6.178  10.922   3.599
  299   2HE   LYS  36          1HE       LYS  36  -7.840  11.508   3.661
  300   1HZ   LYS  36          1HZ       LYS  36  -6.612  12.100   5.656
  301   2HZ   LYS  36          2HZ       LYS  36  -6.292  10.462   5.969
  302   3HZ   LYS  36          3HZ       LYS  36  -7.887  11.045   6.025
  303    H    VAL  37           H        VAL  37  -3.889   8.164   3.355
  304    HA   VAL  37           HA       VAL  37  -2.263   5.668   3.590
  305    HB   VAL  37           HB       VAL  37  -0.300   7.114   3.021
  306   1HG1  VAL  37          1HG1      VAL  37  -1.580   5.718   1.339
  307   2HG1  VAL  37          2HG1      VAL  37  -0.704   7.083   0.648
  308   3HG1  VAL  37          3HG1      VAL  37  -2.448   7.185   0.889
  309   1HG2  VAL  37          1HG2      VAL  37  -0.732   9.313   1.997
  310   2HG2  VAL  37          2HG2      VAL  37  -1.328   9.280   3.656
  311   3HG2  VAL  37          3HG2      VAL  37  -2.458   9.127   2.311
  312    H    THR  38           H        THR  38  -0.678   5.692   5.295
  313    HA   THR  38           HA       THR  38  -0.383   7.857   7.161
  314    HB   THR  38           HB       THR  38  -1.572   5.960   8.896
  315    HG1  THR  38           HG1      THR  38  -3.733   6.045   7.942
  316   1HG2  THR  38          1HG2      THR  38  -3.122   7.785   9.377
  317   2HG2  THR  38          2HG2      THR  38  -2.690   8.581   7.865
  318   3HG2  THR  38          3HG2      THR  38  -1.497   8.431   9.154
  319    H    ASP  39           H        ASP  39   0.354   6.489   9.457
  320    HA   ASP  39           HA       ASP  39   2.010   4.186   8.659
  321   1HB   ASP  39          2HB       ASP  39   4.097   5.262   9.520
  322   2HB   ASP  39          1HB       ASP  39   3.467   6.049   8.073
  323    H    SER  40           H        SER  40  -0.009   5.545  10.847
  324    HA   SER  40           HA       SER  40   1.245   4.073  13.131
  325   1HB   SER  40          2HB       SER  40   0.090   5.684  14.622
  326   2HB   SER  40          1HB       SER  40   1.226   6.495  13.548
  327    HG   SER  40           HG       SER  40  -1.595   6.303  13.322
  328    H    VAL  41           H        VAL  41  -0.643   3.583  14.817
  329    HA   VAL  41           HA       VAL  41  -3.143   2.828  13.394
  330    HB   VAL  41           HB       VAL  41  -3.021   0.541  14.416
  331   1HG1  VAL  41          1HG1      VAL  41  -2.377   0.925  12.061
  332   2HG1  VAL  41          2HG1      VAL  41  -1.397  -0.346  12.791
  333   3HG1  VAL  41          3HG1      VAL  41  -0.724   1.268  12.571
  334   1HG2  VAL  41          1HG2      VAL  41  -1.469   0.907  16.223
  335   2HG2  VAL  41          2HG2      VAL  41  -0.231   1.499  15.117
  336   3HG2  VAL  41          3HG2      VAL  41  -0.689  -0.203  15.096
  337    H    SER  42           H        SER  42  -4.944   2.762  14.748
  338    HA   SER  42           HA       SER  42  -4.524   3.111  17.670
  339   1HB   SER  42          2HB       SER  42  -6.079   5.026  17.719
  340   2HB   SER  42          1HB       SER  42  -4.677   5.389  16.718
  341    HG   SER  42           HG       SER  42  -7.267   4.584  15.880
  342    H    ARG  43           H        ARG  43  -6.823   2.694  14.999
  343    HA   ARG  43           HA       ARG  43  -8.116   0.420  16.092
  344   1HB   ARG  43          2HB       ARG  43  -9.020   1.820  17.842
  345   2HB   ARG  43          1HB       ARG  43  -9.462   3.076  16.687
  346   1HG   ARG  43          2HG       ARG  43 -11.225   1.782  15.779
  347   2HG   ARG  43          1HG       ARG  43 -10.605   0.289  16.483
  348   1HD   ARG  43          2HD       ARG  43 -12.539   1.050  17.768
  349   2HD   ARG  43          1HD       ARG  43 -11.084   1.200  18.753
  350    HE   ARG  43           HE       ARG  43 -11.713   3.644  17.293
  351   1HH1  ARG  43          1HH1      ARG  43 -13.062   1.762  19.800
  352   2HH1  ARG  43          2HH1      ARG  43 -13.234   3.087  20.903
  353   1HH2  ARG  43          1HH2      ARG  43 -11.617   5.359  18.848
  354   2HH2  ARG  43          2HH2      ARG  43 -12.415   5.118  20.366
  355    H    LYS  44           H        LYS  44  -9.386   3.406  14.618
  356    HA   LYS  44           HA       LYS  44 -10.775   2.008  12.513
  357   1HB   LYS  44          2HB       LYS  44 -10.978   4.298  11.485
  358   2HB   LYS  44          1HB       LYS  44 -11.520   4.222  13.161
  359   1HG   LYS  44          2HG       LYS  44  -9.408   5.154  13.939
  360   2HG   LYS  44          1HG       LYS  44  -8.752   5.118  12.302
  361   1HD   LYS  44          2HD       LYS  44 -10.344   6.768  11.547
  362   2HD   LYS  44          1HD       LYS  44 -11.229   6.686  13.070
  363   1HE   LYS  44          2HE       LYS  44  -9.819   8.670  13.089
  364   2HE   LYS  44          1HE       LYS  44  -9.179   7.507  14.252
  365   1HZ   LYS  44          1HZ       LYS  44  -7.439   6.944  12.855
  366   2HZ   LYS  44          2HZ       LYS  44  -7.568   8.623  12.626
  367   3HZ   LYS  44          3HZ       LYS  44  -8.203   7.552  11.469
  368    H    THR  45           H        THR  45  -7.498   2.664  12.988
  369    HA   THR  45           HA       THR  45  -6.925   2.242  10.079
  370    HB   THR  45           HB       THR  45  -5.180   3.756  12.046
  371    HG1  THR  45           HG1      THR  45  -7.012   4.670  10.085
  372   1HG2  THR  45          1HG2      THR  45  -5.125   3.497   9.024
  373   2HG2  THR  45          2HG2      THR  45  -3.990   2.742  10.144
  374   3HG2  THR  45          3HG2      THR  45  -4.036   4.498   9.984
  375    H    SER  46           H        SER  46  -6.484   0.074  10.061
  376    HA   SER  46           HA       SER  46  -4.117  -0.818  11.583
  377   1HB   SER  46          2HB       SER  46  -5.486  -2.985  12.115
  378   2HB   SER  46          1HB       SER  46  -5.646  -1.577  13.151
  379    HG   SER  46           HG       SER  46  -7.602  -1.190  12.354
  380    H    TYR  47           H        TYR  47  -3.541  -0.544   9.268
  381    HA   TYR  47           HA       TYR  47  -3.734  -3.162   7.891
  382   1HB   TYR  47          2HB       TYR  47  -4.218  -0.642   6.298
  383   2HB   TYR  47          1HB       TYR  47  -4.523  -2.311   5.825
  384    HD1  TYR  47           HD1      TYR  47  -5.810   0.605   7.612
  385    HD2  TYR  47           HD2      TYR  47  -6.433  -3.572   6.816
  386    HE1  TYR  47           HE1      TYR  47  -8.132   0.790   8.456
  387    HE2  TYR  47           HE2      TYR  47  -8.754  -3.385   7.662
  388    HH   TYR  47           HH       TYR  47 -10.064  -0.258   8.768
  389    H    LEU  48           H        LEU  48  -1.704  -3.689   7.171
  390    HA   LEU  48           HA       LEU  48   0.227  -1.443   6.753
  391   1HB   LEU  48          2HB       LEU  48   0.877  -2.672   8.732
  392   2HB   LEU  48          1HB       LEU  48   0.708  -4.209   7.888
  393    HG   LEU  48           HG       LEU  48   2.494  -2.349   6.497
  394   1HD1  LEU  48          1HD1      LEU  48   2.862  -1.774   8.959
  395   2HD1  LEU  48          2HD1      LEU  48   4.285  -2.313   8.071
  396   3HD1  LEU  48          3HD1      LEU  48   3.452  -3.425   9.155
  397   1HD2  LEU  48          1HD2      LEU  48   2.870  -5.147   7.606
  398   2HD2  LEU  48          2HD2      LEU  48   3.910  -4.355   6.423
  399   3HD2  LEU  48          3HD2      LEU  48   2.249  -4.768   6.001
  400    H    VAL  49           H        VAL  49   1.369  -1.463   4.858
  401    HA   VAL  49           HA       VAL  49   0.553  -3.378   2.781
  402    HB   VAL  49           HB       VAL  49   2.340  -1.955   1.470
  403   1HG1  VAL  49          1HG1      VAL  49  -0.170  -0.621   2.506
  404   2HG1  VAL  49          2HG1      VAL  49  -0.157  -1.845   1.237
  405   3HG1  VAL  49          3HG1      VAL  49   0.646  -0.296   0.980
  406   1HG2  VAL  49          1HG2      VAL  49   2.949   0.119   2.409
  407   2HG2  VAL  49          2HG2      VAL  49   3.133  -0.997   3.762
  408   3HG2  VAL  49          3HG2      VAL  49   1.701   0.027   3.652
  409    H    VAL  50           H        VAL  50   1.517  -5.392   3.196
  410    HA   VAL  50           HA       VAL  50   4.283  -5.597   4.097
  411    HB   VAL  50           HB       VAL  50   2.493  -7.728   2.878
  412   1HG1  VAL  50          1HG1      VAL  50   4.872  -8.344   2.934
  413   2HG1  VAL  50          2HG1      VAL  50   3.976  -9.273   4.135
  414   3HG1  VAL  50          3HG1      VAL  50   4.962  -7.900   4.637
  415   1HG2  VAL  50          1HG2      VAL  50   1.956  -8.316   5.216
  416   2HG2  VAL  50          2HG2      VAL  50   1.460  -6.661   4.864
  417   3HG2  VAL  50          3HG2      VAL  50   2.932  -6.964   5.787
  418    H    GLY  51           H        GLY  51   5.614  -4.565   2.520
  419   1HA   GLY  51          2HA       GLY  51   5.454  -5.654  -0.250
  420   2HA   GLY  51          1HA       GLY  51   6.244  -4.145   0.209
  421    H    GLU  52           H        GLU  52   8.003  -4.675   2.091
  422    HA   GLU  52           HA       GLU  52   9.965  -6.372   0.746
  423   1HB   GLU  52          2HB       GLU  52  10.333  -4.157   2.108
  424   2HB   GLU  52          1HB       GLU  52  10.355  -5.234   3.504
  425   1HG   GLU  52          2HG       GLU  52  12.546  -5.560   3.036
  426   2HG   GLU  52          1HG       GLU  52  11.996  -6.538   1.677
  427    H    ASN  53           H        ASN  53  11.306  -7.406   3.018
  428    HA   ASN  53           HA       ASN  53   9.369  -9.458   4.014
  429   1HB   ASN  53          2HB       ASN  53  11.944  -9.791   2.609
  430   2HB   ASN  53          1HB       ASN  53  11.777 -10.777   4.065
  431   1HD2  ASN  53          1HD2      ASN  53  10.512 -10.243   0.813
  432   2HD2  ASN  53          2HD2      ASN  53   9.512 -11.614   0.780
  433    HA   PRO  54           HA       PRO  54  12.480  -8.894   7.580
  434   1HB   PRO  54          2HB       PRO  54  14.782  -7.473   7.186
  435   2HB   PRO  54          1HB       PRO  54  14.654  -9.211   6.853
  436   1HG   PRO  54          2HG       PRO  54  14.606  -6.915   4.971
  437   2HG   PRO  54          1HG       PRO  54  15.312  -8.528   4.774
  438   1HD   PRO  54          2HD       PRO  54  12.899  -7.753   3.671
  439   2HD   PRO  54          1HD       PRO  54  13.345  -9.436   4.021
  440    H    GLY  55           H        GLY  55  10.924  -6.697   5.904
  441   1HA   GLY  55          2HA       GLY  55  11.683  -4.129   6.770
  442   2HA   GLY  55          1HA       GLY  55  10.033  -4.590   6.366
  443    H    SER  56           H        SER  56  10.892  -2.800   8.505
  444    HA   SER  56           HA       SER  56  10.818  -4.062  11.068
  445   1HB   SER  56          2HB       SER  56  11.414  -1.628  10.539
  446   2HB   SER  56          1HB       SER  56   9.683  -1.325  10.432
  447    HG   SER  56           HG       SER  56  10.574  -0.949  12.538
  448    H    LYS  57           H        LYS  57   8.467  -3.791   8.665
  449    HA   LYS  57           HA       LYS  57   6.045  -3.490  10.098
  450   1HB   LYS  57          2HB       LYS  57   5.068  -4.884   8.208
  451   2HB   LYS  57          1HB       LYS  57   5.963  -3.454   7.710
  452   1HG   LYS  57          2HG       LYS  57   7.914  -4.776   7.169
  453   2HG   LYS  57          1HG       LYS  57   7.185  -6.222   7.866
  454   1HD   LYS  57          2HD       LYS  57   5.492  -6.288   6.148
  455   2HD   LYS  57          1HD       LYS  57   5.988  -4.712   5.530
  456   1HE   LYS  57          2HE       LYS  57   6.976  -6.309   4.057
  457   2HE   LYS  57          1HE       LYS  57   8.286  -5.762   5.105
  458   1HZ   LYS  57          1HZ       LYS  57   6.743  -8.035   6.053
  459   2HZ   LYS  57          2HZ       LYS  57   8.417  -7.745   6.132
  460   3HZ   LYS  57          3HZ       LYS  57   7.718  -8.319   4.694
  461    H    LEU  58           H        LEU  58   8.325  -6.065  10.140
  462    HA   LEU  58           HA       LEU  58   6.899  -8.388  10.586
  463   1HB   LEU  58          2HB       LEU  58   9.426  -8.009  10.761
  464   2HB   LEU  58          1HB       LEU  58   9.137  -7.525  12.431
  465    HG   LEU  58           HG       LEU  58   7.858  -9.783  12.633
  466   1HD1  LEU  58          1HD1      LEU  58   7.747 -10.410  10.312
  467   2HD1  LEU  58          2HD1      LEU  58   8.876 -11.521  11.087
  468   3HD1  LEU  58          3HD1      LEU  58   9.484 -10.185  10.107
  469   1HD2  LEU  58          1HD2      LEU  58  10.873  -9.670  12.287
  470   2HD2  LEU  58          2HD2      LEU  58  10.004 -10.964  13.111
  471   3HD2  LEU  58          3HD2      LEU  58   9.981  -9.329  13.770
  472    H    GLU  59           H        GLU  59   6.867  -5.535  12.579
  473    HA   GLU  59           HA       GLU  59   5.733  -6.888  14.920
  474   1HB   GLU  59          2HB       GLU  59   7.105  -4.725  14.969
  475   2HB   GLU  59          1HB       GLU  59   5.672  -3.917  14.333
  476   1HG   GLU  59          2HG       GLU  59   4.435  -5.088  16.319
  477   2HG   GLU  59          1HG       GLU  59   6.052  -5.266  17.000
  478    H    LYS  60           H        LYS  60   4.411  -4.423  12.643
  479    HA   LYS  60           HA       LYS  60   1.689  -5.070  13.483
  480   1HB   LYS  60          2HB       LYS  60   2.200  -2.800  12.738
  481   2HB   LYS  60          1HB       LYS  60   2.721  -3.407  11.165
  482   1HG   LYS  60          2HG       LYS  60   0.527  -4.063  10.559
  483   2HG   LYS  60          1HG       LYS  60  -0.052  -3.965  12.221
  484   1HD   LYS  60          2HD       LYS  60   0.316  -1.498  12.166
  485   2HD   LYS  60          1HD       LYS  60   0.779  -1.631  10.470
  486   1HE   LYS  60          2HE       LYS  60  -1.920  -2.051  11.729
  487   2HE   LYS  60          1HE       LYS  60  -1.497  -1.105  10.302
  488   1HZ   LYS  60          1HZ       LYS  60  -0.946  -3.227   9.187
  489   2HZ   LYS  60          2HZ       LYS  60  -2.586  -3.095   9.609
  490   3HZ   LYS  60          3HZ       LYS  60  -1.543  -4.064  10.535
  491    H    ALA  61           H        ALA  61   3.805  -5.929  10.786
  492    HA   ALA  61           HA       ALA  61   1.808  -7.159   9.143
  493   1HB   ALA  61          1HB       ALA  61   3.640  -8.229   7.984
  494   2HB   ALA  61          2HB       ALA  61   4.729  -7.922   9.337
  495   3HB   ALA  61          3HB       ALA  61   4.114  -6.580   8.376
  496    H    ARG  62           H        ARG  62   3.857  -8.449  11.805
  497    HA   ARG  62           HA       ARG  62   2.922 -11.162  11.500
  498   1HB   ARG  62          2HB       ARG  62   4.955 -10.518  12.820
  499   2HB   ARG  62          1HB       ARG  62   3.905  -9.746  14.008
  500   1HG   ARG  62          2HG       ARG  62   2.870 -11.846  14.571
  501   2HG   ARG  62          1HG       ARG  62   3.661 -12.662  13.221
  502   1HD   ARG  62          2HD       ARG  62   5.881 -12.052  14.299
  503   2HD   ARG  62          1HD       ARG  62   4.963 -11.542  15.715
  504    HE   ARG  62           HE       ARG  62   4.573 -13.819  16.224
  505   1HH1  ARG  62          1HH2      ARG  62   7.193 -14.056  14.515
  506   2HH1  ARG  62          2HH2      ARG  62   6.792 -15.449  13.567
  507   1HH2  ARG  62          1HH1      ARG  62   3.416 -15.338  14.351
  508   2HH2  ARG  62          2HH1      ARG  62   4.653 -16.176  13.474
  509    H    ALA  63           H        ALA  63   1.830  -8.272  13.175
  510    HA   ALA  63           HA       ALA  63  -0.201  -7.708  14.128
  511   1HB   ALA  63          1HB       ALA  63  -2.162  -9.274  13.383
  512   2HB   ALA  63          2HB       ALA  63  -0.958  -9.954  12.290
  513   3HB   ALA  63          3HB       ALA  63  -1.368  -8.243  12.195
  514    H    LEU  64           H        LEU  64  -1.479  -8.119  15.885
  515    HA   LEU  64           HA       LEU  64  -1.111 -10.729  17.293
  516   1HB   LEU  64          2HB       LEU  64  -1.271  -9.313  19.438
  517   2HB   LEU  64          1HB       LEU  64   0.247  -9.214  18.548
  518    HG   LEU  64           HG       LEU  64  -0.867  -7.178  17.344
  519   1HD1  LEU  64          1HD1      LEU  64  -2.363  -6.022  19.182
  520   2HD1  LEU  64          2HD1      LEU  64  -2.678  -7.682  19.687
  521   3HD1  LEU  64          3HD1      LEU  64  -3.087  -7.165  18.052
  522   1HD2  LEU  64          1HD2      LEU  64  -0.009  -7.069  20.253
  523   2HD2  LEU  64          2HD2      LEU  64  -0.081  -5.680  19.167
  524   3HD2  LEU  64          3HD2      LEU  64   1.057  -6.990  18.850
  525    H    GLY  65           H        GLY  65  -3.157  -8.973  15.622
  526   1HA   GLY  65          2HA       GLY  65  -5.555 -10.152  16.291
  527   2HA   GLY  65          1HA       GLY  65  -5.471  -8.748  17.364
  528    H    VAL  66           H        VAL  66  -3.857  -7.229  15.431
  529    HA   VAL  66           HA       VAL  66  -6.064  -6.112  13.861
  530    HB   VAL  66           HB       VAL  66  -4.223  -4.508  13.079
  531   1HG1  VAL  66          1HG1      VAL  66  -4.182  -3.328  15.239
  532   2HG1  VAL  66          2HG1      VAL  66  -4.705  -4.798  16.061
  533   3HG1  VAL  66          3HG1      VAL  66  -5.785  -3.990  14.926
  534   1HG2  VAL  66          1HG2      VAL  66  -2.649  -5.775  15.334
  535   2HG2  VAL  66          2HG2      VAL  66  -2.102  -4.569  14.168
  536   3HG2  VAL  66          3HG2      VAL  66  -2.397  -6.226  13.647
  537    HA   PRO  67           HA       PRO  67  -5.036  -8.329  10.151
  538   1HB   PRO  67          2HB       PRO  67  -6.373  -6.794   8.334
  539   2HB   PRO  67          1HB       PRO  67  -7.187  -7.883   9.472
  540   1HG   PRO  67          2HG       PRO  67  -6.932  -4.939   9.527
  541   2HG   PRO  67          1HG       PRO  67  -8.234  -5.975  10.126
  542   1HD   PRO  67          2HD       PRO  67  -6.253  -4.775  11.707
  543   2HD   PRO  67          1HD       PRO  67  -7.306  -6.113  12.207
  544    H    THR  68           H        THR  68  -3.762  -8.202   8.231
  545    HA   THR  68           HA       THR  68  -2.237  -5.653   7.814
  546    HB   THR  68           HB       THR  68  -0.262  -7.071   7.279
  547    HG1  THR  68           HG1      THR  68  -0.387  -9.268   7.857
  548   1HG2  THR  68          1HG2      THR  68  -0.052  -6.315   9.441
  549   2HG2  THR  68          2HG2      THR  68  -0.155  -8.044   9.766
  550   3HG2  THR  68          3HG2      THR  68  -1.579  -7.027   9.955
  551    H    LEU  69           H        LEU  69  -2.280  -4.980   5.655
  552    HA   LEU  69           HA       LEU  69  -3.535  -6.861   3.719
  553   1HB   LEU  69          2HB       LEU  69  -3.877  -4.100   4.260
  554   2HB   LEU  69          1HB       LEU  69  -3.110  -4.203   2.676
  555    HG   LEU  69           HG       LEU  69  -4.866  -5.972   2.092
  556   1HD1  LEU  69          1HD1      LEU  69  -5.576  -6.475   4.394
  557   2HD1  LEU  69          2HD1      LEU  69  -6.941  -5.887   3.447
  558   3HD1  LEU  69          3HD1      LEU  69  -6.138  -4.816   4.595
  559   1HD2  LEU  69          1HD2      LEU  69  -5.222  -3.910   1.047
  560   2HD2  LEU  69          2HD2      LEU  69  -5.431  -3.056   2.576
  561   3HD2  LEU  69          3HD2      LEU  69  -6.715  -4.100   1.965
  562    H    THR  70           H        THR  70  -2.223  -7.865   2.292
  563    HA   THR  70           HA       THR  70   0.575  -7.477   2.116
  564    HB   THR  70           HB       THR  70  -1.035  -8.460  -0.229
  565    HG1  THR  70           HG1      THR  70  -1.273  -9.296   2.289
  566   1HG2  THR  70          1HG2      THR  70   0.825  -9.931  -0.546
  567   2HG2  THR  70          2HG2      THR  70   1.463  -9.580   1.060
  568   3HG2  THR  70          3HG2      THR  70   1.510  -8.344  -0.197
  569    H    GLU  71           H        GLU  71   1.849  -6.111   0.889
  570    HA   GLU  71           HA       GLU  71   0.653  -3.775  -0.330
  571   1HB   GLU  71          2HB       GLU  71   2.979  -3.895   0.680
  572   2HB   GLU  71          1HB       GLU  71   3.473  -4.823  -0.734
  573   1HG   GLU  71          2HG       GLU  71   2.063  -2.500  -1.645
  574   2HG   GLU  71          1HG       GLU  71   3.277  -1.983  -0.475
  575    H    GLU  72           H        GLU  72   1.507  -6.935  -1.390
  576    HA   GLU  72           HA       GLU  72   1.871  -6.602  -4.172
  577   1HB   GLU  72          2HB       GLU  72   0.482  -8.835  -2.657
  578   2HB   GLU  72          1HB       GLU  72   0.902  -8.923  -4.368
  579   1HG   GLU  72          2HG       GLU  72   2.921  -8.358  -2.177
  580   2HG   GLU  72          1HG       GLU  72   2.609  -9.968  -2.827
  581    H    GLU  73           H        GLU  73  -1.213  -7.178  -2.432
  582    HA   GLU  73           HA       GLU  73  -2.917  -6.930  -4.693
  583   1HB   GLU  73          2HB       GLU  73  -3.330  -6.412  -1.744
  584   2HB   GLU  73          1HB       GLU  73  -4.630  -6.166  -2.908
  585   1HG   GLU  73          2HG       GLU  73  -3.093  -8.755  -2.528
  586   2HG   GLU  73          1HG       GLU  73  -4.717  -8.436  -1.918
  587    H    LEU  74           H        LEU  74  -1.619  -4.482  -2.477
  588    HA   LEU  74           HA       LEU  74  -3.067  -2.251  -3.528
  589   1HB   LEU  74          2HB       LEU  74  -2.040  -1.728  -1.517
  590   2HB   LEU  74          1HB       LEU  74  -0.581  -2.631  -1.907
  591    HG   LEU  74           HG       LEU  74   0.001  -0.856  -3.590
  592   1HD1  LEU  74          1HD1      LEU  74  -1.236   1.358  -3.203
  593   2HD1  LEU  74          2HD1      LEU  74  -2.480   0.402  -2.398
  594   3HD1  LEU  74          3HD1      LEU  74  -2.115   0.123  -4.100
  595   1HD2  LEU  74          1HD2      LEU  74   0.800  -0.898  -1.172
  596   2HD2  LEU  74          2HD2      LEU  74  -0.455   0.291  -0.829
  597   3HD2  LEU  74          3HD2      LEU  74   0.844   0.680  -1.956
  598    H    TYR  75           H        TYR  75   0.150  -3.579  -4.345
  599    HA   TYR  75           HA       TYR  75   0.673  -1.638  -6.415
  600   1HB   TYR  75          2HB       TYR  75   2.359  -3.180  -5.216
  601   2HB   TYR  75          1HB       TYR  75   1.828  -4.428  -6.343
  602    HD1  TYR  75           HD1      TYR  75   2.612  -4.466  -8.582
  603    HD2  TYR  75           HD2      TYR  75   3.237  -0.977  -6.155
  604    HE1  TYR  75           HE1      TYR  75   4.081  -3.509 -10.335
  605    HE2  TYR  75           HE2      TYR  75   4.707  -0.019  -7.909
  606    HH   TYR  75           HH       TYR  75   4.893  -1.332 -11.066
  607    H    ARG  76           H        ARG  76  -1.082  -4.669  -6.292
  608    HA   ARG  76           HA       ARG  76  -1.137  -5.247  -9.087
  609   1HB   ARG  76          2HB       ARG  76  -1.910  -6.783  -7.237
  610   2HB   ARG  76          1HB       ARG  76  -3.351  -5.780  -7.083
  611   1HG   ARG  76          2HG       ARG  76  -3.732  -6.177  -9.578
  612   2HG   ARG  76          1HG       ARG  76  -2.479  -7.415  -9.474
  613   1HD   ARG  76          2HD       ARG  76  -3.925  -8.255  -7.422
  614   2HD   ARG  76          1HD       ARG  76  -5.214  -7.378  -8.246
  615    HE   ARG  76           HE       ARG  76  -3.850  -9.799  -9.250
  616   1HH1  ARG  76          1HH1      ARG  76  -4.506  -7.313 -11.137
  617   2HH1  ARG  76          2HH1      ARG  76  -5.926  -7.938 -11.908
  618   1HH2  ARG  76          1HH2      ARG  76  -6.319 -10.548  -9.658
  619   2HH2  ARG  76          2HH2      ARG  76  -6.952  -9.770 -11.070
  620    H    LEU  77           H        LEU  77  -4.000  -4.061  -7.299
  621    HA   LEU  77           HA       LEU  77  -5.367  -3.020  -9.478
  622   1HB   LEU  77          2HB       LEU  77  -5.305  -1.789  -6.709
  623   2HB   LEU  77          1HB       LEU  77  -6.590  -1.613  -7.904
  624    HG   LEU  77           HG       LEU  77  -5.743  -4.152  -6.479
  625   1HD1  LEU  77          1HD1      LEU  77  -7.438  -3.646  -5.093
  626   2HD1  LEU  77          2HD1      LEU  77  -8.554  -3.627  -6.458
  627   3HD1  LEU  77          3HD1      LEU  77  -7.719  -2.151  -5.983
  628   1HD2  LEU  77          1HD2      LEU  77  -6.219  -4.963  -8.627
  629   2HD2  LEU  77          2HD2      LEU  77  -7.415  -3.706  -8.944
  630   3HD2  LEU  77          3HD2      LEU  77  -7.803  -5.037  -7.855
  631    H    LEU  78           H        LEU  78  -2.579  -1.623  -7.865
  632    HA   LEU  78           HA       LEU  78  -2.804   1.072  -8.728
  633   1HB   LEU  78          2HB       LEU  78  -0.980  -0.111  -7.261
  634   2HB   LEU  78          1HB       LEU  78  -0.165  -0.377  -8.799
  635    HG   LEU  78           HG       LEU  78  -1.151   2.374  -8.468
  636   1HD1  LEU  78          1HD1      LEU  78   1.094   1.398  -6.674
  637   2HD1  LEU  78          2HD1      LEU  78  -0.527   1.796  -6.106
  638   3HD1  LEU  78          3HD1      LEU  78   0.494   3.051  -6.808
  639   1HD2  LEU  78          1HD2      LEU  78   0.388   1.571 -10.263
  640   2HD2  LEU  78          2HD2      LEU  78   1.598   1.211  -9.031
  641   3HD2  LEU  78          3HD2      LEU  78   1.095   2.878  -9.313
  642    H    GLU  79           H        GLU  79  -0.604  -1.254 -10.305
  643    HA   GLU  79           HA       GLU  79  -0.525   0.106 -12.797
  644   1HB   GLU  79          2HB       GLU  79  -0.244  -2.890 -12.438
  645   2HB   GLU  79          1HB       GLU  79   0.482  -1.888 -13.696
  646   1HG   GLU  79          2HG       GLU  79   1.560  -0.611 -11.665
  647   2HG   GLU  79          1HG       GLU  79   1.218  -2.103 -10.790
  648    H    ALA  80           H        ALA  80  -2.490  -2.690 -11.788
  649    HA   ALA  80           HA       ALA  80  -3.975  -3.063 -14.153
  650   1HB   ALA  80          1HB       ALA  80  -3.940  -4.499 -12.029
  651   2HB   ALA  80          2HB       ALA  80  -5.496  -4.325 -12.838
  652   3HB   ALA  80          3HB       ALA  80  -5.147  -3.385 -11.389
  653    H    ARG  81           H        ARG  81  -4.017  -0.349 -12.092
  654    HA   ARG  81           HA       ARG  81  -6.699   0.462 -13.150
  655   1HB   ARG  81          2HB       ARG  81  -6.477   0.339 -10.629
  656   2HB   ARG  81          1HB       ARG  81  -5.283   1.633 -10.737
  657   1HG   ARG  81          2HG       ARG  81  -7.380   2.605 -12.265
  658   2HG   ARG  81          1HG       ARG  81  -8.209   1.763 -10.956
  659   1HD   ARG  81          2HD       ARG  81  -7.812   4.054 -10.263
  660   2HD   ARG  81          1HD       ARG  81  -6.762   2.996  -9.321
  661    HE   ARG  81           HE       ARG  81  -4.974   3.630 -11.090
  662   1HH1  ARG  81          1HH1      ARG  81  -7.103   5.489 -12.377
  663   2HH1  ARG  81          2HH1      ARG  81  -6.550   7.027 -11.801
  664   1HH2  ARG  81          1HH2      ARG  81  -4.481   5.668  -9.372
  665   2HH2  ARG  81          2HH2      ARG  81  -5.070   7.126 -10.097
  666    H    THR  82           H        THR  82  -3.334   1.440 -12.590
  667    HA   THR  82           HA       THR  82  -3.622   4.069 -13.777
  668    HB   THR  82           HB       THR  82  -1.183   4.097 -13.853
  669    HG1  THR  82           HG1      THR  82  -1.584   1.365 -13.819
  670   1HG2  THR  82          1HG2      THR  82  -1.390   4.496 -11.645
  671   2HG2  THR  82          2HG2      THR  82  -0.998   2.797 -11.390
  672   3HG2  THR  82          3HG2      THR  82  -2.682   3.307 -11.481
  673    H    GLY  83           H        GLY  83  -2.594   0.901 -14.983
  674   1HA   GLY  83          2HA       GLY  83  -2.940   0.054 -17.195
  675   2HA   GLY  83          1HA       GLY  83  -3.397   1.677 -17.720
  676    H    LYS  84           H        LYS  84  -0.573   1.556 -15.796
  677    HA   LYS  84           HA       LYS  84   1.305   1.186 -18.021
  678   1HB   LYS  84          2HB       LYS  84   0.587   3.532 -18.335
  679   2HB   LYS  84          1HB       LYS  84   0.989   3.882 -16.654
  680   1HG   LYS  84          2HG       LYS  84   3.295   3.666 -17.023
  681   2HG   LYS  84          1HG       LYS  84   3.069   2.723 -18.497
  682   1HD   LYS  84          2HD       LYS  84   1.833   5.376 -18.660
  683   2HD   LYS  84          1HD       LYS  84   3.573   5.455 -18.387
  684   1HE   LYS  84          2HE       LYS  84   3.117   5.393 -20.792
  685   2HE   LYS  84          1HE       LYS  84   3.920   3.902 -20.300
  686   1HZ   LYS  84          1HZ       LYS  84   1.986   3.537 -21.760
  687   2HZ   LYS  84          2HZ       LYS  84   0.980   4.214 -20.570
  688   3HZ   LYS  84          3HZ       LYS  84   1.826   2.774 -20.253
  689    H    LYS  85           H        LYS  85   3.579   1.217 -17.165
  690    HA   LYS  85           HA       LYS  85   3.759  -0.061 -14.621
  691   1HB   LYS  85          2HB       LYS  85   6.240   0.351 -14.836
  692   2HB   LYS  85          1HB       LYS  85   5.504  -0.502 -16.190
  693   1HG   LYS  85          2HG       LYS  85   5.794   1.255 -17.634
  694   2HG   LYS  85          1HG       LYS  85   5.575   2.463 -16.374
  695   1HD   LYS  85          2HD       LYS  85   7.954   2.172 -17.384
  696   2HD   LYS  85          1HD       LYS  85   7.801   2.286 -15.638
  697   1HE   LYS  85          2HE       LYS  85   8.366   0.086 -15.300
  698   2HE   LYS  85          1HE       LYS  85   7.640  -0.448 -16.814
  699   1HZ   LYS  85          1HZ       LYS  85  10.027  -0.596 -16.937
  700   2HZ   LYS  85          2HZ       LYS  85  10.192   1.042 -16.516
  701   3HZ   LYS  85          3HZ       LYS  85   9.483   0.610 -18.000
  702    H    ALA  86           H        ALA  86   4.200   0.682 -12.593
  703    HA   ALA  86           HA       ALA  86   3.492   3.297 -11.833
  704   1HB   ALA  86          1HB       ALA  86   5.458   1.550 -10.331
  705   2HB   ALA  86          2HB       ALA  86   3.720   1.249 -10.335
  706   3HB   ALA  86          3HB       ALA  86   4.353   2.750  -9.661
  707    H    GLU  87           H        GLU  87   6.426   2.139 -13.248
  708    HA   GLU  87           HA       GLU  87   8.085   4.328 -12.231
  709   1HB   GLU  87          2HB       GLU  87   8.485   1.885 -13.753
  710   2HB   GLU  87          1HB       GLU  87   9.304   3.244 -14.522
  711   1HG   GLU  87          2HG       GLU  87  10.486   3.771 -12.475
  712   2HG   GLU  87          1HG       GLU  87   9.560   2.566 -11.578
  713    H    GLU  88           H        GLU  88   6.593   3.454 -15.373
  714    HA   GLU  88           HA       GLU  88   5.514   5.782 -16.217
  715   1HB   GLU  88          2HB       GLU  88   8.441   6.190 -16.077
  716   2HB   GLU  88          1HB       GLU  88   7.714   6.667 -17.607
  717   1HG   GLU  88          2HG       GLU  88   6.373   7.508 -15.060
  718   2HG   GLU  88          1HG       GLU  88   7.804   8.382 -15.605
  719    H    LEU  89           H        LEU  89   8.196   5.220 -18.332
  720    HA   LEU  89           HA       LEU  89   6.741   4.516 -20.568
  721   1HB   LEU  89          2HB       LEU  89   9.323   4.937 -20.184
  722   2HB   LEU  89          1HB       LEU  89   9.400   3.182 -20.165
  723    HG   LEU  89           HG       LEU  89   9.780   4.005 -22.437
  724   1HD1  LEU  89          1HD1      LEU  89   6.982   2.858 -22.315
  725   2HD1  LEU  89          2HD1      LEU  89   8.430   1.893 -22.025
  726   3HD1  LEU  89          3HD1      LEU  89   8.176   2.653 -23.596
  727   1HD2  LEU  89          1HD2      LEU  89   8.238   6.091 -21.879
  728   2HD2  LEU  89          2HD2      LEU  89   6.983   5.076 -22.591
  729   3HD2  LEU  89          3HD2      LEU  89   8.404   5.515 -23.537
  730    H    VAL  90           H        VAL  90   8.785   1.810 -19.663
  731    HA   VAL  90           HA       VAL  90   6.993  -0.015 -18.570
  732    HB   VAL  90           HB       VAL  90   6.254   0.640 -21.287
  733   1HG1  VAL  90          1HG1      VAL  90   7.781  -1.193 -21.934
  734   2HG1  VAL  90          2HG1      VAL  90   6.097  -1.640 -22.202
  735   3HG1  VAL  90          3HG1      VAL  90   6.962  -2.269 -20.801
  736   1HG2  VAL  90          1HG2      VAL  90   4.733   0.295 -19.344
  737   2HG2  VAL  90          2HG2      VAL  90   5.165  -1.414 -19.333
  738   3HG2  VAL  90          3HG2      VAL  90   4.301  -0.730 -20.711
  739    H    GLY  91           H        GLY  91   7.960  -2.076 -18.401
  740   1HA   GLY  91          2HA       GLY  91  10.797  -2.182 -19.012
  741   2HA   GLY  91          1HA       GLY  91   9.849  -3.481 -18.287
  742    H    SER  92           H        SER  92   7.913  -3.886 -20.238
  743    HA   SER  92           HA       SER  92   9.276  -4.291 -22.823
  744   1HB   SER  92          2HB       SER  92   8.572  -6.767 -22.749
  745   2HB   SER  92          1HB       SER  92   9.983  -6.316 -21.797
  746    HG   SER  92           HG       SER  92   7.320  -6.745 -20.924
  Start of MODEL    7
    1    HA   MET   1           HA       MET   1 -15.926  -0.507 -15.109
    2   1HB   MET   1          2HB       MET   1 -18.377  -0.702 -15.442
    3   2HB   MET   1          1HB       MET   1 -17.867  -1.444 -13.926
    4   1HG   MET   1          2HG       MET   1 -18.653   0.414 -12.641
    5   2HG   MET   1          1HG       MET   1 -18.866   1.409 -14.082
    6   1HE   MET   1          1HE       MET   1 -21.006   1.953 -12.885
    7   2HE   MET   1          2HE       MET   1 -21.207   0.664 -11.702
    8   3HE   MET   1          3HE       MET   1 -22.474   0.966 -12.888
    9    H    GLU   2           H        GLU   2 -16.380   2.574 -13.781
   10    HA   GLU   2           HA       GLU   2 -16.300   3.786 -16.452
   11   1HB   GLU   2          2HB       GLU   2 -18.785   3.389 -15.637
   12   2HB   GLU   2          1HB       GLU   2 -18.469   4.808 -14.641
   13   1HG   GLU   2          2HG       GLU   2 -19.436   5.543 -16.747
   14   2HG   GLU   2          1HG       GLU   2 -17.741   6.029 -16.713
   15    H    LYS   3           H        LYS   3 -17.373   6.297 -14.890
   16    HA   LYS   3           HA       LYS   3 -14.731   7.270 -14.161
   17   1HB   LYS   3          2HB       LYS   3 -17.071   8.465 -14.980
   18   2HB   LYS   3          1HB       LYS   3 -17.053   8.848 -13.259
   19   1HG   LYS   3          2HG       LYS   3 -14.687   9.662 -13.535
   20   2HG   LYS   3          1HG       LYS   3 -14.862   9.431 -15.275
   21   1HD   LYS   3          2HD       LYS   3 -16.945  10.930 -15.099
   22   2HD   LYS   3          1HD       LYS   3 -16.363  11.354 -13.489
   23   1HE   LYS   3          2HE       LYS   3 -15.381  13.025 -14.792
   24   2HE   LYS   3          1HE       LYS   3 -14.094  11.820 -14.738
   25   1HZ   LYS   3          1HZ       LYS   3 -16.061  12.241 -16.918
   26   2HZ   LYS   3          2HZ       LYS   3 -14.994  10.921 -16.849
   27   3HZ   LYS   3          3HZ       LYS   3 -14.387  12.502 -16.985
   28    H    GLY   4           H        GLY   4 -16.490   5.120 -12.561
   29   1HA   GLY   4          2HA       GLY   4 -16.095   6.355  -9.868
   30   2HA   GLY   4          1HA       GLY   4 -17.190   5.013 -10.206
   31    H    GLY   5           H        GLY   5 -13.994   5.162 -11.604
   32   1HA   GLY   5          2HA       GLY   5 -12.988   2.727 -11.331
   33   2HA   GLY   5          1HA       GLY   5 -11.964   4.087 -10.883
   34    H    GLU   6           H        GLU   6 -13.276   1.216  -9.792
   35    HA   GLU   6           HA       GLU   6 -13.005   2.023  -6.926
   36   1HB   GLU   6          2HB       GLU   6 -15.150   0.831  -8.051
   37   2HB   GLU   6          1HB       GLU   6 -14.211  -0.605  -7.650
   38   1HG   GLU   6          2HG       GLU   6 -15.709  -0.004  -5.790
   39   2HG   GLU   6          1HG       GLU   6 -14.021   0.172  -5.310
   40    H    ALA   7           H        ALA   7 -10.759   1.431  -8.682
   41    HA   ALA   7           HA       ALA   7  -9.623  -1.045  -8.734
   42   1HB   ALA   7          1HB       ALA   7  -7.961   0.343  -9.382
   43   2HB   ALA   7          2HB       ALA   7  -7.533   0.464  -7.676
   44   3HB   ALA   7          3HB       ALA   7  -8.592   1.669  -8.406
   45    H    LEU   8           H        LEU   8  -8.475   0.872  -5.975
   46    HA   LEU   8           HA       LEU   8  -9.240  -1.369  -4.158
   47   1HB   LEU   8          2HB       LEU   8  -7.007  -0.950  -2.983
   48   2HB   LEU   8          1HB       LEU   8  -6.926  -1.781  -4.533
   49    HG   LEU   8           HG       LEU   8  -6.517   0.506  -5.595
   50   1HD1  LEU   8          1HD1      LEU   8  -6.593   1.206  -2.694
   51   2HD1  LEU   8          2HD1      LEU   8  -7.059   2.170  -4.094
   52   3HD1  LEU   8          3HD1      LEU   8  -5.356   1.990  -3.675
   53   1HD2  LEU   8          1HD2      LEU   8  -4.369  -0.178  -5.570
   54   2HD2  LEU   8          2HD2      LEU   8  -4.793  -1.324  -4.301
   55   3HD2  LEU   8          3HD2      LEU   8  -4.203   0.280  -3.876
   56    H    LYS   9           H        LYS   9  -9.516   1.819  -4.880
   57    HA   LYS   9           HA       LYS   9  -9.130   3.347  -2.600
   58   1HB   LYS   9          2HB       LYS   9 -10.082   4.091  -4.834
   59   2HB   LYS   9          1HB       LYS   9 -11.645   3.491  -4.284
   60   1HG   LYS   9          2HG       LYS   9 -11.755   5.074  -2.516
   61   2HG   LYS   9          1HG       LYS   9 -10.039   5.458  -2.646
   62   1HD   LYS   9          2HD       LYS   9 -10.504   6.353  -4.963
   63   2HD   LYS   9          1HD       LYS   9 -12.223   6.145  -4.631
   64   1HE   LYS   9          2HE       LYS   9 -12.245   7.810  -2.992
   65   2HE   LYS   9          1HE       LYS   9 -10.515   7.669  -2.684
   66   1HZ   LYS   9          1HZ       LYS   9 -10.279   8.477  -5.086
   67   2HZ   LYS   9          2HZ       LYS   9 -10.699   9.615  -3.896
   68   3HZ   LYS   9          3HZ       LYS   9 -11.889   8.989  -4.936
   69    H    GLY  10           H        GLY  10 -11.031   4.181  -1.123
   70   1HA   GLY  10          2HA       GLY  10 -12.790   3.730   0.390
   71   2HA   GLY  10          1HA       GLY  10 -13.043   2.180  -0.412
   72    H    LEU  11           H        LEU  11  -9.947   1.864  -0.037
   73    HA   LEU  11           HA       LEU  11 -10.171   0.744   2.726
   74   1HB   LEU  11          2HB       LEU  11  -8.528  -0.028   0.311
   75   2HB   LEU  11          1HB       LEU  11  -8.103  -0.590   1.929
   76    HG   LEU  11           HG       LEU  11 -10.937  -0.898   0.993
   77   1HD1  LEU  11          1HD1      LEU  11  -9.663  -1.799  -0.875
   78   2HD1  LEU  11          2HD1      LEU  11 -10.316  -3.140   0.066
   79   3HD1  LEU  11          3HD1      LEU  11  -8.617  -2.695   0.225
   80   1HD2  LEU  11          1HD2      LEU  11  -9.084  -2.556   2.739
   81   2HD2  LEU  11          2HD2      LEU  11 -10.792  -2.891   2.456
   82   3HD2  LEU  11          3HD2      LEU  11 -10.311  -1.433   3.323
   83    H    THR  12           H        THR  12  -8.238   0.864   4.070
   84    HA   THR  12           HA       THR  12  -6.634   3.331   3.522
   85    HB   THR  12           HB       THR  12  -7.624   2.102   6.109
   86    HG1  THR  12           HG1      THR  12  -8.129   4.541   6.187
   87   1HG2  THR  12          1HG2      THR  12  -6.344   4.112   7.125
   88   2HG2  THR  12          2HG2      THR  12  -5.422   4.109   5.623
   89   3HG2  THR  12          3HG2      THR  12  -5.404   2.691   6.671
   90    H    PHE  13           H        PHE  13  -4.419   3.118   3.556
   91    HA   PHE  13           HA       PHE  13  -3.299   0.482   4.423
   92   1HB   PHE  13          2HB       PHE  13  -2.611   2.134   1.975
   93   2HB   PHE  13          1HB       PHE  13  -1.582   0.839   2.578
   94    HD1  PHE  13           HD1      PHE  13  -3.598   1.371  -0.008
   95    HD2  PHE  13           HD2      PHE  13  -3.480  -1.234   3.411
   96    HE1  PHE  13           HE1      PHE  13  -4.970  -0.296  -1.226
   97    HE2  PHE  13           HE2      PHE  13  -4.856  -2.894   2.189
   98    HZ   PHE  13           HZ       PHE  13  -5.604  -2.424  -0.130
   99    H    VAL  14           H        VAL  14  -1.458   0.599   5.647
  100    HA   VAL  14           HA       VAL  14  -0.253   3.301   6.009
  101    HB   VAL  14           HB       VAL  14  -0.350   3.193   8.333
  102   1HG1  VAL  14          1HG1      VAL  14  -2.659   2.932   8.873
  103   2HG1  VAL  14          2HG1      VAL  14  -2.891   1.749   7.587
  104   3HG1  VAL  14          3HG1      VAL  14  -2.601   3.440   7.186
  105   1HG2  VAL  14          1HG2      VAL  14   0.296   1.234   9.257
  106   2HG2  VAL  14          2HG2      VAL  14  -0.314   0.300   7.897
  107   3HG2  VAL  14          3HG2      VAL  14  -1.408   0.790   9.185
  108    H    ILE  15           H        ILE  15   1.892   3.185   7.095
  109    HA   ILE  15           HA       ILE  15   3.356   0.660   6.430
  110    HB   ILE  15           HB       ILE  15   5.220   2.664   6.090
  111   1HG1  ILE  15          2HG1      ILE  15   2.546   3.672   5.058
  112   2HG1  ILE  15          1HG1      ILE  15   3.493   4.405   6.352
  113   1HG2  ILE  15          1HG2      ILE  15   4.184   0.656   4.572
  114   2HG2  ILE  15          2HG2      ILE  15   5.323   1.853   3.957
  115   3HG2  ILE  15          3HG2      ILE  15   3.593   2.061   3.685
  116   1HD1  ILE  15          1HD1      ILE  15   3.950   5.653   4.356
  117   2HD1  ILE  15          2HD1      ILE  15   4.231   4.182   3.426
  118   3HD1  ILE  15          3HD1      ILE  15   5.376   4.667   4.675
  119    H    THR  16           H        THR  16   4.947   0.038   8.013
  120    HA   THR  16           HA       THR  16   4.633   0.973  10.647
  121    HB   THR  16           HB       THR  16   5.914  -1.110   9.499
  122    HG1  THR  16           HG1      THR  16   5.303  -1.045  11.642
  123   1HG2  THR  16          1HG2      THR  16   8.235   0.434  10.615
  124   2HG2  THR  16          2HG2      THR  16   7.788   0.633   8.921
  125   3HG2  THR  16          3HG2      THR  16   8.237  -0.956   9.531
  126    H    GLY  17           H        GLY  17   5.909   2.727   8.140
  127   1HA   GLY  17          2HA       GLY  17   6.854   4.908   8.275
  128   2HA   GLY  17          1HA       GLY  17   7.166   4.640   9.995
  129    H    GLU  18           H        GLU  18   8.002   2.336   7.529
  130    HA   GLU  18           HA       GLU  18  10.425   2.739   6.534
  131   1HB   GLU  18          2HB       GLU  18  11.417   3.649   8.548
  132   2HB   GLU  18          1HB       GLU  18  10.873   2.270   9.505
  133   1HG   GLU  18          2HG       GLU  18  12.615   0.972   8.826
  134   2HG   GLU  18          1HG       GLU  18  12.516   1.547   7.162
  135    H    LEU  19           H        LEU  19   8.933   0.989   5.639
  136    HA   LEU  19           HA       LEU  19   9.044  -1.631   6.917
  137   1HB   LEU  19          2HB       LEU  19   8.058  -0.624   4.251
  138   2HB   LEU  19          1HB       LEU  19   8.155  -2.351   4.590
  139    HG   LEU  19           HG       LEU  19   6.836  -1.830   6.736
  140   1HD1  LEU  19          1HD1      LEU  19   6.658   0.770   5.237
  141   2HD1  LEU  19          2HD1      LEU  19   6.948   0.499   6.955
  142   3HD1  LEU  19          3HD1      LEU  19   5.339   0.252   6.282
  143   1HD2  LEU  19          1HD2      LEU  19   4.664  -1.734   5.431
  144   2HD2  LEU  19          2HD2      LEU  19   5.776  -2.998   4.904
  145   3HD2  LEU  19          3HD2      LEU  19   5.629  -1.508   3.971
  146    H    SER  20           H        SER  20  11.327   0.187   5.333
  147    HA   SER  20           HA       SER  20  13.517  -0.422   4.706
  148   1HB   SER  20          2HB       SER  20  14.283  -2.586   4.877
  149   2HB   SER  20          1HB       SER  20  12.838  -2.740   5.862
  150    HG   SER  20           HG       SER  20  12.133  -4.111   4.444
  151    H    ARG  21           H        ARG  21  11.082   0.220   3.129
  152    HA   ARG  21           HA       ARG  21  12.171  -0.478   0.444
  153   1HB   ARG  21          2HB       ARG  21   9.414  -1.001   1.528
  154   2HB   ARG  21          1HB       ARG  21   9.589  -0.599  -0.175
  155   1HG   ARG  21          2HG       ARG  21  11.447  -2.656   0.922
  156   2HG   ARG  21          1HG       ARG  21   9.763  -3.125   0.727
  157   1HD   ARG  21          2HD       ARG  21  11.485  -1.918  -1.455
  158   2HD   ARG  21          1HD       ARG  21  11.109  -3.634  -1.297
  159    HE   ARG  21           HE       ARG  21   8.815  -1.771  -1.493
  160   1HH1  ARG  21          1HH1      ARG  21  10.973  -2.693  -3.778
  161   2HH1  ARG  21          2HH1      ARG  21   9.891  -3.672  -4.711
  162   1HH2  ARG  21          1HH2      ARG  21   7.380  -3.647  -2.322
  163   2HH2  ARG  21          2HH2      ARG  21   7.859  -4.213  -3.886
  164    HA   PRO  22           HA       PRO  22  11.378   3.794  -0.454
  165   1HB   PRO  22          2HB       PRO  22  10.097   3.818  -2.878
  166   2HB   PRO  22          1HB       PRO  22  11.821   3.451  -2.686
  167   1HG   PRO  22          2HG       PRO  22   9.519   1.585  -3.014
  168   2HG   PRO  22          1HG       PRO  22  11.129   1.532  -3.754
  169   1HD   PRO  22          2HD       PRO  22  10.480  -0.026  -1.634
  170   2HD   PRO  22          1HD       PRO  22  12.121   0.608  -1.862
  171    H    ARG  23           H        ARG  23   9.387   2.569   1.199
  172    HA   ARG  23           HA       ARG  23   6.718   2.845   0.676
  173   1HB   ARG  23          2HB       ARG  23   6.440   3.562   3.079
  174   2HB   ARG  23          1HB       ARG  23   7.434   2.126   2.846
  175   1HG   ARG  23          2HG       ARG  23   9.327   3.160   3.580
  176   2HG   ARG  23          1HG       ARG  23   8.928   4.676   2.772
  177   1HD   ARG  23          2HD       ARG  23   7.398   5.295   4.530
  178   2HD   ARG  23          1HD       ARG  23   7.537   3.706   5.281
  179    HE   ARG  23           HE       ARG  23   9.791   4.297   5.996
  180   1HH1  ARG  23          1HH1      ARG  23   7.714   6.747   6.243
  181   2HH1  ARG  23          2HH1      ARG  23   8.838   8.043   6.004
  182   1HH2  ARG  23          1HH2      ARG  23  11.389   5.978   4.887
  183   2HH2  ARG  23          2HH2      ARG  23  10.919   7.608   5.237
  184    H    GLU  24           H        GLU  24   8.925   5.473   0.483
  185    HA   GLU  24           HA       GLU  24   6.905   7.557   0.981
  186   1HB   GLU  24          2HB       GLU  24   9.316   7.977   1.442
  187   2HB   GLU  24          1HB       GLU  24   9.668   7.750  -0.272
  188   1HG   GLU  24          2HG       GLU  24   8.259   9.659  -0.855
  189   2HG   GLU  24          1HG       GLU  24   7.780   9.854   0.831
  190    H    GLU  25           H        GLU  25   8.781   6.415  -1.787
  191    HA   GLU  25           HA       GLU  25   7.448   7.838  -3.840
  192   1HB   GLU  25          2HB       GLU  25   9.509   6.558  -4.249
  193   2HB   GLU  25          1HB       GLU  25   8.641   5.050  -3.974
  194   1HG   GLU  25          2HG       GLU  25   8.891   5.549  -6.397
  195   2HG   GLU  25          1HG       GLU  25   7.198   5.492  -5.907
  196    H    VAL  26           H        VAL  26   6.759   4.512  -2.688
  197    HA   VAL  26           HA       VAL  26   4.427   4.137  -4.290
  198    HB   VAL  26           HB       VAL  26   5.686   2.336  -3.023
  199   1HG1  VAL  26          1HG1      VAL  26   5.332   2.021  -0.707
  200   2HG1  VAL  26          2HG1      VAL  26   3.971   3.142  -0.673
  201   3HG1  VAL  26          3HG1      VAL  26   5.614   3.754  -0.861
  202   1HG2  VAL  26          1HG2      VAL  26   3.354   2.098  -4.025
  203   2HG2  VAL  26          2HG2      VAL  26   2.719   2.389  -2.405
  204   3HG2  VAL  26          3HG2      VAL  26   3.730   0.978  -2.716
  205    H    LYS  27           H        LYS  27   4.906   5.701  -1.156
  206    HA   LYS  27           HA       LYS  27   2.145   5.892  -0.412
  207   1HB   LYS  27          2HB       LYS  27   4.665   7.296   0.351
  208   2HB   LYS  27          1HB       LYS  27   3.148   8.106   0.734
  209   1HG   LYS  27          2HG       LYS  27   3.547   5.198   1.414
  210   2HG   LYS  27          1HG       LYS  27   4.144   6.463   2.487
  211   1HD   LYS  27          2HD       LYS  27   2.059   7.012   3.197
  212   2HD   LYS  27          1HD       LYS  27   1.382   6.901   1.574
  213   1HE   LYS  27          2HE       LYS  27   0.596   4.821   1.958
  214   2HE   LYS  27          1HE       LYS  27   2.159   4.276   2.567
  215   1HZ   LYS  27          1HZ       LYS  27   0.710   4.094   4.369
  216   2HZ   LYS  27          2HZ       LYS  27  -0.034   5.587   4.054
  217   3HZ   LYS  27          3HZ       LYS  27   1.551   5.537   4.663
  218    H    ALA  28           H        ALA  28   4.213   7.872  -2.488
  219    HA   ALA  28           HA       ALA  28   2.352  10.043  -2.831
  220   1HB   ALA  28          1HB       ALA  28   3.726  10.671  -4.733
  221   2HB   ALA  28          2HB       ALA  28   4.424   9.053  -4.818
  222   3HB   ALA  28          3HB       ALA  28   4.799  10.106  -3.453
  223    H    LEU  29           H        LEU  29   2.748   6.884  -4.266
  224    HA   LEU  29           HA       LEU  29   0.678   7.406  -6.317
  225   1HB   LEU  29          2HB       LEU  29   2.798   5.460  -5.926
  226   2HB   LEU  29          1HB       LEU  29   1.267   4.646  -6.233
  227    HG   LEU  29           HG       LEU  29   2.389   5.087  -8.359
  228   1HD1  LEU  29          1HD1      LEU  29  -0.205   5.627  -7.851
  229   2HD1  LEU  29          2HD1      LEU  29   0.509   5.816  -9.452
  230   3HD1  LEU  29          3HD1      LEU  29   0.312   7.220  -8.403
  231   1HD2  LEU  29          1HD2      LEU  29   3.076   7.269  -9.048
  232   2HD2  LEU  29          2HD2      LEU  29   3.672   7.089  -7.400
  233   3HD2  LEU  29          3HD2      LEU  29   2.221   8.041  -7.713
  234    H    LEU  30           H        LEU  30   1.002   6.028  -3.142
  235    HA   LEU  30           HA       LEU  30  -1.343   4.366  -3.141
  236   1HB   LEU  30          2HB       LEU  30   0.681   4.589  -1.440
  237   2HB   LEU  30          1HB       LEU  30  -0.379   5.754  -0.660
  238    HG   LEU  30           HG       LEU  30  -0.707   3.536   0.321
  239   1HD1  LEU  30          1HD1      LEU  30  -3.035   3.561   0.319
  240   2HD1  LEU  30          2HD1      LEU  30  -3.134   3.915  -1.405
  241   3HD1  LEU  30          3HD1      LEU  30  -2.676   5.183  -0.269
  242   1HD2  LEU  30          1HD2      LEU  30  -0.159   2.561  -2.167
  243   2HD2  LEU  30          2HD2      LEU  30  -1.914   2.386  -2.127
  244   3HD2  LEU  30          3HD2      LEU  30  -0.923   1.616  -0.890
  245    H    ARG  31           H        ARG  31  -0.807   7.686  -1.889
  246    HA   ARG  31           HA       ARG  31  -3.524   8.153  -1.142
  247   1HB   ARG  31          2HB       ARG  31  -1.633   9.581  -0.403
  248   2HB   ARG  31          1HB       ARG  31  -1.443  10.167  -2.056
  249   1HG   ARG  31          2HG       ARG  31  -3.451  11.363  -2.007
  250   2HG   ARG  31          1HG       ARG  31  -4.125  10.374  -0.712
  251   1HD   ARG  31          2HD       ARG  31  -2.327  11.338   0.807
  252   2HD   ARG  31          1HD       ARG  31  -1.961  12.480  -0.487
  253    HE   ARG  31           HE       ARG  31  -4.789  12.432   0.243
  254   1HH1  ARG  31          1HH1      ARG  31  -2.340  13.108   2.302
  255   2HH1  ARG  31          2HH1      ARG  31  -2.622  14.813   2.424
  256   1HH2  ARG  31          1HH2      ARG  31  -4.873  14.902  -0.208
  257   2HH2  ARG  31          2HH2      ARG  31  -4.057  15.826   1.008
  258    H    ARG  32           H        ARG  32  -1.751   8.829  -4.136
  259    HA   ARG  32           HA       ARG  32  -3.828  10.134  -5.567
  260   1HB   ARG  32          2HB       ARG  32  -1.399   9.831  -6.297
  261   2HB   ARG  32          1HB       ARG  32  -1.849   8.203  -6.806
  262   1HG   ARG  32          2HG       ARG  32  -2.134   9.452  -8.774
  263   2HG   ARG  32          1HG       ARG  32  -3.767   9.396  -8.114
  264   1HD   ARG  32          2HD       ARG  32  -3.582  11.667  -8.539
  265   2HD   ARG  32          1HD       ARG  32  -2.984  11.616  -6.881
  266    HE   ARG  32           HE       ARG  32  -0.691  11.744  -7.785
  267   1HH1  ARG  32          1HH1      ARG  32  -2.174  14.162  -8.843
  268   2HH1  ARG  32          2HH1      ARG  32  -1.723  14.139 -10.516
  269   1HH2  ARG  32          1HH2      ARG  32  -0.593  10.862 -10.439
  270   2HH2  ARG  32          2HH2      ARG  32  -0.830  12.270 -11.420
  271    H    LEU  33           H        LEU  33  -3.197   6.710  -4.993
  272    HA   LEU  33           HA       LEU  33  -5.203   5.722  -6.814
  273   1HB   LEU  33          2HB       LEU  33  -3.179   4.606  -5.258
  274   2HB   LEU  33          1HB       LEU  33  -4.659   3.979  -4.536
  275    HG   LEU  33           HG       LEU  33  -5.421   3.176  -6.723
  276   1HD1  LEU  33          1HD1      LEU  33  -4.550   4.704  -8.303
  277   2HD1  LEU  33          2HD1      LEU  33  -3.596   3.251  -8.587
  278   3HD1  LEU  33          3HD1      LEU  33  -2.916   4.584  -7.654
  279   1HD2  LEU  33          1HD2      LEU  33  -2.540   2.313  -6.437
  280   2HD2  LEU  33          2HD2      LEU  33  -3.932   1.342  -6.912
  281   3HD2  LEU  33          3HD2      LEU  33  -3.754   1.869  -5.239
  282    H    GLY  34           H        GLY  34  -5.909   7.749  -4.507
  283   1HA   GLY  34          2HA       GLY  34  -7.970   8.216  -3.484
  284   2HA   GLY  34          1HA       GLY  34  -8.585   6.696  -4.123
  285    H    ALA  35           H        ALA  35  -6.334   5.152  -2.818
  286    HA   ALA  35           HA       ALA  35  -7.687   4.585  -0.348
  287   1HB   ALA  35          1HB       ALA  35  -5.199   3.504   0.007
  288   2HB   ALA  35          2HB       ALA  35  -5.266   3.638  -1.750
  289   3HB   ALA  35          3HB       ALA  35  -6.500   2.720  -0.886
  290    H    LYS  36           H        LYS  36  -7.136   5.145   1.783
  291    HA   LYS  36           HA       LYS  36  -5.770   7.697   2.112
  292   1HB   LYS  36          2HB       LYS  36  -7.757   6.768   3.489
  293   2HB   LYS  36          1HB       LYS  36  -6.540   5.836   4.362
  294   1HG   LYS  36          2HG       LYS  36  -5.299   8.047   4.715
  295   2HG   LYS  36          1HG       LYS  36  -6.763   8.846   4.142
  296   1HD   LYS  36          2HD       LYS  36  -6.760   6.852   6.422
  297   2HD   LYS  36          1HD       LYS  36  -6.591   8.590   6.664
  298   1HE   LYS  36          2HE       LYS  36  -8.754   8.684   5.132
  299   2HE   LYS  36          1HE       LYS  36  -8.966   7.032   5.714
  300   1HZ   LYS  36          1HZ       LYS  36 -10.039   8.258   7.315
  301   2HZ   LYS  36          2HZ       LYS  36  -8.935   9.548   7.237
  302   3HZ   LYS  36          3HZ       LYS  36  -8.497   8.097   8.004
  303    H    VAL  37           H        VAL  37  -3.795   8.054   3.304
  304    HA   VAL  37           HA       VAL  37  -2.049   5.634   3.506
  305    HB   VAL  37           HB       VAL  37  -0.167   7.218   3.082
  306   1HG1  VAL  37          1HG1      VAL  37  -0.599   7.485   0.690
  307   2HG1  VAL  37          2HG1      VAL  37  -2.332   7.297   0.959
  308   3HG1  VAL  37          3HG1      VAL  37  -1.244   5.937   1.238
  309   1HG2  VAL  37          1HG2      VAL  37  -2.454   9.176   2.707
  310   2HG2  VAL  37          2HG2      VAL  37  -0.821   9.470   2.113
  311   3HG2  VAL  37          3HG2      VAL  37  -1.112   9.306   3.844
  312    H    THR  38           H        THR  38  -1.010   5.326   5.452
  313    HA   THR  38           HA       THR  38  -0.859   7.517   7.422
  314    HB   THR  38           HB       THR  38  -1.961   5.057   8.624
  315    HG1  THR  38           HG1      THR  38  -4.050   5.456   7.879
  316   1HG2  THR  38          1HG2      THR  38  -1.574   7.256   9.776
  317   2HG2  THR  38          2HG2      THR  38  -3.228   6.662   9.918
  318   3HG2  THR  38          3HG2      THR  38  -2.848   7.949   8.773
  319    H    ASP  39           H        ASP  39  -0.027   6.108   9.629
  320    HA   ASP  39           HA       ASP  39   1.966   4.116   8.755
  321   1HB   ASP  39          2HB       ASP  39   3.811   5.429   9.889
  322   2HB   ASP  39          1HB       ASP  39   3.217   6.137   8.387
  323    H    SER  40           H        SER  40  -0.268   5.122  10.999
  324    HA   SER  40           HA       SER  40   0.953   3.371  13.081
  325   1HB   SER  40          2HB       SER  40  -0.531   5.950  13.659
  326   2HB   SER  40          1HB       SER  40   0.244   4.891  14.835
  327    HG   SER  40           HG       SER  40   1.545   6.702  14.241
  328    H    VAL  41           H        VAL  41  -0.933   3.024  14.840
  329    HA   VAL  41           HA       VAL  41  -3.578   2.749  13.525
  330    HB   VAL  41           HB       VAL  41  -3.671   0.333  14.326
  331   1HG1  VAL  41          1HG1      VAL  41  -3.281   1.066  11.940
  332   2HG1  VAL  41          2HG1      VAL  41  -2.610  -0.516  12.335
  333   3HG1  VAL  41          3HG1      VAL  41  -1.552   0.891  12.236
  334   1HG2  VAL  41          1HG2      VAL  41  -1.573  -0.812  14.751
  335   2HG2  VAL  41          2HG2      VAL  41  -1.671   0.568  15.845
  336   3HG2  VAL  41          3HG2      VAL  41  -0.653   0.653  14.407
  337    H    SER  42           H        SER  42  -5.281   2.308  15.090
  338    HA   SER  42           HA       SER  42  -4.533   2.525  17.953
  339   1HB   SER  42          2HB       SER  42  -6.362   4.473  16.516
  340   2HB   SER  42          1HB       SER  42  -6.193   4.371  18.267
  341    HG   SER  42           HG       SER  42  -4.470   5.382  16.347
  342    H    ARG  43           H        ARG  43  -7.066   2.119  15.502
  343    HA   ARG  43           HA       ARG  43  -8.203  -0.177  16.744
  344   1HB   ARG  43          2HB       ARG  43  -9.029   1.345  18.465
  345   2HB   ARG  43          1HB       ARG  43  -9.662   2.444  17.239
  346   1HG   ARG  43          2HG       ARG  43 -11.268   0.769  16.498
  347   2HG   ARG  43          1HG       ARG  43 -10.574  -0.428  17.592
  348   1HD   ARG  43          2HD       ARG  43 -11.493   2.155  18.779
  349   2HD   ARG  43          1HD       ARG  43 -12.729   1.005  18.267
  350    HE   ARG  43           HE       ARG  43 -10.581  -0.106  19.953
  351   1HH1  ARG  43          1HH2      ARG  43 -12.158   1.948  21.511
  352   2HH1  ARG  43          2HH2      ARG  43 -13.418   0.975  22.195
  353   1HH2  ARG  43          1HH1      ARG  43 -12.893  -1.691  20.043
  354   2HH2  ARG  43          2HH1      ARG  43 -13.832  -1.084  21.367
  355    H    LYS  44           H        LYS  44  -9.834   2.631  15.294
  356    HA   LYS  44           HA       LYS  44 -11.202   1.113  13.301
  357   1HB   LYS  44          2HB       LYS  44 -10.428   4.048  13.220
  358   2HB   LYS  44          1HB       LYS  44 -11.678   3.280  12.241
  359   1HG   LYS  44          2HG       LYS  44 -13.111   3.831  13.903
  360   2HG   LYS  44          1HG       LYS  44 -12.363   2.525  14.820
  361   1HD   LYS  44          2HD       LYS  44 -12.136   4.342  16.281
  362   2HD   LYS  44          1HD       LYS  44 -10.579   4.334  15.455
  363   1HE   LYS  44          2HE       LYS  44 -11.273   6.597  15.361
  364   2HE   LYS  44          1HE       LYS  44 -11.672   5.955  13.768
  365   1HZ   LYS  44          1HZ       LYS  44 -13.502   6.399  16.054
  366   2HZ   LYS  44          2HZ       LYS  44 -13.934   5.480  14.692
  367   3HZ   LYS  44          3HZ       LYS  44 -13.556   7.128  14.524
  368    H    THR  45           H        THR  45  -7.996   2.528  13.391
  369    HA   THR  45           HA       THR  45  -7.564   1.816  10.524
  370    HB   THR  45           HB       THR  45  -5.746   3.358  12.405
  371    HG1  THR  45           HG1      THR  45  -6.764   5.111  11.791
  372   1HG2  THR  45          1HG2      THR  45  -4.689   4.092  10.290
  373   2HG2  THR  45          2HG2      THR  45  -5.790   3.052   9.388
  374   3HG2  THR  45          3HG2      THR  45  -4.603   2.341  10.482
  375    H    SER  46           H        SER  46  -6.868  -0.256  10.303
  376    HA   SER  46           HA       SER  46  -4.514  -1.143  11.832
  377   1HB   SER  46          2HB       SER  46  -6.767  -3.104  11.791
  378   2HB   SER  46          1HB       SER  46  -5.457  -2.924  12.952
  379    HG   SER  46           HG       SER  46  -6.928  -1.937  14.087
  380    H    TYR  47           H        TYR  47  -4.092  -0.655   9.412
  381    HA   TYR  47           HA       TYR  47  -4.009  -3.251   8.008
  382   1HB   TYR  47          2HB       TYR  47  -5.160  -0.781   6.667
  383   2HB   TYR  47          1HB       TYR  47  -4.951  -2.371   5.935
  384    HD1  TYR  47           HD1      TYR  47  -7.034  -0.295   8.074
  385    HD2  TYR  47           HD2      TYR  47  -6.284  -4.325   6.789
  386    HE1  TYR  47           HE1      TYR  47  -9.254  -0.984   8.935
  387    HE2  TYR  47           HE2      TYR  47  -8.503  -5.014   7.652
  388    HH   TYR  47           HH       TYR  47 -10.343  -4.373   8.705
  389    H    LEU  48           H        LEU  48  -1.996  -3.447   7.164
  390    HA   LEU  48           HA       LEU  48  -0.498  -0.932   6.551
  391   1HB   LEU  48          2HB       LEU  48   0.850  -1.561   8.265
  392   2HB   LEU  48          1HB       LEU  48   0.184  -3.188   8.313
  393    HG   LEU  48           HG       LEU  48   1.952  -2.579   5.979
  394   1HD1  LEU  48          1HD1      LEU  48   3.991  -2.759   7.235
  395   2HD1  LEU  48          2HD1      LEU  48   3.112  -3.037   8.737
  396   3HD1  LEU  48          3HD1      LEU  48   3.052  -1.456   7.958
  397   1HD2  LEU  48          1HD2      LEU  48   2.491  -4.858   6.189
  398   2HD2  LEU  48          2HD2      LEU  48   0.810  -4.815   6.719
  399   3HD2  LEU  48          3HD2      LEU  48   2.107  -4.888   7.910
  400    H    VAL  49           H        VAL  49   0.680  -0.938   4.673
  401    HA   VAL  49           HA       VAL  49   0.088  -3.131   2.767
  402    HB   VAL  49           HB       VAL  49   1.626  -1.433   1.324
  403   1HG1  VAL  49          1HG1      VAL  49  -1.314  -1.315   1.985
  404   2HG1  VAL  49          2HG1      VAL  49  -0.538  -2.005   0.562
  405   3HG1  VAL  49          3HG1      VAL  49  -0.601  -0.255   0.769
  406   1HG2  VAL  49          1HG2      VAL  49   1.988   0.055   3.294
  407   2HG2  VAL  49          2HG2      VAL  49   0.247   0.323   3.383
  408   3HG2  VAL  49          3HG2      VAL  49   1.153   0.881   1.978
  409    H    VAL  50           H        VAL  50   1.513  -4.825   2.769
  410    HA   VAL  50           HA       VAL  50   3.890  -4.957   4.187
  411    HB   VAL  50           HB       VAL  50   3.159  -6.387   1.613
  412   1HG1  VAL  50          1HG1      VAL  50   5.510  -6.693   1.838
  413   2HG1  VAL  50          2HG1      VAL  50   4.797  -8.126   2.575
  414   3HG1  VAL  50          3HG1      VAL  50   5.404  -6.822   3.594
  415   1HG2  VAL  50          1HG2      VAL  50   3.052  -7.389   4.468
  416   2HG2  VAL  50          2HG2      VAL  50   2.305  -8.105   3.040
  417   3HG2  VAL  50          3HG2      VAL  50   1.680  -6.593   3.699
  418    H    GLY  51           H        GLY  51   6.125  -5.201   3.276
  419   1HA   GLY  51          2HA       GLY  51   6.675  -3.209   1.114
  420   2HA   GLY  51          1HA       GLY  51   7.566  -3.139   2.633
  421    H    GLU  52           H        GLU  52   8.461  -5.522   3.216
  422    HA   GLU  52           HA       GLU  52   9.442  -6.882   0.771
  423   1HB   GLU  52          2HB       GLU  52  10.972  -4.903   1.579
  424   2HB   GLU  52          1HB       GLU  52  11.465  -6.039   2.831
  425   1HG   GLU  52          2HG       GLU  52  11.935  -7.712   0.973
  426   2HG   GLU  52          1HG       GLU  52  11.694  -6.390  -0.169
  427    H    ASN  53           H        ASN  53  11.604  -7.788   2.922
  428    HA   ASN  53           HA       ASN  53   9.845  -9.819   4.234
  429   1HB   ASN  53          2HB       ASN  53  10.920 -11.168   2.692
  430   2HB   ASN  53          1HB       ASN  53  12.384 -10.194   2.687
  431   1HD2  ASN  53          1HD2      ASN  53  14.068 -11.406   3.580
  432   2HD2  ASN  53          2HD2      ASN  53  13.927 -12.427   4.930
  433    HA   PRO  54           HA       PRO  54  13.350  -9.036   7.355
  434   1HB   PRO  54          2HB       PRO  54  15.515  -7.521   6.672
  435   2HB   PRO  54          1HB       PRO  54  15.426  -9.265   6.360
  436   1HG   PRO  54          2HG       PRO  54  15.086  -6.991   4.494
  437   2HG   PRO  54          1HG       PRO  54  15.774  -8.597   4.212
  438   1HD   PRO  54          2HD       PRO  54  13.208  -7.808   3.465
  439   2HD   PRO  54          1HD       PRO  54  13.753  -9.486   3.645
  440    H    GLY  55           H        GLY  55  11.617  -6.835   5.733
  441   1HA   GLY  55          2HA       GLY  55  12.455  -4.310   6.782
  442   2HA   GLY  55          1HA       GLY  55  10.850  -4.669   6.156
  443    H    SER  56           H        SER  56  10.996  -3.002   8.278
  444    HA   SER  56           HA       SER  56  10.750  -4.446  10.809
  445   1HB   SER  56          2HB       SER  56  11.605  -2.111  10.687
  446   2HB   SER  56          1HB       SER  56  10.026  -1.581  10.119
  447    HG   SER  56           HG       SER  56  10.720  -1.682  12.556
  448    H    LYS  57           H        LYS  57   8.740  -4.025   8.157
  449    HA   LYS  57           HA       LYS  57   6.187  -3.533   9.285
  450   1HB   LYS  57          2HB       LYS  57   5.276  -4.401   7.279
  451   2HB   LYS  57          1HB       LYS  57   6.847  -3.774   6.798
  452   1HG   LYS  57          2HG       LYS  57   6.398  -6.674   7.553
  453   2HG   LYS  57          1HG       LYS  57   6.285  -6.081   5.899
  454   1HD   LYS  57          2HD       LYS  57   8.659  -5.036   6.455
  455   2HD   LYS  57          1HD       LYS  57   8.694  -6.322   7.661
  456   1HE   LYS  57          2HE       LYS  57   8.083  -6.779   4.731
  457   2HE   LYS  57          1HE       LYS  57   9.682  -6.981   5.442
  458   1HZ   LYS  57          1HZ       LYS  57   9.060  -9.027   5.973
  459   2HZ   LYS  57          2HZ       LYS  57   7.450  -8.737   5.512
  460   3HZ   LYS  57          3HZ       LYS  57   7.967  -8.362   7.087
  461    H    LEU  58           H        LEU  58   8.277  -6.249   9.586
  462    HA   LEU  58           HA       LEU  58   6.568  -8.415  10.010
  463   1HB   LEU  58          2HB       LEU  58   9.166  -8.240  10.195
  464   2HB   LEU  58          1HB       LEU  58   8.859  -7.888  11.895
  465    HG   LEU  58           HG       LEU  58   7.292 -10.030  11.702
  466   1HD1  LEU  58          1HD1      LEU  58   8.307 -11.706  10.184
  467   2HD1  LEU  58          2HD1      LEU  58   9.388 -10.465   9.550
  468   3HD1  LEU  58          3HD1      LEU  58   7.648 -10.337   9.289
  469   1HD2  LEU  58          1HD2      LEU  58   9.204 -11.392  12.480
  470   2HD2  LEU  58          2HD2      LEU  58   9.236  -9.787  13.209
  471   3HD2  LEU  58          3HD2      LEU  58  10.322 -10.170  11.873
  472    H    GLU  59           H        GLU  59   6.852  -5.530  11.914
  473    HA   GLU  59           HA       GLU  59   5.780  -6.640  14.368
  474   1HB   GLU  59          2HB       GLU  59   7.072  -4.513  14.304
  475   2HB   GLU  59          1HB       GLU  59   5.760  -3.765  13.393
  476   1HG   GLU  59          2HG       GLU  59   5.572  -3.217  15.786
  477   2HG   GLU  59          1HG       GLU  59   4.208  -4.208  15.270
  478    H    LYS  60           H        LYS  60   4.232  -4.377  12.026
  479    HA   LYS  60           HA       LYS  60   1.603  -5.193  13.039
  480   1HB   LYS  60          2HB       LYS  60   2.272  -2.844  12.175
  481   2HB   LYS  60          1HB       LYS  60   2.063  -3.533  10.565
  482   1HG   LYS  60          2HG       LYS  60  -0.209  -3.638  10.758
  483   2HG   LYS  60          1HG       LYS  60  -0.141  -4.120  12.453
  484   1HD   LYS  60          2HD       LYS  60  -1.018  -1.982  12.661
  485   2HD   LYS  60          1HD       LYS  60   0.704  -1.629  12.792
  486   1HE   LYS  60          2HE       LYS  60  -0.184  -0.072  11.200
  487   2HE   LYS  60          1HE       LYS  60   0.704  -1.279  10.274
  488   1HZ   LYS  60          1HZ       LYS  60  -1.714  -2.397  10.386
  489   2HZ   LYS  60          2HZ       LYS  60  -1.199  -1.391   9.117
  490   3HZ   LYS  60          3HZ       LYS  60  -2.144  -0.757  10.379
  491    H    ALA  61           H        ALA  61   3.611  -5.823  10.200
  492    HA   ALA  61           HA       ALA  61   1.604  -7.100   8.611
  493   1HB   ALA  61          1HB       ALA  61   4.534  -7.847   8.641
  494   2HB   ALA  61          2HB       ALA  61   3.930  -6.386   7.857
  495   3HB   ALA  61          3HB       ALA  61   3.399  -7.971   7.297
  496    H    ARG  62           H        ARG  62   3.758  -8.329  11.174
  497    HA   ARG  62           HA       ARG  62   2.918 -11.090  10.827
  498   1HB   ARG  62          2HB       ARG  62   5.041 -10.483  11.986
  499   2HB   ARG  62          1HB       ARG  62   4.098  -9.736  13.279
  500   1HG   ARG  62          2HG       ARG  62   3.271 -11.787  14.043
  501   2HG   ARG  62          1HG       ARG  62   3.560 -12.591  12.498
  502   1HD   ARG  62          2HD       ARG  62   5.885 -12.753  12.881
  503   2HD   ARG  62          1HD       ARG  62   5.851 -11.530  14.150
  504    HE   ARG  62           HE       ARG  62   4.415 -14.094  14.612
  505   1HH1  ARG  62          1HH1      ARG  62   5.107 -11.827  16.618
  506   2HH1  ARG  62          2HH1      ARG  62   6.372 -12.593  17.519
  507   1HH2  ARG  62          1HH2      ARG  62   6.854 -15.126  15.200
  508   2HH2  ARG  62          2HH2      ARG  62   7.359 -14.462  16.718
  509    H    ALA  63           H        ALA  63   1.929  -8.331  12.795
  510    HA   ALA  63           HA       ALA  63   0.149  -8.066  14.311
  511   1HB   ALA  63          1HB       ALA  63  -1.009  -7.516  12.366
  512   2HB   ALA  63          2HB       ALA  63  -2.026  -8.761  13.082
  513   3HB   ALA  63          3HB       ALA  63  -0.952  -9.166  11.746
  514    H    LEU  64           H        LEU  64   0.091  -9.268  16.152
  515    HA   LEU  64           HA       LEU  64  -0.491 -12.154  16.042
  516   1HB   LEU  64          2HB       LEU  64  -0.369 -11.900  18.592
  517   2HB   LEU  64          1HB       LEU  64   1.113 -11.551  17.705
  518    HG   LEU  64           HG       LEU  64  -0.686  -9.229  18.059
  519   1HD1  LEU  64          1HD1      LEU  64  -1.041 -10.220  20.237
  520   2HD1  LEU  64          2HD1      LEU  64   0.112  -8.898  20.426
  521   3HD1  LEU  64          3HD1      LEU  64   0.680 -10.568  20.411
  522   1HD2  LEU  64          1HD2      LEU  64   2.231  -9.520  18.798
  523   2HD2  LEU  64          2HD2      LEU  64   1.371  -8.068  18.289
  524   3HD2  LEU  64          3HD2      LEU  64   1.722  -9.340  17.119
  525    H    GLY  65           H        GLY  65  -2.554 -10.235  15.101
  526   1HA   GLY  65          2HA       GLY  65  -4.896 -11.374  15.971
  527   2HA   GLY  65          1HA       GLY  65  -4.606 -10.107  17.167
  528    H    VAL  66           H        VAL  66  -3.280  -8.337  15.270
  529    HA   VAL  66           HA       VAL  66  -5.664  -7.073  14.192
  530    HB   VAL  66           HB       VAL  66  -3.505  -5.655  13.156
  531   1HG1  VAL  66          1HG1      VAL  66  -4.829  -5.333  15.866
  532   2HG1  VAL  66          2HG1      VAL  66  -5.499  -4.765  14.337
  533   3HG1  VAL  66          3HG1      VAL  66  -4.002  -4.069  14.955
  534   1HG2  VAL  66          1HG2      VAL  66  -2.775  -6.539  15.963
  535   2HG2  VAL  66          2HG2      VAL  66  -1.828  -5.531  14.869
  536   3HG2  VAL  66          3HG2      VAL  66  -2.045  -7.244  14.522
  537    HA   PRO  67           HA       PRO  67  -5.193  -8.499  10.010
  538   1HB   PRO  67          2HB       PRO  67  -6.652  -6.583   8.717
  539   2HB   PRO  67          1HB       PRO  67  -7.374  -7.812   9.769
  540   1HG   PRO  67          2HG       PRO  67  -7.082  -4.951  10.208
  541   2HG   PRO  67          1HG       PRO  67  -8.095  -6.122  11.059
  542   1HD   PRO  67          2HD       PRO  67  -5.523  -5.027  11.883
  543   2HD   PRO  67          1HD       PRO  67  -6.636  -6.061  12.803
  544    H    THR  68           H        THR  68  -3.799  -8.303   8.272
  545    HA   THR  68           HA       THR  68  -2.478  -5.655   7.788
  546    HB   THR  68           HB       THR  68  -0.358  -6.646   7.680
  547    HG1  THR  68           HG1      THR  68  -1.636  -9.173   7.542
  548   1HG2  THR  68          1HG2      THR  68  -1.200  -6.682   9.991
  549   2HG2  THR  68          2HG2      THR  68  -0.139  -8.057   9.696
  550   3HG2  THR  68          3HG2      THR  68  -1.883  -8.285   9.724
  551    H    LEU  69           H        LEU  69  -2.407  -5.073   5.594
  552    HA   LEU  69           HA       LEU  69  -3.508  -7.090   3.694
  553   1HB   LEU  69          2HB       LEU  69  -3.798  -4.164   4.016
  554   2HB   LEU  69          1HB       LEU  69  -3.603  -4.711   2.352
  555    HG   LEU  69           HG       LEU  69  -5.997  -4.621   3.103
  556   1HD1  LEU  69          1HD1      LEU  69  -6.578  -6.523   1.901
  557   2HD1  LEU  69          2HD1      LEU  69  -5.323  -7.509   2.651
  558   3HD1  LEU  69          3HD1      LEU  69  -4.895  -6.329   1.411
  559   1HD2  LEU  69          1HD2      LEU  69  -6.796  -5.866   4.878
  560   2HD2  LEU  69          2HD2      LEU  69  -5.159  -5.575   5.464
  561   3HD2  LEU  69          3HD2      LEU  69  -5.561  -7.112   4.699
  562    H    THR  70           H        THR  70  -2.171  -7.906   2.193
  563    HA   THR  70           HA       THR  70   0.595  -7.252   2.018
  564    HB   THR  70           HB       THR  70  -0.959  -8.486  -0.249
  565    HG1  THR  70           HG1      THR  70  -1.677  -9.412   1.712
  566   1HG2  THR  70          1HG2      THR  70   1.685  -9.330   0.941
  567   2HG2  THR  70          2HG2      THR  70   1.584  -8.047  -0.263
  568   3HG2  THR  70          3HG2      THR  70   1.047  -9.677  -0.665
  569    H    GLU  71           H        GLU  71   1.735  -5.921   0.586
  570    HA   GLU  71           HA       GLU  71   0.270  -3.719  -0.626
  571   1HB   GLU  71          2HB       GLU  71   2.634  -3.627   0.355
  572   2HB   GLU  71          1HB       GLU  71   3.171  -4.428  -1.120
  573   1HG   GLU  71          2HG       GLU  71   2.514  -2.606  -2.485
  574   2HG   GLU  71          1HG       GLU  71   1.496  -1.917  -1.220
  575    H    GLU  72           H        GLU  72   1.329  -6.833  -1.626
  576    HA   GLU  72           HA       GLU  72   1.779  -6.680  -4.358
  577   1HB   GLU  72          2HB       GLU  72   1.514  -8.767  -2.814
  578   2HB   GLU  72          1HB       GLU  72  -0.180  -8.714  -3.299
  579   1HG   GLU  72          2HG       GLU  72   0.690 -10.093  -4.954
  580   2HG   GLU  72          1HG       GLU  72   0.849  -8.518  -5.731
  581    H    GLU  73           H        GLU  73  -1.412  -6.644  -2.751
  582    HA   GLU  73           HA       GLU  73  -2.993  -6.446  -5.110
  583   1HB   GLU  73          2HB       GLU  73  -3.795  -6.859  -2.717
  584   2HB   GLU  73          1HB       GLU  73  -3.649  -5.119  -2.469
  585   1HG   GLU  73          2HG       GLU  73  -5.940  -5.597  -3.097
  586   2HG   GLU  73          1HG       GLU  73  -5.162  -4.777  -4.449
  587    H    LEU  74           H        LEU  74  -1.382  -3.974  -3.138
  588    HA   LEU  74           HA       LEU  74  -2.457  -1.662  -4.390
  589   1HB   LEU  74          2HB       LEU  74  -1.063  -1.579  -2.344
  590   2HB   LEU  74          1HB       LEU  74   0.336  -2.103  -3.271
  591    HG   LEU  74           HG       LEU  74   0.121   0.416  -2.806
  592   1HD1  LEU  74          1HD1      LEU  74   0.269   0.200  -5.738
  593   2HD1  LEU  74          2HD1      LEU  74   1.267  -0.972  -4.879
  594   3HD1  LEU  74          3HD1      LEU  74   1.481   0.752  -4.584
  595   1HD2  LEU  74          1HD2      LEU  74  -1.911   0.212  -5.049
  596   2HD2  LEU  74          2HD2      LEU  74  -1.351   1.687  -4.263
  597   3HD2  LEU  74          3HD2      LEU  74  -2.317   0.520  -3.361
  598    H    TYR  75           H        TYR  75   0.371  -3.665  -5.227
  599    HA   TYR  75           HA       TYR  75   1.163  -2.126  -7.518
  600   1HB   TYR  75          2HB       TYR  75   1.660  -4.953  -6.600
  601   2HB   TYR  75          1HB       TYR  75   2.201  -4.428  -8.193
  602    HD1  TYR  75           HD1      TYR  75   3.918  -2.692  -8.443
  603    HD2  TYR  75           HD2      TYR  75   2.649  -4.035  -4.563
  604    HE1  TYR  75           HE1      TYR  75   5.897  -1.604  -7.418
  605    HE2  TYR  75           HE2      TYR  75   4.628  -2.947  -3.540
  606    HH   TYR  75           HH       TYR  75   6.880  -1.015  -5.497
  607    H    ARG  76           H        ARG  76  -1.128  -4.785  -7.063
  608    HA   ARG  76           HA       ARG  76  -1.589  -5.369  -9.822
  609   1HB   ARG  76          2HB       ARG  76  -3.232  -5.708  -7.318
  610   2HB   ARG  76          1HB       ARG  76  -3.913  -6.098  -8.896
  611   1HG   ARG  76          2HG       ARG  76  -2.064  -7.659  -9.329
  612   2HG   ARG  76          1HG       ARG  76  -1.337  -7.247  -7.776
  613   1HD   ARG  76          2HD       ARG  76  -2.687  -9.374  -7.737
  614   2HD   ARG  76          1HD       ARG  76  -3.225  -8.164  -6.574
  615    HE   ARG  76           HE       ARG  76  -5.119  -7.668  -8.068
  616   1HH1  ARG  76          1HH2      ARG  76  -3.073  -9.589  -9.887
  617   2HH1  ARG  76          2HH2      ARG  76  -4.294 -10.688 -10.435
  618   1HH2  ARG  76          1HH1      ARG  76  -6.747  -9.428  -8.332
  619   2HH2  ARG  76          2HH1      ARG  76  -6.373 -10.597  -9.554
  620    H    LEU  77           H        LEU  77  -4.033  -3.764  -7.773
  621    HA   LEU  77           HA       LEU  77  -5.463  -2.546  -9.827
  622   1HB   LEU  77          2HB       LEU  77  -4.982  -1.683  -6.971
  623   2HB   LEU  77          1HB       LEU  77  -6.008  -0.744  -8.049
  624    HG   LEU  77           HG       LEU  77  -7.393  -2.293  -6.782
  625   1HD1  LEU  77          1HD1      LEU  77  -8.654  -3.078  -8.561
  626   2HD1  LEU  77          2HD1      LEU  77  -7.241  -3.640  -9.452
  627   3HD1  LEU  77          3HD1      LEU  77  -7.623  -1.920  -9.401
  628   1HD2  LEU  77          1HD2      LEU  77  -5.915  -4.604  -8.038
  629   2HD2  LEU  77          2HD2      LEU  77  -7.015  -4.618  -6.659
  630   3HD2  LEU  77          3HD2      LEU  77  -5.401  -3.929  -6.492
  631    H    LEU  78           H        LEU  78  -2.463  -1.407  -8.328
  632    HA   LEU  78           HA       LEU  78  -2.471   1.219  -9.472
  633   1HB   LEU  78          2HB       LEU  78  -0.914   0.466  -7.670
  634   2HB   LEU  78          1HB       LEU  78  -0.075  -0.540  -8.849
  635    HG   LEU  78           HG       LEU  78   0.067   1.741 -10.201
  636   1HD1  LEU  78          1HD1      LEU  78   0.420   3.625  -8.563
  637   2HD1  LEU  78          2HD1      LEU  78  -0.279   2.598  -7.313
  638   3HD1  LEU  78          3HD1      LEU  78  -1.256   3.094  -8.695
  639   1HD2  LEU  78          1HD2      LEU  78   2.261   2.143  -9.146
  640   2HD2  LEU  78          2HD2      LEU  78   1.988   0.415  -9.368
  641   3HD2  LEU  78          3HD2      LEU  78   1.791   1.143  -7.772
  642    H    GLU  79           H        GLU  79  -0.528  -1.590 -10.544
  643    HA   GLU  79           HA       GLU  79   0.273  -0.603 -13.034
  644   1HB   GLU  79          2HB       GLU  79   0.653  -2.945 -11.755
  645   2HB   GLU  79          1HB       GLU  79  -0.519  -3.473 -12.960
  646   1HG   GLU  79          2HG       GLU  79   2.023  -1.946 -13.603
  647   2HG   GLU  79          1HG       GLU  79   1.853  -3.696 -13.734
  648    H    ALA  80           H        ALA  80  -2.841  -2.060 -12.175
  649    HA   ALA  80           HA       ALA  80  -3.764  -2.061 -14.967
  650   1HB   ALA  80          1HB       ALA  80  -4.639  -3.753 -13.428
  651   2HB   ALA  80          2HB       ALA  80  -5.956  -2.711 -13.964
  652   3HB   ALA  80          3HB       ALA  80  -5.258  -2.495 -12.359
  653    H    ARG  81           H        ARG  81  -5.102  -0.472 -12.059
  654    HA   ARG  81           HA       ARG  81  -6.715   1.440 -13.214
  655   1HB   ARG  81          2HB       ARG  81  -6.136   1.102 -10.710
  656   2HB   ARG  81          1HB       ARG  81  -4.835   2.260 -10.995
  657   1HG   ARG  81          2HG       ARG  81  -6.570   3.838 -11.938
  658   2HG   ARG  81          1HG       ARG  81  -7.807   2.708 -11.388
  659   1HD   ARG  81          2HD       ARG  81  -6.638   2.888  -9.076
  660   2HD   ARG  81          1HD       ARG  81  -5.880   4.335  -9.737
  661    HE   ARG  81           HE       ARG  81  -8.793   3.993  -9.243
  662   1HH1  ARG  81          1HH1      ARG  81  -7.948   5.690 -11.669
  663   2HH1  ARG  81          2HH1      ARG  81  -7.967   7.276 -10.970
  664   1HH2  ARG  81          1HH2      ARG  81  -8.010   6.119  -7.700
  665   2HH2  ARG  81          2HH2      ARG  81  -8.000   7.518  -8.722
  666    H    THR  82           H        THR  82  -3.193   1.801 -12.697
  667    HA   THR  82           HA       THR  82  -2.986   4.346 -14.029
  668    HB   THR  82           HB       THR  82  -0.891   2.167 -13.719
  669    HG1  THR  82           HG1      THR  82  -0.913   4.427 -12.125
  670   1HG2  THR  82          1HG2      THR  82  -0.262   3.832 -15.395
  671   2HG2  THR  82          2HG2      THR  82   0.701   4.064 -13.937
  672   3HG2  THR  82          3HG2      THR  82  -0.655   5.138 -14.277
  673    H    GLY  83           H        GLY  83  -2.325   1.022 -15.096
  674   1HA   GLY  83          2HA       GLY  83  -2.832   0.088 -17.238
  675   2HA   GLY  83          1HA       GLY  83  -3.218   1.705 -17.826
  676    H    LYS  84           H        LYS  84  -0.278   1.458 -16.058
  677    HA   LYS  84           HA       LYS  84   1.358   0.970 -18.471
  678   1HB   LYS  84          2HB       LYS  84   0.885   3.422 -18.477
  679   2HB   LYS  84          1HB       LYS  84   1.573   3.535 -16.856
  680   1HG   LYS  84          2HG       LYS  84   3.747   2.911 -17.626
  681   2HG   LYS  84          1HG       LYS  84   3.121   2.394 -19.193
  682   1HD   LYS  84          2HD       LYS  84   4.038   4.511 -19.658
  683   2HD   LYS  84          1HD       LYS  84   2.324   4.858 -19.439
  684   1HE   LYS  84          2HE       LYS  84   2.687   5.632 -17.186
  685   2HE   LYS  84          1HE       LYS  84   4.356   5.062 -17.200
  686   1HZ   LYS  84          1HZ       LYS  84   4.915   7.060 -17.935
  687   2HZ   LYS  84          2HZ       LYS  84   3.292   7.517 -18.149
  688   3HZ   LYS  84          3HZ       LYS  84   4.120   6.705 -19.391
  689    H    LYS  85           H        LYS  85   3.593   0.515 -17.889
  690    HA   LYS  85           HA       LYS  85   3.879  -0.893 -15.414
  691   1HB   LYS  85          2HB       LYS  85   6.402  -0.746 -16.036
  692   2HB   LYS  85          1HB       LYS  85   5.326  -1.622 -17.123
  693   1HG   LYS  85          2HG       LYS  85   5.236   0.204 -18.665
  694   2HG   LYS  85          1HG       LYS  85   5.977   1.309 -17.508
  695   1HD   LYS  85          2HD       LYS  85   8.075   0.030 -17.601
  696   2HD   LYS  85          1HD       LYS  85   7.338  -1.114 -18.724
  697   1HE   LYS  85          2HE       LYS  85   6.822   1.224 -20.013
  698   2HE   LYS  85          1HE       LYS  85   8.337   1.637 -19.209
  699   1HZ   LYS  85          1HZ       LYS  85   9.491   0.082 -20.371
  700   2HZ   LYS  85          2HZ       LYS  85   8.300   0.439 -21.528
  701   3HZ   LYS  85          3HZ       LYS  85   8.160  -0.951 -20.562
  702    H    ALA  86           H        ALA  86   3.551   0.348 -13.582
  703    HA   ALA  86           HA       ALA  86   4.260   3.019 -13.121
  704   1HB   ALA  86          1HB       ALA  86   4.268   0.709 -11.155
  705   2HB   ALA  86          2HB       ALA  86   2.890   1.737 -11.551
  706   3HB   ALA  86          3HB       ALA  86   4.281   2.414 -10.705
  707    H    GLU  87           H        GLU  87   6.296   0.181 -13.160
  708    HA   GLU  87           HA       GLU  87   8.558   1.360 -11.795
  709   1HB   GLU  87          2HB       GLU  87   8.168  -1.040 -13.582
  710   2HB   GLU  87          1HB       GLU  87   9.778  -0.559 -13.054
  711   1HG   GLU  87          2HG       GLU  87   8.819  -2.236 -11.522
  712   2HG   GLU  87          1HG       GLU  87   9.053  -0.695 -10.697
  713    H    GLU  88           H        GLU  88   7.483   1.198 -15.153
  714    HA   GLU  88           HA       GLU  88   8.277   2.237 -17.090
  715   1HB   GLU  88          2HB       GLU  88   9.054   4.165 -14.909
  716   2HB   GLU  88          1HB       GLU  88   9.503   4.485 -16.583
  717   1HG   GLU  88          2HG       GLU  88   6.667   3.868 -15.714
  718   2HG   GLU  88          1HG       GLU  88   7.299   5.507 -15.863
  719    H    LEU  89           H        LEU  89  11.031   3.587 -15.438
  720    HA   LEU  89           HA       LEU  89  12.923   2.475 -17.229
  721   1HB   LEU  89          2HB       LEU  89  13.383   4.454 -15.825
  722   2HB   LEU  89          1HB       LEU  89  13.367   3.437 -14.385
  723    HG   LEU  89           HG       LEU  89  15.243   2.094 -15.400
  724   1HD1  LEU  89          1HD1      LEU  89  15.023   4.288 -17.470
  725   2HD1  LEU  89          2HD1      LEU  89  15.035   2.544 -17.728
  726   3HD1  LEU  89          3HD1      LEU  89  16.510   3.370 -17.235
  727   1HD2  LEU  89          1HD2      LEU  89  16.971   3.755 -14.889
  728   2HD2  LEU  89          2HD2      LEU  89  15.638   3.916 -13.746
  729   3HD2  LEU  89          3HD2      LEU  89  15.801   5.062 -15.077
  730    H    VAL  90           H        VAL  90  12.579   1.579 -13.766
  731    HA   VAL  90           HA       VAL  90  14.007  -0.928 -14.230
  732    HB   VAL  90           HB       VAL  90  13.361  -1.343 -11.797
  733   1HG1  VAL  90          1HG1      VAL  90  14.896   0.442 -10.963
  734   2HG1  VAL  90          2HG1      VAL  90  14.802   1.220 -12.543
  735   3HG1  VAL  90          3HG1      VAL  90  15.523  -0.382 -12.389
  736   1HG2  VAL  90          1HG2      VAL  90  12.282   0.363 -10.556
  737   2HG2  VAL  90          2HG2      VAL  90  11.331   0.249 -12.035
  738   3HG2  VAL  90          3HG2      VAL  90  12.500   1.554 -11.839
  739    H    GLY  91           H        GLY  91  11.654  -0.725 -15.833
  740   1HA   GLY  91          2HA       GLY  91   9.634  -2.460 -14.548
  741   2HA   GLY  91          1HA       GLY  91   9.501  -1.724 -16.146
  742    H    SER  92           H        SER  92   9.310  -4.612 -15.123
  743    HA   SER  92           HA       SER  92  10.866  -5.779 -17.350
  744   1HB   SER  92          2HB       SER  92  11.165  -6.715 -14.478
  745   2HB   SER  92          1HB       SER  92  11.820  -7.545 -15.886
  746    HG   SER  92           HG       SER  92  12.542  -5.008 -16.047
  Start of MODEL    8
    1    HA   MET   1           HA       MET   1 -19.511  -7.315  -0.262
    2   1HB   MET   1          2HB       MET   1 -21.849  -7.474  -1.020
    3   2HB   MET   1          1HB       MET   1 -21.685  -5.948  -1.887
    4   1HG   MET   1          2HG       MET   1 -19.720  -7.082  -3.130
    5   2HG   MET   1          1HG       MET   1 -20.359  -8.595  -2.488
    6   1HE   MET   1          1HE       MET   1 -23.064  -9.594  -4.671
    7   2HE   MET   1          2HE       MET   1 -22.481  -9.660  -3.010
    8   3HE   MET   1          3HE       MET   1 -21.360  -9.940  -4.341
    9    H    GLU   2           H        GLU   2 -20.476  -4.592  -2.328
   10    HA   GLU   2           HA       GLU   2 -19.204  -3.159  -3.664
   11   1HB   GLU   2          2HB       GLU   2 -18.513  -2.279  -1.445
   12   2HB   GLU   2          1HB       GLU   2 -17.178  -3.432  -1.421
   13   1HG   GLU   2          2HG       GLU   2 -16.040  -2.362  -3.158
   14   2HG   GLU   2          1HG       GLU   2 -17.503  -1.600  -3.781
   15    H    LYS   3           H        LYS   3 -18.793  -4.501  -5.428
   16    HA   LYS   3           HA       LYS   3 -16.574  -6.426  -5.348
   17   1HB   LYS   3          2HB       LYS   3 -18.600  -5.586  -7.415
   18   2HB   LYS   3          1HB       LYS   3 -17.201  -6.556  -7.876
   19   1HG   LYS   3          2HG       LYS   3 -17.812  -8.286  -6.269
   20   2HG   LYS   3          1HG       LYS   3 -19.150  -7.302  -5.673
   21   1HD   LYS   3          2HD       LYS   3 -20.227  -8.741  -7.176
   22   2HD   LYS   3          1HD       LYS   3 -19.939  -7.312  -8.169
   23   1HE   LYS   3          2HE       LYS   3 -19.176  -9.064  -9.539
   24   2HE   LYS   3          1HE       LYS   3 -17.692  -8.477  -8.789
   25   1HZ   LYS   3          1HZ       LYS   3 -18.027 -10.947  -8.755
   26   2HZ   LYS   3          2HZ       LYS   3 -19.297 -10.693  -7.654
   27   3HZ   LYS   3          3HZ       LYS   3 -17.712 -10.238  -7.247
   28    H    GLY   4           H        GLY   4 -16.571  -3.183  -5.459
   29   1HA   GLY   4          2HA       GLY   4 -13.946  -2.757  -6.195
   30   2HA   GLY   4          1HA       GLY   4 -14.808  -2.699  -7.734
   31    H    GLY   5           H        GLY   5 -13.595  -0.707  -5.490
   32   1HA   GLY   5          2HA       GLY   5 -15.876   1.218  -5.539
   33   2HA   GLY   5          1HA       GLY   5 -14.501   1.306  -4.439
   34    H    GLU   6           H        GLU   6 -12.303   1.321  -5.850
   35    HA   GLU   6           HA       GLU   6 -12.469   2.842  -8.324
   36   1HB   GLU   6          2HB       GLU   6 -12.582   4.352  -5.992
   37   2HB   GLU   6          1HB       GLU   6 -10.872   4.382  -6.410
   38   1HG   GLU   6          2HG       GLU   6 -11.737   6.212  -7.605
   39   2HG   GLU   6          1HG       GLU   6 -11.692   4.930  -8.816
   40    H    ALA   7           H        ALA   7 -11.440   0.513  -8.205
   41    HA   ALA   7           HA       ALA   7  -9.492  -0.623  -8.805
   42   1HB   ALA   7          1HB       ALA   7  -8.677   1.886  -9.343
   43   2HB   ALA   7          2HB       ALA   7  -7.560   0.521  -9.348
   44   3HB   ALA   7          3HB       ALA   7  -7.660   1.571  -7.937
   45    H    LEU   8           H        LEU   8  -8.118   1.448  -6.244
   46    HA   LEU   8           HA       LEU   8  -8.517  -0.760  -4.309
   47   1HB   LEU   8          2HB       LEU   8  -6.112  -0.237  -3.492
   48   2HB   LEU   8          1HB       LEU   8  -6.283  -1.236  -4.928
   49    HG   LEU   8           HG       LEU   8  -6.100   0.984  -6.255
   50   1HD1  LEU   8          1HD1      LEU   8  -6.327   2.628  -4.564
   51   2HD1  LEU   8          2HD1      LEU   8  -4.603   2.617  -4.930
   52   3HD1  LEU   8          3HD1      LEU   8  -5.203   1.798  -3.489
   53   1HD2  LEU   8          1HD2      LEU   8  -4.144  -0.814  -5.137
   54   2HD2  LEU   8          2HD2      LEU   8  -3.450   0.801  -5.255
   55   3HD2  LEU   8          3HD2      LEU   8  -4.112   0.018  -6.690
   56    H    LYS   9           H        LYS   9  -9.776   1.858  -4.793
   57    HA   LYS   9           HA       LYS   9  -8.737   3.602  -2.655
   58   1HB   LYS   9          2HB       LYS   9  -9.763   4.418  -4.846
   59   2HB   LYS   9          1HB       LYS   9 -11.325   3.925  -4.190
   60   1HG   LYS   9          2HG       LYS   9 -11.291   5.555  -2.521
   61   2HG   LYS   9          1HG       LYS   9  -9.532   5.682  -2.540
   62   1HD   LYS   9          2HD       LYS   9 -10.085   7.630  -3.667
   63   2HD   LYS   9          1HD       LYS   9  -9.963   6.517  -5.029
   64   1HE   LYS   9          2HE       LYS   9 -12.032   7.594  -5.382
   65   2HE   LYS   9          1HE       LYS   9 -12.486   6.070  -4.619
   66   1HZ   LYS   9          1HZ       LYS   9 -12.007   8.542  -3.064
   67   2HZ   LYS   9          2HZ       LYS   9 -12.783   7.117  -2.559
   68   3HZ   LYS   9          3HZ       LYS   9 -13.534   8.144  -3.684
   69    H    GLY  10           H        GLY  10 -10.677   4.503  -1.158
   70   1HA   GLY  10          2HA       GLY  10 -12.324   4.033   0.456
   71   2HA   GLY  10          1HA       GLY  10 -12.671   2.529  -0.398
   72    H    LEU  11           H        LEU  11  -9.492   2.283  -0.096
   73    HA   LEU  11           HA       LEU  11  -9.679   0.914   2.557
   74   1HB   LEU  11          2HB       LEU  11  -7.839   0.405   0.197
   75   2HB   LEU  11          1HB       LEU  11  -7.761  -0.456   1.733
   76    HG   LEU  11           HG       LEU  11 -10.296  -0.343   0.086
   77   1HD1  LEU  11          1HD1      LEU  11  -8.514  -1.340  -1.295
   78   2HD1  LEU  11          2HD1      LEU  11  -9.670  -2.570  -0.785
   79   3HD1  LEU  11          3HD1      LEU  11  -8.105  -2.443   0.019
   80   1HD2  LEU  11          1HD2      LEU  11  -9.259  -2.101   2.332
   81   2HD2  LEU  11          2HD2      LEU  11 -10.705  -2.481   1.395
   82   3HD2  LEU  11          3HD2      LEU  11 -10.650  -1.017   2.377
   83    H    THR  12           H        THR  12  -7.858   1.071   3.967
   84    HA   THR  12           HA       THR  12  -6.298   3.588   3.594
   85    HB   THR  12           HB       THR  12  -7.149   2.025   6.040
   86    HG1  THR  12           HG1      THR  12  -8.654   3.474   5.593
   87   1HG2  THR  12          1HG2      THR  12  -5.010   4.135   5.743
   88   2HG2  THR  12          2HG2      THR  12  -4.922   2.597   6.600
   89   3HG2  THR  12          3HG2      THR  12  -5.879   3.920   7.263
   90    H    PHE  13           H        PHE  13  -4.138   3.392   3.246
   91    HA   PHE  13           HA       PHE  13  -2.869   0.719   3.710
   92   1HB   PHE  13          2HB       PHE  13  -2.486   2.856   1.623
   93   2HB   PHE  13          1HB       PHE  13  -1.124   1.826   2.048
   94    HD1  PHE  13           HD1      PHE  13  -4.548   0.491   2.291
   95    HD2  PHE  13           HD2      PHE  13  -1.088   0.854  -0.228
   96    HE1  PHE  13           HE1      PHE  13  -5.432  -1.294   0.826
   97    HE2  PHE  13           HE2      PHE  13  -1.979  -0.935  -1.696
   98    HZ   PHE  13           HZ       PHE  13  -4.151  -2.007  -1.172
   99    H    VAL  14           H        VAL  14  -1.399   0.694   5.356
  100    HA   VAL  14           HA       VAL  14  -0.263   3.318   6.235
  101    HB   VAL  14           HB       VAL  14  -0.624   0.838   7.932
  102   1HG1  VAL  14          1HG1      VAL  14  -0.176   3.730   8.702
  103   2HG1  VAL  14          2HG1      VAL  14   1.093   2.507   8.645
  104   3HG1  VAL  14          3HG1      VAL  14  -0.236   2.347   9.791
  105   1HG2  VAL  14          1HG2      VAL  14  -2.352   3.268   8.227
  106   2HG2  VAL  14          2HG2      VAL  14  -2.710   1.590   8.627
  107   3HG2  VAL  14          3HG2      VAL  14  -2.745   2.123   6.948
  108    H    ILE  15           H        ILE  15   1.925   3.439   6.674
  109    HA   ILE  15           HA       ILE  15   3.596   1.093   5.842
  110    HB   ILE  15           HB       ILE  15   4.294   4.051   5.784
  111   1HG1  ILE  15          2HG1      ILE  15   4.222   3.188   3.170
  112   2HG1  ILE  15          1HG1      ILE  15   2.865   2.312   3.878
  113   1HG2  ILE  15          1HG2      ILE  15   6.353   3.465   4.991
  114   2HG2  ILE  15          2HG2      ILE  15   5.745   2.040   4.149
  115   3HG2  ILE  15          3HG2      ILE  15   6.029   1.984   5.890
  116   1HD1  ILE  15          1HD1      ILE  15   3.194   5.209   3.404
  117   2HD1  ILE  15          2HD1      ILE  15   2.514   4.792   4.974
  118   3HD1  ILE  15          3HD1      ILE  15   1.722   4.245   3.498
  119    H    THR  16           H        THR  16   4.728   0.199   7.610
  120    HA   THR  16           HA       THR  16   4.620   1.420  10.189
  121    HB   THR  16           HB       THR  16   6.120  -0.872   8.941
  122    HG1  THR  16           HG1      THR  16   4.921  -1.986  10.427
  123   1HG2  THR  16          1HG2      THR  16   7.882  -0.221  10.311
  124   2HG2  THR  16          2HG2      THR  16   6.947  -1.207  11.431
  125   3HG2  THR  16          3HG2      THR  16   6.822   0.550  11.489
  126    H    GLY  17           H        GLY  17   5.389   3.587   9.915
  127   1HA   GLY  17          2HA       GLY  17   7.041   5.262   9.973
  128   2HA   GLY  17          1HA       GLY  17   8.215   3.981  10.307
  129    H    GLU  18           H        GLU  18   8.764   2.592   8.415
  130    HA   GLU  18           HA       GLU  18   8.318   3.606   5.742
  131   1HB   GLU  18          2HB       GLU  18  10.948   3.756   5.440
  132   2HB   GLU  18          1HB       GLU  18  10.042   5.155   6.012
  133   1HG   GLU  18          2HG       GLU  18  10.684   4.793   8.267
  134   2HG   GLU  18          1HG       GLU  18  11.214   3.143   7.939
  135    H    LEU  19           H        LEU  19   7.741   1.562   5.060
  136    HA   LEU  19           HA       LEU  19   8.869  -0.862   5.981
  137   1HB   LEU  19          2HB       LEU  19   7.633  -0.290   3.269
  138   2HB   LEU  19          1HB       LEU  19   7.918  -1.893   3.940
  139    HG   LEU  19           HG       LEU  19   5.978   0.212   4.902
  140   1HD1  LEU  19          1HD1      LEU  19   5.185  -1.360   3.205
  141   2HD1  LEU  19          2HD1      LEU  19   4.406  -1.691   4.753
  142   3HD1  LEU  19          3HD1      LEU  19   5.722  -2.721   4.191
  143   1HD2  LEU  19          1HD2      LEU  19   5.589  -1.647   6.739
  144   2HD2  LEU  19          2HD2      LEU  19   6.825  -0.415   6.977
  145   3HD2  LEU  19          3HD2      LEU  19   7.281  -2.022   6.420
  146    H    SER  20           H        SER  20   9.998  -2.393   4.136
  147    HA   SER  20           HA       SER  20  12.638  -1.296   3.758
  148   1HB   SER  20          2HB       SER  20  12.664  -3.613   3.993
  149   2HB   SER  20          1HB       SER  20  11.251  -3.838   2.969
  150    HG   SER  20           HG       SER  20  13.242  -4.446   1.960
  151    H    ARG  21           H        ARG  21   9.811  -0.836   1.974
  152    HA   ARG  21           HA       ARG  21  11.286  -0.439  -0.589
  153   1HB   ARG  21          2HB       ARG  21   8.568  -1.196   0.119
  154   2HB   ARG  21          1HB       ARG  21   8.570   0.188  -0.973
  155   1HG   ARG  21          2HG       ARG  21  10.342  -1.204  -2.313
  156   2HG   ARG  21          1HG       ARG  21   9.682  -2.571  -1.419
  157   1HD   ARG  21          2HD       ARG  21   7.387  -1.871  -2.204
  158   2HD   ARG  21          1HD       ARG  21   8.173  -0.681  -3.243
  159    HE   ARG  21           HE       ARG  21   8.303  -3.625  -3.582
  160   1HH1  ARG  21          1HH1      ARG  21  10.216  -0.924  -4.194
  161   2HH1  ARG  21          2HH1      ARG  21  10.342  -1.187  -5.901
  162   1HH2  ARG  21          1HH2      ARG  21   8.024  -3.764  -5.946
  163   2HH2  ARG  21          2HH2      ARG  21   9.099  -2.791  -6.892
  164    HA   PRO  22           HA       PRO  22  11.177   3.962  -0.272
  165   1HB   PRO  22          2HB       PRO  22  10.294   4.822  -2.717
  166   2HB   PRO  22          1HB       PRO  22  11.902   4.124  -2.454
  167   1HG   PRO  22          2HG       PRO  22   9.459   2.867  -3.587
  168   2HG   PRO  22          1HG       PRO  22  11.155   2.669  -4.057
  169   1HD   PRO  22          2HD       PRO  22   9.787   0.842  -2.526
  170   2HD   PRO  22          1HD       PRO  22  11.550   1.057  -2.452
  171    H    ARG  23           H        ARG  23   9.163   3.254   1.167
  172    HA   ARG  23           HA       ARG  23   6.505   3.582   0.625
  173   1HB   ARG  23          2HB       ARG  23   6.172   4.284   2.911
  174   2HB   ARG  23          1HB       ARG  23   7.507   3.135   2.875
  175   1HG   ARG  23          2HG       ARG  23   8.654   4.714   4.034
  176   2HG   ARG  23          1HG       ARG  23   8.809   5.532   2.482
  177   1HD   ARG  23          2HD       ARG  23   6.344   6.395   3.212
  178   2HD   ARG  23          1HD       ARG  23   7.078   6.188   4.802
  179    HE   ARG  23           HE       ARG  23   8.473   7.801   2.713
  180   1HH1  ARG  23          1HH2      ARG  23   9.274   7.316   5.685
  181   2HH1  ARG  23          2HH2      ARG  23   8.857   8.855   6.362
  182   1HH2  ARG  23          1HH1      ARG  23   6.962   9.842   3.630
  183   2HH2  ARG  23          2HH1      ARG  23   7.549  10.286   5.198
  184    H    GLU  24           H        GLU  24   8.837   6.122   0.289
  185    HA   GLU  24           HA       GLU  24   6.845   8.281   0.467
  186   1HB   GLU  24          2HB       GLU  24   9.170   8.766   1.082
  187   2HB   GLU  24          1HB       GLU  24   9.724   8.251  -0.509
  188   1HG   GLU  24          2HG       GLU  24   9.565  10.724  -0.339
  189   2HG   GLU  24          1HG       GLU  24   8.476  10.079  -1.566
  190    H    GLU  25           H        GLU  25   8.878   6.894  -2.070
  191    HA   GLU  25           HA       GLU  25   7.666   8.184  -4.297
  192   1HB   GLU  25          2HB       GLU  25   8.970   5.446  -4.182
  193   2HB   GLU  25          1HB       GLU  25   8.628   6.343  -5.659
  194   1HG   GLU  25          2HG       GLU  25  10.365   7.399  -3.407
  195   2HG   GLU  25          1HG       GLU  25  10.997   6.601  -4.847
  196    H    VAL  26           H        VAL  26   7.026   4.873  -3.058
  197    HA   VAL  26           HA       VAL  26   4.866   4.323  -4.818
  198    HB   VAL  26           HB       VAL  26   5.980   2.580  -3.471
  199   1HG1  VAL  26          1HG1      VAL  26   4.469   3.774  -1.125
  200   2HG1  VAL  26          2HG1      VAL  26   6.201   3.967  -1.398
  201   3HG1  VAL  26          3HG1      VAL  26   5.531   2.366  -1.090
  202   1HG2  VAL  26          1HG2      VAL  26   3.582   2.355  -4.331
  203   2HG2  VAL  26          2HG2      VAL  26   3.056   2.740  -2.692
  204   3HG2  VAL  26          3HG2      VAL  26   4.015   1.291  -2.992
  205    H    LYS  27           H        LYS  27   4.886   5.977  -1.660
  206    HA   LYS  27           HA       LYS  27   2.041   6.026  -1.338
  207   1HB   LYS  27          2HB       LYS  27   4.292   7.687  -0.245
  208   2HB   LYS  27          1HB       LYS  27   2.621   8.165   0.053
  209   1HG   LYS  27          2HG       LYS  27   3.654   5.377   0.614
  210   2HG   LYS  27          1HG       LYS  27   3.652   6.656   1.826
  211   1HD   LYS  27          2HD       LYS  27   1.524   6.094   2.306
  212   2HD   LYS  27          1HD       LYS  27   1.072   6.705   0.719
  213   1HE   LYS  27          2HE       LYS  27   0.422   4.261   1.310
  214   2HE   LYS  27          1HE       LYS  27   1.153   4.560  -0.264
  215   1HZ   LYS  27          1HZ       LYS  27   2.941   3.373   0.270
  216   2HZ   LYS  27          2HZ       LYS  27   2.031   2.770   1.571
  217   3HZ   LYS  27          3HZ       LYS  27   3.083   4.083   1.804
  218    H    ALA  28           H        ALA  28   4.231   8.064  -3.194
  219    HA   ALA  28           HA       ALA  28   2.302  10.166  -3.702
  220   1HB   ALA  28          1HB       ALA  28   3.865  10.762  -5.580
  221   2HB   ALA  28          2HB       ALA  28   4.797   9.311  -5.208
  222   3HB   ALA  28          3HB       ALA  28   4.676  10.610  -4.020
  223    H    LEU  29           H        LEU  29   3.132   7.108  -5.208
  224    HA   LEU  29           HA       LEU  29   1.265   7.563  -7.461
  225   1HB   LEU  29          2HB       LEU  29   3.579   6.188  -7.367
  226   2HB   LEU  29          1HB       LEU  29   2.468   4.881  -6.962
  227    HG   LEU  29           HG       LEU  29   1.107   5.508  -8.992
  228   1HD1  LEU  29          1HD1      LEU  29   3.415   7.426  -9.291
  229   2HD1  LEU  29          2HD1      LEU  29   1.689   7.733  -9.487
  230   3HD1  LEU  29          3HD1      LEU  29   2.567   6.823 -10.715
  231   1HD2  LEU  29          1HD2      LEU  29   2.810   3.667  -8.973
  232   2HD2  LEU  29          2HD2      LEU  29   4.008   4.820  -9.563
  233   3HD2  LEU  29          3HD2      LEU  29   2.613   4.408 -10.562
  234    H    LEU  30           H        LEU  30   1.362   6.062  -4.355
  235    HA   LEU  30           HA       LEU  30  -0.938   4.308  -4.794
  236   1HB   LEU  30          2HB       LEU  30   0.826   3.769  -3.130
  237   2HB   LEU  30          1HB       LEU  30   0.379   5.199  -2.209
  238    HG   LEU  30           HG       LEU  30  -0.600   2.928  -1.455
  239   1HD1  LEU  30          1HD1      LEU  30  -2.877   4.767  -1.907
  240   2HD1  LEU  30          2HD1      LEU  30  -1.459   5.487  -1.150
  241   3HD1  LEU  30          3HD1      LEU  30  -2.246   4.098  -0.403
  242   1HD2  LEU  30          1HD2      LEU  30  -2.615   3.490  -3.638
  243   2HD2  LEU  30          2HD2      LEU  30  -2.460   2.048  -2.636
  244   3HD2  LEU  30          3HD2      LEU  30  -1.266   2.383  -3.891
  245    H    ARG  31           H        ARG  31  -0.379   7.364  -3.001
  246    HA   ARG  31           HA       ARG  31  -3.104   7.720  -2.212
  247   1HB   ARG  31          2HB       ARG  31  -0.978   9.009  -1.428
  248   2HB   ARG  31          1HB       ARG  31  -1.260  10.027  -2.841
  249   1HG   ARG  31          2HG       ARG  31  -3.713  10.169  -1.927
  250   2HG   ARG  31          1HG       ARG  31  -2.985   9.662  -0.402
  251   1HD   ARG  31          2HD       ARG  31  -2.059  12.042  -2.038
  252   2HD   ARG  31          1HD       ARG  31  -3.114  12.147  -0.629
  253    HE   ARG  31           HE       ARG  31  -0.623  10.728  -0.081
  254   1HH1  ARG  31          1HH1      ARG  31  -1.939  12.335   1.995
  255   2HH1  ARG  31          2HH1      ARG  31  -0.982  13.778   2.048
  256   1HH2  ARG  31          1HH2      ARG  31   0.515  13.212  -1.028
  257   2HH2  ARG  31          2HH2      ARG  31   0.408  14.272   0.337
  258    H    ARG  32           H        ARG  32  -1.282   8.830  -5.011
  259    HA   ARG  32           HA       ARG  32  -3.248  10.369  -6.340
  260   1HB   ARG  32          2HB       ARG  32  -0.972   8.659  -7.262
  261   2HB   ARG  32          1HB       ARG  32  -2.160   9.141  -8.473
  262   1HG   ARG  32          2HG       ARG  32  -1.851  11.514  -7.806
  263   2HG   ARG  32          1HG       ARG  32  -0.620  11.012  -6.646
  264   1HD   ARG  32          2HD       ARG  32   0.745  10.085  -8.473
  265   2HD   ARG  32          1HD       ARG  32  -0.494  10.544  -9.642
  266    HE   ARG  32           HE       ARG  32   1.316  12.413  -8.219
  267   1HH1  ARG  32          1HH1      ARG  32  -1.509  13.482  -8.508
  268   2HH1  ARG  32          2HH1      ARG  32  -1.404  14.327 -10.016
  269   1HH2  ARG  32          1HH2      ARG  32   1.552  12.788 -10.972
  270   2HH2  ARG  32          2HH2      ARG  32   0.328  13.932 -11.412
  271    H    LEU  33           H        LEU  33  -2.996   6.956  -5.805
  272    HA   LEU  33           HA       LEU  33  -5.266   6.291  -7.591
  273   1HB   LEU  33          2HB       LEU  33  -3.008   4.952  -7.090
  274   2HB   LEU  33          1HB       LEU  33  -3.967   4.321  -5.758
  275    HG   LEU  33           HG       LEU  33  -5.710   3.575  -7.301
  276   1HD1  LEU  33          1HD1      LEU  33  -4.090   5.187  -9.217
  277   2HD1  LEU  33          2HD1      LEU  33  -5.836   4.941  -9.148
  278   3HD1  LEU  33          3HD1      LEU  33  -4.797   3.696  -9.840
  279   1HD2  LEU  33          1HD2      LEU  33  -4.534   1.734  -8.217
  280   2HD2  LEU  33          2HD2      LEU  33  -3.540   2.236  -6.848
  281   3HD2  LEU  33          3HD2      LEU  33  -3.077   2.692  -8.487
  282    H    GLY  34           H        GLY  34  -5.636   7.937  -5.106
  283   1HA   GLY  34          2HA       GLY  34  -7.361   8.065  -3.503
  284   2HA   GLY  34          1HA       GLY  34  -7.910   6.471  -4.032
  285    H    ALA  35           H        ALA  35  -7.628   4.871  -2.564
  286    HA   ALA  35           HA       ALA  35  -7.028   3.962  -0.466
  287   1HB   ALA  35          1HB       ALA  35  -5.571   2.621  -1.588
  288   2HB   ALA  35          2HB       ALA  35  -4.365   3.557  -0.710
  289   3HB   ALA  35          3HB       ALA  35  -4.764   3.974  -2.377
  290    H    LYS  36           H        LYS  36  -7.334   5.475   1.183
  291    HA   LYS  36           HA       LYS  36  -5.842   7.781   1.768
  292   1HB   LYS  36          2HB       LYS  36  -7.108   5.750   3.634
  293   2HB   LYS  36          1HB       LYS  36  -6.442   7.286   4.190
  294   1HG   LYS  36          2HG       LYS  36  -8.000   8.524   2.780
  295   2HG   LYS  36          1HG       LYS  36  -8.604   7.023   2.077
  296   1HD   LYS  36          2HD       LYS  36 -10.216   7.379   3.708
  297   2HD   LYS  36          1HD       LYS  36  -9.063   6.407   4.621
  298   1HE   LYS  36          2HE       LYS  36  -9.556   8.272   6.020
  299   2HE   LYS  36          1HE       LYS  36  -7.977   8.627   5.317
  300   1HZ   LYS  36          1HZ       LYS  36  -8.797  10.422   4.343
  301   2HZ   LYS  36          2HZ       LYS  36 -10.256  10.179   5.180
  302   3HZ   LYS  36          3HZ       LYS  36 -10.052   9.540   3.619
  303    H    VAL  37           H        VAL  37  -3.859   8.137   2.942
  304    HA   VAL  37           HA       VAL  37  -2.228   5.660   3.313
  305    HB   VAL  37           HB       VAL  37  -0.252   7.049   2.825
  306   1HG1  VAL  37          1HG1      VAL  37  -1.320   5.933   0.945
  307   2HG1  VAL  37          2HG1      VAL  37  -0.779   7.530   0.427
  308   3HG1  VAL  37          3HG1      VAL  37  -2.483   7.249   0.779
  309   1HG2  VAL  37          1HG2      VAL  37  -0.980   9.208   3.641
  310   2HG2  VAL  37          2HG2      VAL  37  -2.328   9.240   2.503
  311   3HG2  VAL  37          3HG2      VAL  37  -0.672   9.374   1.912
  312    H    THR  38           H        THR  38  -0.920   5.518   5.171
  313    HA   THR  38           HA       THR  38  -0.834   7.691   7.133
  314    HB   THR  38           HB       THR  38  -1.972   5.180   8.269
  315    HG1  THR  38           HG1      THR  38  -3.295   5.537   6.467
  316   1HG2  THR  38          1HG2      THR  38  -1.913   6.632   9.998
  317   2HG2  THR  38          2HG2      THR  38  -3.324   7.384   9.257
  318   3HG2  THR  38          3HG2      THR  38  -1.714   8.022   8.930
  319    H    ASP  39           H        ASP  39   0.159   6.498   9.308
  320    HA   ASP  39           HA       ASP  39   2.028   4.346   8.514
  321   1HB   ASP  39          2HB       ASP  39   4.027   5.559   9.052
  322   2HB   ASP  39          1HB       ASP  39   3.105   6.580   7.949
  323    H    SER  40           H        SER  40  -0.094   5.495  10.716
  324    HA   SER  40           HA       SER  40   1.275   4.061  12.951
  325   1HB   SER  40          2HB       SER  40  -0.468   6.517  13.285
  326   2HB   SER  40          1HB       SER  40   0.450   5.686  14.538
  327    HG   SER  40           HG       SER  40   2.302   6.450  13.702
  328    H    VAL  41           H        VAL  41  -0.415   3.409  14.660
  329    HA   VAL  41           HA       VAL  41  -3.082   2.891  13.433
  330    HB   VAL  41           HB       VAL  41  -2.990   0.556  14.342
  331   1HG1  VAL  41          1HG1      VAL  41  -2.390   1.219  11.948
  332   2HG1  VAL  41          2HG1      VAL  41  -1.757  -0.330  12.502
  333   3HG1  VAL  41          3HG1      VAL  41  -0.701   1.080  12.435
  334   1HG2  VAL  41          1HG2      VAL  41  -0.061   1.249  14.761
  335   2HG2  VAL  41          2HG2      VAL  41  -0.761  -0.362  14.922
  336   3HG2  VAL  41          3HG2      VAL  41  -1.236   0.918  16.036
  337    H    SER  42           H        SER  42  -4.778   2.749  14.945
  338    HA   SER  42           HA       SER  42  -4.118   2.997  17.826
  339   1HB   SER  42          2HB       SER  42  -5.769   5.023  16.284
  340   2HB   SER  42          1HB       SER  42  -5.643   4.962  18.040
  341    HG   SER  42           HG       SER  42  -3.631   5.673  17.932
  342    H    ARG  43           H        ARG  43  -6.608   2.744  15.308
  343    HA   ARG  43           HA       ARG  43  -7.942   0.540  16.532
  344   1HB   ARG  43          2HB       ARG  43  -8.667   2.138  18.235
  345   2HB   ARG  43          1HB       ARG  43  -9.209   3.264  16.992
  346   1HG   ARG  43          2HG       ARG  43 -10.802   1.448  16.198
  347   2HG   ARG  43          1HG       ARG  43 -10.377   0.549  17.655
  348   1HD   ARG  43          2HD       ARG  43 -12.260   1.725  18.374
  349   2HD   ARG  43          1HD       ARG  43 -10.962   2.809  18.873
  350    HE   ARG  43           HE       ARG  43 -11.984   3.356  16.184
  351   1HH1  ARG  43          1HH1      ARG  43 -13.632   3.438  19.041
  352   2HH1  ARG  43          2HH1      ARG  43 -13.842   5.156  19.107
  353   1HH2  ARG  43          1HH2      ARG  43 -11.667   5.789  16.483
  354   2HH2  ARG  43          2HH2      ARG  43 -12.730   6.487  17.659
  355    H    LYS  44           H        LYS  44  -9.185   3.500  14.982
  356    HA   LYS  44           HA       LYS  44 -10.635   2.006  12.966
  357   1HB   LYS  44          2HB       LYS  44 -11.157   4.201  12.018
  358   2HB   LYS  44          1HB       LYS  44 -11.335   4.258  13.771
  359   1HG   LYS  44          2HG       LYS  44  -8.911   5.104  13.834
  360   2HG   LYS  44          1HG       LYS  44  -9.067   5.349  12.094
  361   1HD   LYS  44          2HD       LYS  44 -11.115   6.742  12.548
  362   2HD   LYS  44          1HD       LYS  44 -10.753   6.618  14.269
  363   1HE   LYS  44          2HE       LYS  44  -8.419   7.524  13.669
  364   2HE   LYS  44          1HE       LYS  44  -9.119   7.957  12.109
  365   1HZ   LYS  44          1HZ       LYS  44  -9.573   9.114  14.731
  366   2HZ   LYS  44          2HZ       LYS  44 -10.959   8.927  13.765
  367   3HZ   LYS  44          3HZ       LYS  44  -9.639   9.837  13.199
  368    H    THR  45           H        THR  45  -7.385   2.508  13.305
  369    HA   THR  45           HA       THR  45  -6.956   2.330  10.348
  370    HB   THR  45           HB       THR  45  -5.132   3.721  12.338
  371    HG1  THR  45           HG1      THR  45  -7.303   4.550  10.891
  372   1HG2  THR  45          1HG2      THR  45  -3.894   2.823  10.462
  373   2HG2  THR  45          2HG2      THR  45  -4.063   4.563  10.224
  374   3HG2  THR  45          3HG2      THR  45  -5.087   3.446   9.320
  375    H    SER  46           H        SER  46  -6.498   0.172  10.133
  376    HA   SER  46           HA       SER  46  -4.080  -0.849  11.481
  377   1HB   SER  46          2HB       SER  46  -6.510  -2.613  11.579
  378   2HB   SER  46          1HB       SER  46  -5.060  -2.661  12.574
  379    HG   SER  46           HG       SER  46  -5.793  -0.598  13.428
  380    H    TYR  47           H        TYR  47  -3.773  -0.376   9.031
  381    HA   TYR  47           HA       TYR  47  -3.984  -2.963   7.607
  382   1HB   TYR  47          2HB       TYR  47  -5.098  -0.337   6.573
  383   2HB   TYR  47          1HB       TYR  47  -4.744  -1.709   5.525
  384    HD1  TYR  47           HD1      TYR  47  -7.068  -0.277   7.908
  385    HD2  TYR  47           HD2      TYR  47  -5.913  -3.915   5.936
  386    HE1  TYR  47           HE1      TYR  47  -9.254  -1.287   8.491
  387    HE2  TYR  47           HE2      TYR  47  -8.101  -4.925   6.520
  388    HH   TYR  47           HH       TYR  47  -9.927  -4.236   8.675
  389    H    LEU  48           H        LEU  48  -1.924  -3.340   6.864
  390    HA   LEU  48           HA       LEU  48  -0.263  -0.937   6.225
  391   1HB   LEU  48          2HB       LEU  48   1.044  -1.787   7.884
  392   2HB   LEU  48          1HB       LEU  48   0.328  -3.388   7.769
  393    HG   LEU  48           HG       LEU  48   2.103  -2.501   5.513
  394   1HD1  LEU  48          1HD1      LEU  48   3.230  -1.868   7.712
  395   2HD1  LEU  48          2HD1      LEU  48   4.113  -3.001   6.692
  396   3HD1  LEU  48          3HD1      LEU  48   3.232  -3.590   8.100
  397   1HD2  LEU  48          1HD2      LEU  48   2.407  -5.136   6.806
  398   2HD2  LEU  48          2HD2      LEU  48   2.184  -4.742   5.103
  399   3HD2  LEU  48          3HD2      LEU  48   0.789  -4.834   6.177
  400    H    VAL  49           H        VAL  49   0.567  -0.808   4.233
  401    HA   VAL  49           HA       VAL  49  -0.083  -2.949   2.302
  402    HB   VAL  49           HB       VAL  49  -0.497  -0.597   1.653
  403   1HG1  VAL  49          1HG1      VAL  49   2.471  -0.122   1.575
  404   2HG1  VAL  49          2HG1      VAL  49   1.577   0.168   3.067
  405   3HG1  VAL  49          3HG1      VAL  49   1.157   1.053   1.602
  406   1HG2  VAL  49          1HG2      VAL  49   0.107  -2.255  -0.086
  407   2HG2  VAL  49          2HG2      VAL  49   1.810  -1.851   0.131
  408   3HG2  VAL  49          3HG2      VAL  49   0.692  -0.645  -0.504
  409    H    VAL  50           H        VAL  50   1.426  -4.551   1.999
  410    HA   VAL  50           HA       VAL  50   3.917  -4.646   3.263
  411    HB   VAL  50           HB       VAL  50   3.097  -5.958   0.653
  412   1HG1  VAL  50          1HG1      VAL  50   4.860  -7.670   1.453
  413   2HG1  VAL  50          2HG1      VAL  50   5.464  -6.371   2.479
  414   3HG1  VAL  50          3HG1      VAL  50   5.453  -6.177   0.727
  415   1HG2  VAL  50          1HG2      VAL  50   3.167  -7.123   3.446
  416   2HG2  VAL  50          2HG2      VAL  50   2.410  -7.808   2.009
  417   3HG2  VAL  50          3HG2      VAL  50   1.722  -6.374   2.768
  418    H    GLY  51           H        GLY  51   6.090  -4.647   2.210
  419   1HA   GLY  51          2HA       GLY  51   6.329  -2.568   0.076
  420   2HA   GLY  51          1HA       GLY  51   7.311  -2.461   1.538
  421    H    GLU  52           H        GLU  52   8.422  -4.737   2.018
  422    HA   GLU  52           HA       GLU  52   9.337  -6.009  -0.499
  423   1HB   GLU  52          2HB       GLU  52  10.793  -3.952   0.486
  424   2HB   GLU  52          1HB       GLU  52  11.496  -5.270   1.415
  425   1HG   GLU  52          2HG       GLU  52  11.140  -5.409  -1.589
  426   2HG   GLU  52          1HG       GLU  52  12.604  -4.777  -0.838
  427    H    ASN  53           H        ASN  53  11.582  -6.813   1.745
  428    HA   ASN  53           HA       ASN  53   9.892  -9.007   2.872
  429   1HB   ASN  53          2HB       ASN  53  12.322  -9.144   1.266
  430   2HB   ASN  53          1HB       ASN  53  12.501  -9.994   2.803
  431   1HD2  ASN  53          1HD2      ASN  53  11.251 -10.286  -0.360
  432   2HD2  ASN  53          2HD2      ASN  53  10.279 -11.655  -0.105
  433    HA   PRO  54           HA       PRO  54  13.059  -8.075   6.263
  434   1HB   PRO  54          2HB       PRO  54  15.276  -6.571   5.753
  435   2HB   PRO  54          1HB       PRO  54  15.193  -8.309   5.420
  436   1HG   PRO  54          2HG       PRO  54  15.106  -6.033   3.558
  437   2HG   PRO  54          1HG       PRO  54  15.656  -7.693   3.295
  438   1HD   PRO  54          2HD       PRO  54  13.165  -6.591   2.503
  439   2HD   PRO  54          1HD       PRO  54  13.636  -8.301   2.457
  440    H    GLY  55           H        GLY  55  11.164  -6.043   4.907
  441   1HA   GLY  55          2HA       GLY  55  12.011  -3.434   5.849
  442   2HA   GLY  55          1HA       GLY  55  10.397  -3.851   5.274
  443    H    SER  56           H        SER  56  10.660  -2.200   7.447
  444    HA   SER  56           HA       SER  56  10.593  -3.586   9.977
  445   1HB   SER  56          2HB       SER  56  11.063  -1.142   9.713
  446   2HB   SER  56          1HB       SER  56   9.383  -0.901   9.243
  447    HG   SER  56           HG       SER  56   9.245  -2.275  11.424
  448    H    LYS  57           H        LYS  57   8.476  -3.600   7.400
  449    HA   LYS  57           HA       LYS  57   5.893  -3.437   8.532
  450   1HB   LYS  57          2HB       LYS  57   5.174  -4.832   6.648
  451   2HB   LYS  57          1HB       LYS  57   6.363  -3.663   6.097
  452   1HG   LYS  57          2HG       LYS  57   8.125  -5.328   6.150
  453   2HG   LYS  57          1HG       LYS  57   7.038  -6.511   6.880
  454   1HD   LYS  57          2HD       LYS  57   5.630  -6.495   4.873
  455   2HD   LYS  57          1HD       LYS  57   6.655  -5.258   4.145
  456   1HE   LYS  57          2HE       LYS  57   7.187  -7.561   3.330
  457   2HE   LYS  57          1HE       LYS  57   8.557  -6.779   4.119
  458   1HZ   LYS  57          1HZ       LYS  57   6.705  -8.513   5.632
  459   2HZ   LYS  57          2HZ       LYS  57   8.300  -8.068   6.016
  460   3HZ   LYS  57          3HZ       LYS  57   8.003  -9.173   4.760
  461    H    LEU  58           H        LEU  58   8.347  -5.853   8.924
  462    HA   LEU  58           HA       LEU  58   6.999  -8.201   9.498
  463   1HB   LEU  58          2HB       LEU  58   9.508  -7.687   9.690
  464   2HB   LEU  58          1HB       LEU  58   9.158  -7.141  11.329
  465    HG   LEU  58           HG       LEU  58   7.976  -9.440  11.614
  466   1HD1  LEU  58          1HD1      LEU  58   9.046 -11.206  10.161
  467   2HD1  LEU  58          2HD1      LEU  58   9.671  -9.909   9.144
  468   3HD1  LEU  58          3HD1      LEU  58   7.930 -10.147   9.303
  469   1HD2  LEU  58          1HD2      LEU  58  10.148  -8.744  12.661
  470   2HD2  LEU  58          2HD2      LEU  58  10.989  -9.383  11.249
  471   3HD2  LEU  58          3HD2      LEU  58  10.077 -10.469  12.298
  472    H    GLU  59           H        GLU  59   6.866  -5.237  11.353
  473    HA   GLU  59           HA       GLU  59   5.734  -6.544  13.721
  474   1HB   GLU  59          2HB       GLU  59   7.075  -4.321  13.639
  475   2HB   GLU  59          1HB       GLU  59   5.556  -3.591  13.124
  476   1HG   GLU  59          2HG       GLU  59   5.812  -5.289  15.621
  477   2HG   GLU  59          1HG       GLU  59   5.975  -3.533  15.627
  478    H    LYS  60           H        LYS  60   4.320  -4.056  11.525
  479    HA   LYS  60           HA       LYS  60   1.654  -4.831  12.387
  480   1HB   LYS  60          2HB       LYS  60   2.275  -2.526  11.564
  481   2HB   LYS  60          1HB       LYS  60   2.369  -3.205   9.937
  482   1HG   LYS  60          2HG       LYS  60   0.064  -3.737   9.893
  483   2HG   LYS  60          1HG       LYS  60  -0.093  -3.595  11.644
  484   1HD   LYS  60          2HD       LYS  60   0.140  -1.204  11.551
  485   2HD   LYS  60          1HD       LYS  60   0.598  -1.257   9.848
  486   1HE   LYS  60          2HE       LYS  60  -1.663  -2.279   9.363
  487   2HE   LYS  60          1HE       LYS  60  -2.103  -1.946  11.038
  488   1HZ   LYS  60          1HZ       LYS  60  -1.041   0.398  10.137
  489   2HZ   LYS  60          2HZ       LYS  60  -2.694   0.054  10.324
  490   3HZ   LYS  60          3HZ       LYS  60  -1.944  -0.161   8.814
  491    H    ALA  61           H        ALA  61   3.710  -5.583   9.608
  492    HA   ALA  61           HA       ALA  61   1.688  -6.892   8.051
  493   1HB   ALA  61          1HB       ALA  61   4.562  -7.761   8.022
  494   2HB   ALA  61          2HB       ALA  61   4.094  -6.191   7.372
  495   3HB   ALA  61          3HB       ALA  61   3.417  -7.665   6.684
  496    H    ARG  62           H        ARG  62   3.952  -8.128  10.573
  497    HA   ARG  62           HA       ARG  62   3.199 -10.874  10.315
  498   1HB   ARG  62          2HB       ARG  62   5.113 -10.168  11.706
  499   2HB   ARG  62          1HB       ARG  62   4.021  -9.315  12.797
  500   1HG   ARG  62          2HG       ARG  62   2.933 -11.419  13.406
  501   2HG   ARG  62          1HG       ARG  62   3.931 -12.298  12.247
  502   1HD   ARG  62          2HD       ARG  62   5.933 -11.247  13.578
  503   2HD   ARG  62          1HD       ARG  62   4.734 -11.031  14.854
  504    HE   ARG  62           HE       ARG  62   5.131 -13.731  13.650
  505   1HH1  ARG  62          1HH2      ARG  62   6.890 -12.275  15.907
  506   2HH1  ARG  62          2HH2      ARG  62   6.323 -13.169  17.279
  507   1HH2  ARG  62          1HH1      ARG  62   3.645 -14.580  15.587
  508   2HH2  ARG  62          2HH1      ARG  62   4.487 -14.474  17.097
  509    H    ALA  63           H        ALA  63   1.831  -8.099  11.995
  510    HA   ALA  63           HA       ALA  63  -0.197  -7.830  13.156
  511   1HB   ALA  63          1HB       ALA  63  -0.592  -8.904  10.483
  512   2HB   ALA  63          2HB       ALA  63  -1.469  -7.621  11.313
  513   3HB   ALA  63          3HB       ALA  63  -1.938  -9.305  11.546
  514    H    LEU  64           H        LEU  64  -0.022  -8.982  15.135
  515    HA   LEU  64           HA       LEU  64  -0.551 -11.855  15.215
  516   1HB   LEU  64          2HB       LEU  64   1.020 -10.843  16.806
  517   2HB   LEU  64          1HB       LEU  64  -0.233  -9.752  17.388
  518    HG   LEU  64           HG       LEU  64  -1.467 -11.539  18.377
  519   1HD1  LEU  64          1HD1      LEU  64   0.367 -13.310  16.751
  520   2HD1  LEU  64          2HD1      LEU  64  -1.397 -13.272  16.751
  521   3HD1  LEU  64          3HD1      LEU  64  -0.529 -13.935  18.135
  522   1HD2  LEU  64          1HD2      LEU  64   0.189 -12.537  19.912
  523   2HD2  LEU  64          2HD2      LEU  64   0.520 -10.825  19.650
  524   3HD2  LEU  64          3HD2      LEU  64   1.490 -12.047  18.827
  525    H    GLY  65           H        GLY  65  -2.625  -9.908  14.147
  526   1HA   GLY  65          2HA       GLY  65  -4.981 -11.089  14.866
  527   2HA   GLY  65          1HA       GLY  65  -4.754  -9.892  16.146
  528    H    VAL  66           H        VAL  66  -3.355  -8.009  14.458
  529    HA   VAL  66           HA       VAL  66  -5.671  -6.662  13.346
  530    HB   VAL  66           HB       VAL  66  -4.020  -4.911  12.653
  531   1HG1  VAL  66          1HG1      VAL  66  -5.054  -5.071  14.964
  532   2HG1  VAL  66          2HG1      VAL  66  -3.523  -4.200  14.893
  533   3HG1  VAL  66          3HG1      VAL  66  -3.567  -5.857  15.494
  534   1HG2  VAL  66          1HG2      VAL  66  -1.971  -5.835  12.184
  535   2HG2  VAL  66          2HG2      VAL  66  -2.160  -7.119  13.377
  536   3HG2  VAL  66          3HG2      VAL  66  -1.685  -5.501  13.891
  537    HA   PRO  67           HA       PRO  67  -5.202  -8.058   9.168
  538   1HB   PRO  67          2HB       PRO  67  -6.613  -6.114   7.869
  539   2HB   PRO  67          1HB       PRO  67  -7.362  -7.345   8.899
  540   1HG   PRO  67          2HG       PRO  67  -7.014  -4.489   9.379
  541   2HG   PRO  67          1HG       PRO  67  -8.097  -5.641  10.167
  542   1HD   PRO  67          2HD       PRO  67  -5.567  -4.621  11.143
  543   2HD   PRO  67          1HD       PRO  67  -6.704  -5.712  11.960
  544    H    THR  68           H        THR  68  -3.825  -7.897   7.441
  545    HA   THR  68           HA       THR  68  -2.405  -5.297   6.947
  546    HB   THR  68           HB       THR  68  -0.376  -6.623   6.447
  547    HG1  THR  68           HG1      THR  68  -1.878  -8.794   7.476
  548   1HG2  THR  68          1HG2      THR  68  -0.123  -7.551   8.875
  549   2HG2  THR  68          2HG2      THR  68  -1.703  -6.819   9.134
  550   3HG2  THR  68          3HG2      THR  68  -0.340  -5.819   8.636
  551    H    LEU  69           H        LEU  69  -2.543  -4.666   4.773
  552    HA   LEU  69           HA       LEU  69  -3.726  -6.626   2.889
  553   1HB   LEU  69          2HB       LEU  69  -3.969  -3.800   3.292
  554   2HB   LEU  69          1HB       LEU  69  -3.300  -4.063   1.684
  555    HG   LEU  69           HG       LEU  69  -5.769  -4.029   1.635
  556   1HD1  LEU  69          1HD1      LEU  69  -4.895  -6.881   1.179
  557   2HD1  LEU  69          2HD1      LEU  69  -4.307  -5.570   0.156
  558   3HD1  LEU  69          3HD1      LEU  69  -6.034  -5.915   0.241
  559   1HD2  LEU  69          1HD2      LEU  69  -5.806  -6.624   3.157
  560   2HD2  LEU  69          2HD2      LEU  69  -7.108  -5.462   2.904
  561   3HD2  LEU  69          3HD2      LEU  69  -5.812  -5.097   4.041
  562    H    THR  70           H        THR  70  -2.380  -7.724   1.568
  563    HA   THR  70           HA       THR  70   0.419  -7.244   1.380
  564    HB   THR  70           HB       THR  70  -1.148  -8.630  -0.787
  565    HG1  THR  70           HG1      THR  70  -0.605  -9.518   1.847
  566   1HG2  THR  70          1HG2      THR  70   0.797  -9.997  -0.969
  567   2HG2  THR  70          2HG2      THR  70   1.429  -9.429   0.576
  568   3HG2  THR  70          3HG2      THR  70   1.394  -8.345  -0.814
  569    H    GLU  71           H        GLU  71   1.653  -6.111  -0.118
  570    HA   GLU  71           HA       GLU  71   0.415  -3.929  -1.540
  571   1HB   GLU  71          2HB       GLU  71   2.834  -4.137  -0.625
  572   2HB   GLU  71          1HB       GLU  71   3.178  -4.989  -2.128
  573   1HG   GLU  71          2HG       GLU  71   2.589  -3.094  -3.454
  574   2HG   GLU  71          1HG       GLU  71   1.836  -2.281  -2.085
  575    H    GLU  72           H        GLU  72   1.061  -7.224  -2.325
  576    HA   GLU  72           HA       GLU  72   1.435  -7.305  -5.072
  577   1HB   GLU  72          2HB       GLU  72   1.030  -9.251  -3.411
  578   2HB   GLU  72          1HB       GLU  72  -0.682  -9.022  -3.768
  579   1HG   GLU  72          2HG       GLU  72   0.053  -9.146  -6.263
  580   2HG   GLU  72          1HG       GLU  72   1.532  -9.869  -5.630
  581    H    GLU  73           H        GLU  73  -1.732  -6.987  -3.436
  582    HA   GLU  73           HA       GLU  73  -3.282  -6.669  -5.807
  583   1HB   GLU  73          2HB       GLU  73  -3.972  -7.018  -3.276
  584   2HB   GLU  73          1HB       GLU  73  -4.030  -5.255  -3.265
  585   1HG   GLU  73          2HG       GLU  73  -6.220  -5.841  -3.881
  586   2HG   GLU  73          1HG       GLU  73  -5.452  -5.523  -5.436
  587    H    LEU  74           H        LEU  74  -1.405  -4.370  -3.900
  588    HA   LEU  74           HA       LEU  74  -2.466  -1.952  -4.972
  589   1HB   LEU  74          2HB       LEU  74  -0.906  -2.040  -3.033
  590   2HB   LEU  74          1HB       LEU  74   0.395  -2.513  -4.122
  591    HG   LEU  74           HG       LEU  74  -1.173  -0.020  -4.716
  592   1HD1  LEU  74          1HD1      LEU  74  -0.588   0.385  -2.433
  593   2HD1  LEU  74          2HD1      LEU  74   0.636   1.210  -3.397
  594   3HD1  LEU  74          3HD1      LEU  74   1.007  -0.339  -2.641
  595   1HD2  LEU  74          1HD2      LEU  74   1.421  -1.271  -5.459
  596   2HD2  LEU  74          2HD2      LEU  74   1.433   0.483  -5.281
  597   3HD2  LEU  74          3HD2      LEU  74   0.333  -0.277  -6.428
  598    H    TYR  75           H        TYR  75   0.366  -3.871  -6.023
  599    HA   TYR  75           HA       TYR  75   0.997  -2.305  -8.312
  600   1HB   TYR  75          2HB       TYR  75   1.389  -5.270  -7.792
  601   2HB   TYR  75          1HB       TYR  75   2.115  -4.397  -9.142
  602    HD1  TYR  75           HD1      TYR  75   3.525  -2.293  -8.566
  603    HD2  TYR  75           HD2      TYR  75   2.472  -5.316  -5.701
  604    HE1  TYR  75           HE1      TYR  75   5.374  -1.542  -7.094
  605    HE2  TYR  75           HE2      TYR  75   4.322  -4.565  -4.230
  606    HH   TYR  75           HH       TYR  75   6.128  -1.645  -4.897
  607    H    ARG  76           H        ARG  76  -1.350  -4.910  -7.845
  608    HA   ARG  76           HA       ARG  76  -1.964  -5.313 -10.616
  609   1HB   ARG  76          2HB       ARG  76  -2.594  -6.836  -8.688
  610   2HB   ARG  76          1HB       ARG  76  -3.866  -5.681  -8.286
  611   1HG   ARG  76          2HG       ARG  76  -4.669  -5.922 -10.697
  612   2HG   ARG  76          1HG       ARG  76  -3.567  -7.293 -10.831
  613   1HD   ARG  76          2HD       ARG  76  -5.790  -7.026  -8.784
  614   2HD   ARG  76          1HD       ARG  76  -5.851  -8.033 -10.229
  615    HE   ARG  76           HE       ARG  76  -4.413  -8.656  -7.766
  616   1HH1  ARG  76          1HH2      ARG  76  -5.794 -10.258 -10.179
  617   2HH1  ARG  76          2HH2      ARG  76  -4.450 -11.258 -10.617
  618   1HH2  ARG  76          1HH1      ARG  76  -2.152  -9.445  -8.755
  619   2HH2  ARG  76          2HH1      ARG  76  -2.387 -10.797  -9.813
  620    H    LEU  77           H        LEU  77  -4.269  -3.895  -8.294
  621    HA   LEU  77           HA       LEU  77  -5.824  -2.554 -10.195
  622   1HB   LEU  77          2HB       LEU  77  -5.316  -1.698  -7.332
  623   2HB   LEU  77          1HB       LEU  77  -6.711  -1.259  -8.317
  624    HG   LEU  77           HG       LEU  77  -6.092  -4.170  -8.048
  625   1HD1  LEU  77          1HD1      LEU  77  -7.284  -4.316  -5.908
  626   2HD1  LEU  77          2HD1      LEU  77  -7.418  -2.562  -5.848
  627   3HD1  LEU  77          3HD1      LEU  77  -5.835  -3.327  -5.738
  628   1HD2  LEU  77          1HD2      LEU  77  -8.742  -3.932  -7.705
  629   2HD2  LEU  77          2HD2      LEU  77  -8.003  -3.899  -9.306
  630   3HD2  LEU  77          3HD2      LEU  77  -8.445  -2.391  -8.509
  631    H    LEU  78           H        LEU  78  -2.710  -1.619  -8.924
  632    HA   LEU  78           HA       LEU  78  -2.997   1.172  -9.813
  633   1HB   LEU  78          2HB       LEU  78  -1.582   0.527  -7.839
  634   2HB   LEU  78          1HB       LEU  78  -0.483  -0.285  -8.954
  635    HG   LEU  78           HG       LEU  78  -1.157   2.478  -9.736
  636   1HD1  LEU  78          1HD1      LEU  78   0.532   1.992  -7.261
  637   2HD1  LEU  78          2HD1      LEU  78  -1.088   2.689  -7.249
  638   3HD1  LEU  78          3HD1      LEU  78   0.233   3.547  -8.038
  639   1HD2  LEU  78          1HD2      LEU  78   1.461   0.997  -9.309
  640   2HD2  LEU  78          2HD2      LEU  78   1.276   2.546 -10.130
  641   3HD2  LEU  78          3HD2      LEU  78   0.580   1.089 -10.833
  642    H    GLU  79           H        GLU  79  -0.609  -1.364 -10.670
  643    HA   GLU  79           HA       GLU  79   0.356  -0.222 -13.024
  644   1HB   GLU  79          2HB       GLU  79   1.068  -2.424 -11.883
  645   2HB   GLU  79          1HB       GLU  79  -0.197  -3.187 -12.847
  646   1HG   GLU  79          2HG       GLU  79   0.849  -2.589 -14.895
  647   2HG   GLU  79          1HG       GLU  79   1.909  -1.421 -14.104
  648    H    ALA  80           H        ALA  80  -2.729  -1.788 -12.494
  649    HA   ALA  80           HA       ALA  80  -3.377  -1.936 -15.358
  650   1HB   ALA  80          1HB       ALA  80  -4.445  -3.562 -13.910
  651   2HB   ALA  80          2HB       ALA  80  -5.697  -2.458 -14.479
  652   3HB   ALA  80          3HB       ALA  80  -5.049  -2.290 -12.846
  653    H    ARG  81           H        ARG  81  -4.930  -0.207 -12.645
  654    HA   ARG  81           HA       ARG  81  -6.403   1.687 -13.999
  655   1HB   ARG  81          2HB       ARG  81  -6.265   1.565 -11.520
  656   2HB   ARG  81          1HB       ARG  81  -4.665   2.305 -11.587
  657   1HG   ARG  81          2HG       ARG  81  -5.531   4.376 -11.855
  658   2HG   ARG  81          1HG       ARG  81  -6.637   3.828 -13.114
  659   1HD   ARG  81          2HD       ARG  81  -7.130   3.278 -10.180
  660   2HD   ARG  81          1HD       ARG  81  -7.727   4.729 -10.984
  661    HE   ARG  81           HE       ARG  81  -8.522   1.951 -11.767
  662   1HH1  ARG  81          1HH2      ARG  81  -8.835   4.621 -13.448
  663   2HH1  ARG  81          2HH2      ARG  81 -10.531   4.889 -13.217
  664   1HH2  ARG  81          1HH1      ARG  81 -10.812   2.600 -10.628
  665   2HH2  ARG  81          2HH1      ARG  81 -11.651   3.742 -11.625
  666    H    THR  82           H        THR  82  -2.911   1.990 -13.247
  667    HA   THR  82           HA       THR  82  -2.552   4.477 -14.652
  668    HB   THR  82           HB       THR  82  -0.132   3.868 -14.637
  669    HG1  THR  82           HG1      THR  82  -1.162   1.427 -13.634
  670   1HG2  THR  82          1HG2      THR  82  -1.016   4.887 -12.632
  671   2HG2  THR  82          2HG2      THR  82   0.074   3.588 -12.148
  672   3HG2  THR  82          3HG2      THR  82  -1.671   3.344 -12.082
  673    H    GLY  83           H        GLY  83  -1.811   1.119 -15.590
  674   1HA   GLY  83          2HA       GLY  83  -2.173   0.125 -17.734
  675   2HA   GLY  83          1HA       GLY  83  -2.564   1.718 -18.381
  676    H    LYS  84           H        LYS  84   0.283   1.600 -16.462
  677    HA   LYS  84           HA       LYS  84   1.995   1.318 -18.891
  678   1HB   LYS  84          2HB       LYS  84   1.583   3.747 -18.293
  679   2HB   LYS  84          1HB       LYS  84   2.389   3.441 -16.756
  680   1HG   LYS  84          2HG       LYS  84   4.254   4.076 -17.918
  681   2HG   LYS  84          1HG       LYS  84   4.226   2.403 -18.474
  682   1HD   LYS  84          2HD       LYS  84   2.792   3.160 -20.413
  683   2HD   LYS  84          1HD       LYS  84   3.088   4.822 -19.901
  684   1HE   LYS  84          2HE       LYS  84   5.564   4.338 -20.059
  685   2HE   LYS  84          1HE       LYS  84   5.150   2.786 -20.788
  686   1HZ   LYS  84          1HZ       LYS  84   5.307   4.020 -22.658
  687   2HZ   LYS  84          2HZ       LYS  84   4.918   5.479 -21.880
  688   3HZ   LYS  84          3HZ       LYS  84   3.690   4.378 -22.292
  689    H    LYS  85           H        LYS  85   3.816   2.389 -16.312
  690    HA   LYS  85           HA       LYS  85   4.359  -0.414 -15.404
  691   1HB   LYS  85          2HB       LYS  85   6.303   1.886 -15.797
  692   2HB   LYS  85          1HB       LYS  85   6.721   0.338 -15.062
  693   1HG   LYS  85          2HG       LYS  85   5.741  -0.699 -17.246
  694   2HG   LYS  85          1HG       LYS  85   5.949   0.919 -17.915
  695   1HD   LYS  85          2HD       LYS  85   8.169  -0.620 -16.540
  696   2HD   LYS  85          1HD       LYS  85   7.921  -0.617 -18.286
  697   1HE   LYS  85          2HE       LYS  85   8.477   1.809 -16.549
  698   2HE   LYS  85          1HE       LYS  85   9.587   1.073 -17.705
  699   1HZ   LYS  85          1HZ       LYS  85   8.680   2.744 -18.953
  700   2HZ   LYS  85          2HZ       LYS  85   7.159   2.648 -18.202
  701   3HZ   LYS  85          3HZ       LYS  85   7.624   1.474 -19.339
  702    H    ALA  86           H        ALA  86   3.771  -0.644 -13.324
  703    HA   ALA  86           HA       ALA  86   2.865   1.284 -11.555
  704   1HB   ALA  86          1HB       ALA  86   3.581  -0.260  -9.700
  705   2HB   ALA  86          2HB       ALA  86   4.453  -1.214 -10.899
  706   3HB   ALA  86          3HB       ALA  86   2.699  -1.069 -10.995
  707    H    GLU  87           H        GLU  87   6.259   0.123 -11.707
  708    HA   GLU  87           HA       GLU  87   7.335   1.895  -9.786
  709   1HB   GLU  87          2HB       GLU  87   8.645   0.869 -12.325
  710   2HB   GLU  87          1HB       GLU  87   9.497   1.565 -10.946
  711   1HG   GLU  87          2HG       GLU  87   8.432  -0.240  -9.513
  712   2HG   GLU  87          1HG       GLU  87   7.880  -0.996 -11.009
  713    H    GLU  88           H        GLU  88   7.044   2.341 -13.317
  714    HA   GLU  88           HA       GLU  88   6.890   4.297 -14.597
  715   1HB   GLU  88          2HB       GLU  88   5.419   4.856 -12.384
  716   2HB   GLU  88          1HB       GLU  88   6.662   6.101 -12.253
  717   1HG   GLU  88          2HG       GLU  88   6.195   6.772 -14.606
  718   2HG   GLU  88          1HG       GLU  88   4.895   5.581 -14.663
  719    H    LEU  89           H        LEU  89   9.257   3.808 -12.222
  720    HA   LEU  89           HA       LEU  89  10.942   5.961 -13.441
  721   1HB   LEU  89          2HB       LEU  89  12.051   6.215 -11.237
  722   2HB   LEU  89          1HB       LEU  89  10.332   6.586 -11.141
  723    HG   LEU  89           HG       LEU  89  10.432   3.843 -10.655
  724   1HD1  LEU  89          1HD1      LEU  89  12.622   3.469 -10.107
  725   2HD1  LEU  89          2HD1      LEU  89  12.128   4.155  -8.560
  726   3HD1  LEU  89          3HD1      LEU  89  12.935   5.169  -9.755
  727   1HD2  LEU  89          1HD2      LEU  89   9.716   4.454  -8.430
  728   2HD2  LEU  89          2HD2      LEU  89   9.065   5.658  -9.542
  729   3HD2  LEU  89          3HD2      LEU  89  10.481   6.037  -8.563
  730    H    VAL  90           H        VAL  90  13.238   5.059 -11.850
  731    HA   VAL  90           HA       VAL  90  14.872   3.367 -11.761
  732    HB   VAL  90           HB       VAL  90  12.596   1.833 -12.203
  733   1HG1  VAL  90          1HG1      VAL  90  14.662   1.019 -14.269
  734   2HG1  VAL  90          2HG1      VAL  90  13.192   1.899 -14.679
  735   3HG1  VAL  90          3HG1      VAL  90  13.084   0.285 -13.980
  736   1HG2  VAL  90          1HG2      VAL  90  15.497   0.978 -11.964
  737   2HG2  VAL  90          2HG2      VAL  90  14.106  -0.062 -11.655
  738   3HG2  VAL  90          3HG2      VAL  90  14.404   1.340 -10.627
  739    H    GLY  91           H        GLY  91  13.299   4.327 -14.743
  740   1HA   GLY  91          2HA       GLY  91  15.203   5.458 -16.173
  741   2HA   GLY  91          1HA       GLY  91  15.805   3.801 -16.258
  742    H    SER  92           H        SER  92  15.440   3.324 -18.383
  743    HA   SER  92           HA       SER  92  12.873   3.985 -19.666
  744   1HB   SER  92          2HB       SER  92  13.930   2.798 -21.637
  745   2HB   SER  92          1HB       SER  92  14.836   4.188 -21.047
  746    HG   SER  92           HG       SER  92  16.038   2.613 -19.759
  Start of MODEL    9
    1    HA   MET   1           HA       MET   1 -20.556  10.048  -7.899
    2   1HB   MET   1          2HB       MET   1 -21.936  10.274 -10.230
    3   2HB   MET   1          1HB       MET   1 -20.818   8.980 -10.661
    4   1HG   MET   1          2HG       MET   1 -21.515   7.966  -8.344
    5   2HG   MET   1          1HG       MET   1 -22.916   9.023  -8.506
    6   1HE   MET   1          1HE       MET   1 -24.530   6.961  -8.452
    7   2HE   MET   1          2HE       MET   1 -23.096   5.968  -8.203
    8   3HE   MET   1          3HE       MET   1 -24.284   5.500  -9.418
    9    H    GLU   2           H        GLU   2 -19.808   7.593  -8.991
   10    HA   GLU   2           HA       GLU   2 -16.841   7.894  -9.072
   11   1HB   GLU   2          2HB       GLU   2 -16.969   5.362  -8.544
   12   2HB   GLU   2          1HB       GLU   2 -17.408   6.489  -7.262
   13   1HG   GLU   2          2HG       GLU   2 -19.724   6.098  -7.547
   14   2HG   GLU   2          1HG       GLU   2 -19.495   5.380  -9.141
   15    H    LYS   3           H        LYS   3 -15.692   7.157 -10.815
   16    HA   LYS   3           HA       LYS   3 -17.195   5.707 -12.962
   17   1HB   LYS   3          2HB       LYS   3 -15.153   7.933 -13.252
   18   2HB   LYS   3          1HB       LYS   3 -15.752   6.960 -14.595
   19   1HG   LYS   3          2HG       LYS   3 -18.057   7.702 -14.112
   20   2HG   LYS   3          1HG       LYS   3 -17.463   8.671 -12.763
   21   1HD   LYS   3          2HD       LYS   3 -17.544  10.270 -14.454
   22   2HD   LYS   3          1HD       LYS   3 -15.877   9.714 -14.595
   23   1HE   LYS   3          2HE       LYS   3 -16.694   8.043 -16.325
   24   2HE   LYS   3          1HE       LYS   3 -18.243   8.883 -16.293
   25   1HZ   LYS   3          1HZ       LYS   3 -17.072   9.893 -18.011
   26   2HZ   LYS   3          2HZ       LYS   3 -15.609   9.908 -17.148
   27   3HZ   LYS   3          3HZ       LYS   3 -16.866  10.966 -16.713
   28    H    GLY   4           H        GLY   4 -14.423   5.917 -10.944
   29   1HA   GLY   4          2HA       GLY   4 -13.432   3.354 -11.956
   30   2HA   GLY   4          1HA       GLY   4 -12.327   4.704 -12.218
   31    H    GLY   5           H        GLY   5 -14.343   4.954  -9.452
   32   1HA   GLY   5          2HA       GLY   5 -12.002   4.738  -7.684
   33   2HA   GLY   5          1HA       GLY   5 -13.623   5.243  -7.204
   34    H    GLU   6           H        GLU   6 -12.368   2.277  -8.763
   35    HA   GLU   6           HA       GLU   6 -13.640   0.716  -6.548
   36   1HB   GLU   6          2HB       GLU   6 -13.369  -0.238  -9.408
   37   2HB   GLU   6          1HB       GLU   6 -14.348  -0.938  -8.119
   38   1HG   GLU   6          2HG       GLU   6 -15.613   1.286  -8.063
   39   2HG   GLU   6          1HG       GLU   6 -14.791   1.676  -9.574
   40    H    ALA   7           H        ALA   7 -10.819   1.400  -8.339
   41    HA   ALA   7           HA       ALA   7  -9.317  -0.903  -8.472
   42   1HB   ALA   7          1HB       ALA   7  -8.573   1.901  -7.679
   43   2HB   ALA   7          2HB       ALA   7  -8.202   1.035  -9.169
   44   3HB   ALA   7          3HB       ALA   7  -7.349   0.631  -7.681
   45    H    LEU   8           H        LEU   8  -8.240   1.028  -5.741
   46    HA   LEU   8           HA       LEU   8  -8.916  -1.189  -3.875
   47   1HB   LEU   8          2HB       LEU   8  -6.574  -0.797  -2.870
   48   2HB   LEU   8          1HB       LEU   8  -6.650  -1.699  -4.380
   49    HG   LEU   8           HG       LEU   8  -6.293   0.567  -5.556
   50   1HD1  LEU   8          1HD1      LEU   8  -6.683   2.156  -3.850
   51   2HD1  LEU   8          2HD1      LEU   8  -4.929   2.125  -4.000
   52   3HD1  LEU   8          3HD1      LEU   8  -5.713   1.265  -2.677
   53   1HD2  LEU   8          1HD2      LEU   8  -3.756   0.381  -4.373
   54   2HD2  LEU   8          2HD2      LEU   8  -4.304  -0.477  -5.811
   55   3HD2  LEU   8          3HD2      LEU   8  -4.435  -1.240  -4.228
   56    H    LYS   9           H        LYS   9 -10.069   1.438  -4.366
   57    HA   LYS   9           HA       LYS   9  -9.174   3.204  -2.206
   58   1HB   LYS   9          2HB       LYS   9 -10.212   3.937  -4.436
   59   2HB   LYS   9          1HB       LYS   9 -11.757   3.411  -3.770
   60   1HG   LYS   9          2HG       LYS   9 -11.685   5.028  -2.033
   61   2HG   LYS   9          1HG       LYS   9  -9.967   5.337  -2.280
   62   1HD   LYS   9          2HD       LYS   9 -10.334   6.729  -4.060
   63   2HD   LYS   9          1HD       LYS   9 -11.718   5.800  -4.633
   64   1HE   LYS   9          2HE       LYS   9 -11.801   7.512  -2.137
   65   2HE   LYS   9          1HE       LYS   9 -12.278   8.105  -3.728
   66   1HZ   LYS   9          1HZ       LYS   9 -13.919   6.856  -2.003
   67   2HZ   LYS   9          2HZ       LYS   9 -13.443   5.568  -3.004
   68   3HZ   LYS   9          3HZ       LYS   9 -14.172   6.946  -3.678
   69    H    GLY  10           H        GLY  10 -11.045   4.016  -0.670
   70   1HA   GLY  10          2HA       GLY  10 -12.764   3.522   0.881
   71   2HA   GLY  10          1HA       GLY  10 -13.015   1.975   0.069
   72    H    LEU  11           H        LEU  11  -9.811   2.008   0.449
   73    HA   LEU  11           HA       LEU  11  -9.924   0.806   3.190
   74   1HB   LEU  11          2HB       LEU  11  -8.281  -0.035   0.782
   75   2HB   LEU  11          1HB       LEU  11  -8.068  -0.691   2.405
   76    HG   LEU  11           HG       LEU  11 -10.690  -0.771   0.881
   77   1HD1  LEU  11          1HD1      LEU  11  -8.599  -2.935   1.277
   78   2HD1  LEU  11          2HD1      LEU  11  -8.980  -2.138  -0.249
   79   3HD1  LEU  11          3HD1      LEU  11 -10.181  -3.167   0.533
   80   1HD2  LEU  11          1HD2      LEU  11 -11.089  -2.606   2.655
   81   2HD2  LEU  11          2HD2      LEU  11 -11.130  -0.935   3.215
   82   3HD2  LEU  11          3HD2      LEU  11  -9.698  -1.925   3.498
   83    H    THR  12           H        THR  12  -7.527   0.638   4.038
   84    HA   THR  12           HA       THR  12  -6.135   3.216   3.449
   85    HB   THR  12           HB       THR  12  -6.791   1.970   6.131
   86    HG1  THR  12           HG1      THR  12  -8.346   3.343   5.226
   87   1HG2  THR  12          1HG2      THR  12  -4.526   2.665   6.366
   88   2HG2  THR  12          2HG2      THR  12  -5.486   3.996   7.013
   89   3HG2  THR  12          3HG2      THR  12  -4.790   4.116   5.398
   90    H    PHE  13           H        PHE  13  -3.902   3.060   3.353
   91    HA   PHE  13           HA       PHE  13  -2.700   0.386   3.959
   92   1HB   PHE  13          2HB       PHE  13  -2.254   2.242   1.620
   93   2HB   PHE  13          1HB       PHE  13  -1.022   1.080   2.105
   94    HD1  PHE  13           HD1      PHE  13  -4.382   1.508   0.669
   95    HD2  PHE  13           HD2      PHE  13  -1.414  -1.340   1.904
   96    HE1  PHE  13           HE1      PHE  13  -5.573  -0.279  -0.573
   97    HE2  PHE  13           HE2      PHE  13  -2.606  -3.124   0.662
   98    HZ   PHE  13           HZ       PHE  13  -4.691  -2.589  -0.578
   99    H    VAL  14           H        VAL  14  -1.168   0.476   5.446
  100    HA   VAL  14           HA       VAL  14   0.209   3.091   5.866
  101    HB   VAL  14           HB       VAL  14   0.188   2.683   8.247
  102   1HG1  VAL  14          1HG1      VAL  14  -2.608   2.197   7.232
  103   2HG1  VAL  14          2HG1      VAL  14  -1.794   3.753   7.078
  104   3HG1  VAL  14          3HG1      VAL  14  -2.127   3.085   8.676
  105   1HG2  VAL  14          1HG2      VAL  14  -1.696   0.538   8.450
  106   2HG2  VAL  14          2HG2      VAL  14  -0.069   0.633   9.119
  107   3HG2  VAL  14          3HG2      VAL  14  -0.316   0.000   7.497
  108    H    ILE  15           H        ILE  15   2.308   2.903   6.919
  109    HA   ILE  15           HA       ILE  15   3.670   0.297   6.327
  110    HB   ILE  15           HB       ILE  15   4.573   3.149   5.843
  111   1HG1  ILE  15          2HG1      ILE  15   5.258   1.699   3.653
  112   2HG1  ILE  15          1HG1      ILE  15   3.868   0.767   4.205
  113   1HG2  ILE  15          1HG2      ILE  15   6.506   2.269   6.817
  114   2HG2  ILE  15          2HG2      ILE  15   6.745   1.897   5.110
  115   3HG2  ILE  15          3HG2      ILE  15   6.188   0.642   6.216
  116   1HD1  ILE  15          1HD1      ILE  15   3.989   3.559   3.171
  117   2HD1  ILE  15          2HD1      ILE  15   2.821   3.225   4.450
  118   3HD1  ILE  15          3HD1      ILE  15   2.751   2.326   2.934
  119    H    THR  16           H        THR  16   4.913  -0.504   8.062
  120    HA   THR  16           HA       THR  16   4.543   0.586  10.651
  121    HB   THR  16           HB       THR  16   6.346  -1.482   9.426
  122    HG1  THR  16           HG1      THR  16   4.465  -2.302  10.033
  123   1HG2  THR  16          1HG2      THR  16   7.005  -1.825  11.995
  124   2HG2  THR  16          2HG2      THR  16   6.790  -0.077  12.031
  125   3HG2  THR  16          3HG2      THR  16   7.961  -0.800  10.930
  126    H    GLY  17           H        GLY  17   5.098   2.831  10.535
  127   1HA   GLY  17          2HA       GLY  17   6.537   4.666  10.797
  128   2HA   GLY  17          1HA       GLY  17   7.779   3.504  11.276
  129    H    GLU  18           H        GLU  18   8.699   2.219   9.402
  130    HA   GLU  18           HA       GLU  18   8.610   3.436   6.762
  131   1HB   GLU  18          2HB       GLU  18  10.203   4.926   8.008
  132   2HB   GLU  18          1HB       GLU  18  11.215   3.515   8.320
  133   1HG   GLU  18          2HG       GLU  18  11.950   3.386   6.153
  134   2HG   GLU  18          1HG       GLU  18  10.420   3.958   5.489
  135    H    LEU  19           H        LEU  19   8.133   1.400   5.954
  136    HA   LEU  19           HA       LEU  19   9.232  -1.069   6.754
  137   1HB   LEU  19          2HB       LEU  19   7.860  -0.053   4.338
  138   2HB   LEU  19          1HB       LEU  19   8.863  -1.466   4.077
  139    HG   LEU  19           HG       LEU  19   7.020  -1.488   6.433
  140   1HD1  LEU  19          1HD1      LEU  19   6.102  -2.175   3.629
  141   2HD1  LEU  19          2HD1      LEU  19   5.721  -0.642   4.413
  142   3HD1  LEU  19          3HD1      LEU  19   5.137  -2.156   5.106
  143   1HD2  LEU  19          1HD2      LEU  19   8.131  -3.489   6.371
  144   2HD2  LEU  19          2HD2      LEU  19   8.486  -3.357   4.650
  145   3HD2  LEU  19          3HD2      LEU  19   6.897  -3.898   5.182
  146    H    SER  20           H        SER  20  10.811  -2.393   5.386
  147    HA   SER  20           HA       SER  20  13.310  -0.971   5.082
  148   1HB   SER  20          2HB       SER  20  12.341  -3.756   4.574
  149   2HB   SER  20          1HB       SER  20  13.868  -3.255   3.861
  150    HG   SER  20           HG       SER  20  14.521  -2.613   5.979
  151    H    ARG  21           H        ARG  21  10.633  -0.902   3.174
  152    HA   ARG  21           HA       ARG  21  12.182  -0.669   0.621
  153   1HB   ARG  21          2HB       ARG  21   9.957  -1.018  -0.474
  154   2HB   ARG  21          1HB       ARG  21  10.407  -2.372   0.553
  155   1HG   ARG  21          2HG       ARG  21   8.402  -2.109   1.559
  156   2HG   ARG  21          1HG       ARG  21   9.070  -0.649   2.285
  157   1HD   ARG  21          2HD       ARG  21   7.027  -0.001   1.210
  158   2HD   ARG  21          1HD       ARG  21   8.340   0.597   0.198
  159    HE   ARG  21           HE       ARG  21   6.703  -1.826  -0.425
  160   1HH1  ARG  21          1HH1      ARG  21   7.101   1.153  -1.643
  161   2HH1  ARG  21          2HH1      ARG  21   7.749   0.689  -3.182
  162   1HH2  ARG  21          1HH2      ARG  21   8.284  -2.610  -2.260
  163   2HH2  ARG  21          2HH2      ARG  21   8.418  -1.441  -3.531
  164    HA   PRO  22           HA       PRO  22  11.242   3.658   0.402
  165   1HB   PRO  22          2HB       PRO  22  10.118   4.008  -2.088
  166   2HB   PRO  22          1HB       PRO  22  11.857   3.769  -1.819
  167   1HG   PRO  22          2HG       PRO  22   9.777   1.769  -2.606
  168   2HG   PRO  22          1HG       PRO  22  11.411   2.011  -3.258
  169   1HD   PRO  22          2HD       PRO  22  10.936   0.046  -1.498
  170   2HD   PRO  22          1HD       PRO  22  12.448   0.974  -1.420
  171    H    ARG  23           H        ARG  23   9.690   4.027   1.908
  172    HA   ARG  23           HA       ARG  23   6.898   3.242   1.461
  173   1HB   ARG  23          2HB       ARG  23   6.521   3.856   3.706
  174   2HB   ARG  23          1HB       ARG  23   8.166   3.228   3.713
  175   1HG   ARG  23          2HG       ARG  23   8.745   5.176   4.706
  176   2HG   ARG  23          1HG       ARG  23   8.532   5.916   3.120
  177   1HD   ARG  23          2HD       ARG  23   6.065   6.186   3.720
  178   2HD   ARG  23          1HD       ARG  23   6.511   5.739   5.367
  179    HE   ARG  23           HE       ARG  23   8.168   7.896   4.361
  180   1HH1  ARG  23          1HH1      ARG  23   4.923   8.067   4.255
  181   2HH1  ARG  23          2HH1      ARG  23   4.710   9.179   5.566
  182   1HH2  ARG  23          1HH2      ARG  23   7.979   8.905   6.682
  183   2HH2  ARG  23          2HH2      ARG  23   6.439   9.653   6.938
  184    H    GLU  24           H        GLU  24   8.874   5.964   0.804
  185    HA   GLU  24           HA       GLU  24   6.692   7.928   0.841
  186   1HB   GLU  24          2HB       GLU  24   9.566   7.992  -0.121
  187   2HB   GLU  24          1HB       GLU  24   8.467   9.360  -0.309
  188   1HG   GLU  24          2HG       GLU  24   8.047   9.223   2.196
  189   2HG   GLU  24          1HG       GLU  24   9.381   8.073   2.276
  190    H    GLU  25           H        GLU  25   8.515   6.046  -1.532
  191    HA   GLU  25           HA       GLU  25   7.329   7.167  -3.884
  192   1HB   GLU  25          2HB       GLU  25   9.390   5.686  -3.785
  193   2HB   GLU  25          1HB       GLU  25   8.303   4.316  -3.562
  194   1HG   GLU  25          2HG       GLU  25   8.846   4.510  -5.929
  195   2HG   GLU  25          1HG       GLU  25   7.152   4.939  -5.697
  196    H    VAL  26           H        VAL  26   6.583   4.065  -2.244
  197    HA   VAL  26           HA       VAL  26   4.262   3.463  -3.756
  198    HB   VAL  26           HB       VAL  26   5.386   1.833  -2.273
  199   1HG1  VAL  26          1HG1      VAL  26   5.707   3.606  -0.424
  200   2HG1  VAL  26          2HG1      VAL  26   5.295   1.971   0.091
  201   3HG1  VAL  26          3HG1      VAL  26   4.053   3.222   0.056
  202   1HG2  VAL  26          1HG2      VAL  26   3.373   0.775  -1.412
  203   2HG2  VAL  26          2HG2      VAL  26   2.979   1.553  -2.944
  204   3HG2  VAL  26          3HG2      VAL  26   2.512   2.313  -1.423
  205    H    LYS  27           H        LYS  27   4.668   5.508  -0.886
  206    HA   LYS  27           HA       LYS  27   1.950   5.822  -0.167
  207   1HB   LYS  27          2HB       LYS  27   4.394   7.535   0.091
  208   2HB   LYS  27          1HB       LYS  27   2.823   8.249   0.456
  209   1HG   LYS  27          2HG       LYS  27   3.573   5.579   1.622
  210   2HG   LYS  27          1HG       LYS  27   4.145   7.069   2.376
  211   1HD   LYS  27          2HD       LYS  27   1.982   7.784   2.907
  212   2HD   LYS  27          1HD       LYS  27   1.234   6.762   1.679
  213   1HE   LYS  27          2HE       LYS  27   1.145   4.960   3.066
  214   2HE   LYS  27          1HE       LYS  27   2.755   5.270   3.715
  215   1HZ   LYS  27          1HZ       LYS  27   0.520   5.639   5.095
  216   2HZ   LYS  27          2HZ       LYS  27   0.717   7.195   4.440
  217   3HZ   LYS  27          3HZ       LYS  27   1.949   6.503   5.384
  218    H    ALA  28           H        ALA  28   3.862   7.689  -2.545
  219    HA   ALA  28           HA       ALA  28   1.677   9.416  -3.290
  220   1HB   ALA  28          1HB       ALA  28   4.051   9.977  -3.727
  221   2HB   ALA  28          2HB       ALA  28   3.094  10.021  -5.207
  222   3HB   ALA  28          3HB       ALA  28   4.144   8.644  -4.878
  223    H    LEU  29           H        LEU  29   2.905   6.341  -4.593
  224    HA   LEU  29           HA       LEU  29   1.101   6.312  -6.855
  225   1HB   LEU  29          2HB       LEU  29   3.159   4.588  -5.685
  226   2HB   LEU  29          1HB       LEU  29   1.804   3.673  -6.335
  227    HG   LEU  29           HG       LEU  29   2.024   4.850  -8.490
  228   1HD1  LEU  29          1HD1      LEU  29   4.105   6.268  -8.810
  229   2HD1  LEU  29          2HD1      LEU  29   4.294   6.258  -7.056
  230   3HD1  LEU  29          3HD1      LEU  29   2.868   6.994  -7.785
  231   1HD2  LEU  29          1HD2      LEU  29   3.390   2.766  -7.912
  232   2HD2  LEU  29          2HD2      LEU  29   4.751   3.849  -7.630
  233   3HD2  LEU  29          3HD2      LEU  29   4.022   3.752  -9.232
  234    H    LEU  30           H        LEU  30   0.930   5.180  -3.533
  235    HA   LEU  30           HA       LEU  30  -1.495   3.606  -3.989
  236   1HB   LEU  30          2HB       LEU  30   0.148   3.034  -2.199
  237   2HB   LEU  30          1HB       LEU  30  -0.259   4.537  -1.378
  238    HG   LEU  30           HG       LEU  30  -1.453   2.400  -0.571
  239   1HD1  LEU  30          1HD1      LEU  30  -3.040   3.770   0.283
  240   2HD1  LEU  30          2HD1      LEU  30  -3.618   4.245  -1.312
  241   3HD1  LEU  30          3HD1      LEU  30  -2.215   5.044  -0.612
  242   1HD2  LEU  30          1HD2      LEU  30  -1.947   1.682  -2.983
  243   2HD2  LEU  30          2HD2      LEU  30  -3.201   2.919  -2.987
  244   3HD2  LEU  30          3HD2      LEU  30  -3.292   1.576  -1.850
  245    H    ARG  31           H        ARG  31  -0.746   6.710  -2.358
  246    HA   ARG  31           HA       ARG  31  -3.452   7.330  -1.681
  247   1HB   ARG  31          2HB       ARG  31  -1.420   8.514  -0.773
  248   2HB   ARG  31          1HB       ARG  31  -1.241   9.305  -2.340
  249   1HG   ARG  31          2HG       ARG  31  -3.675  10.089  -2.034
  250   2HG   ARG  31          1HG       ARG  31  -3.500   9.593  -0.352
  251   1HD   ARG  31          2HD       ARG  31  -2.963  11.960  -0.528
  252   2HD   ARG  31          1HD       ARG  31  -1.484  11.066  -0.177
  253    HE   ARG  31           HE       ARG  31  -1.290  11.170  -2.842
  254   1HH1  ARG  31          1HH1      ARG  31  -0.473  13.388  -0.667
  255   2HH1  ARG  31          2HH1      ARG  31  -0.821  14.800  -1.610
  256   1HH2  ARG  31          1HH2      ARG  31  -2.567  13.067  -4.052
  257   2HH2  ARG  31          2HH2      ARG  31  -2.000  14.618  -3.527
  258    H    ARG  32           H        ARG  32  -1.489   8.149  -4.497
  259    HA   ARG  32           HA       ARG  32  -3.332   9.744  -5.934
  260   1HB   ARG  32          2HB       ARG  32  -1.007   9.249  -6.710
  261   2HB   ARG  32          1HB       ARG  32  -1.513   7.607  -7.107
  262   1HG   ARG  32          2HG       ARG  32  -3.171   8.496  -8.702
  263   2HG   ARG  32          1HG       ARG  32  -2.685  10.142  -8.296
  264   1HD   ARG  32          2HD       ARG  32  -0.275   9.241  -8.927
  265   2HD   ARG  32          1HD       ARG  32  -1.197   8.055  -9.850
  266    HE   ARG  32           HE       ARG  32  -2.360  10.313 -10.729
  267   1HH1  ARG  32          1HH2      ARG  32   0.507   8.855 -11.413
  268   2HH1  ARG  32          2HH2      ARG  32   1.321  10.260 -12.013
  269   1HH2  ARG  32          1HH1      ARG  32  -1.125  12.466 -10.932
  270   2HH2  ARG  32          2HH1      ARG  32   0.397  12.303 -11.743
  271    H    LEU  33           H        LEU  33  -3.241   6.328  -5.308
  272    HA   LEU  33           HA       LEU  33  -5.470   5.699  -7.131
  273   1HB   LEU  33          2HB       LEU  33  -3.333   4.263  -6.353
  274   2HB   LEU  33          1HB       LEU  33  -4.462   3.755  -5.105
  275    HG   LEU  33           HG       LEU  33  -6.072   3.017  -6.775
  276   1HD1  LEU  33          1HD1      LEU  33  -5.985   4.325  -8.662
  277   2HD1  LEU  33          2HD1      LEU  33  -4.945   3.020  -9.228
  278   3HD1  LEU  33          3HD1      LEU  33  -4.231   4.501  -8.590
  279   1HD2  LEU  33          1HD2      LEU  33  -3.493   1.929  -7.846
  280   2HD2  LEU  33          2HD2      LEU  33  -4.956   1.070  -7.369
  281   3HD2  LEU  33          3HD2      LEU  33  -3.856   1.690  -6.139
  282    H    GLY  34           H        GLY  34  -5.832   7.507  -4.697
  283   1HA   GLY  34          2HA       GLY  34  -7.727   7.842  -3.307
  284   2HA   GLY  34          1HA       GLY  34  -8.289   6.224  -3.733
  285    H    ALA  35           H        ALA  35  -8.033   4.650  -2.243
  286    HA   ALA  35           HA       ALA  35  -7.759   4.055   0.092
  287   1HB   ALA  35          1HB       ALA  35  -6.536   2.353  -0.743
  288   2HB   ALA  35          2HB       ALA  35  -5.159   3.232  -0.084
  289   3HB   ALA  35          3HB       ALA  35  -5.589   3.415  -1.784
  290    H    LYS  36           H        LYS  36  -7.666   5.427   1.800
  291    HA   LYS  36           HA       LYS  36  -5.905   7.634   2.128
  292   1HB   LYS  36          2HB       LYS  36  -7.334   5.898   4.159
  293   2HB   LYS  36          1HB       LYS  36  -6.439   7.351   4.599
  294   1HG   LYS  36          2HG       LYS  36  -7.862   8.662   3.021
  295   2HG   LYS  36          1HG       LYS  36  -8.802   7.203   2.704
  296   1HD   LYS  36          2HD       LYS  36  -9.375   7.053   5.106
  297   2HD   LYS  36          1HD       LYS  36  -8.454   8.525   5.413
  298   1HE   LYS  36          2HE       LYS  36  -9.940   9.762   3.860
  299   2HE   LYS  36          1HE       LYS  36 -10.883   8.293   3.608
  300   1HZ   LYS  36          1HZ       LYS  36 -11.961   9.575   5.270
  301   2HZ   LYS  36          2HZ       LYS  36 -10.521   9.783   6.146
  302   3HZ   LYS  36          3HZ       LYS  36 -11.246   8.251   6.051
  303    H    VAL  37           H        VAL  37  -3.986   7.799   3.583
  304    HA   VAL  37           HA       VAL  37  -2.605   5.183   3.974
  305    HB   VAL  37           HB       VAL  37  -0.554   6.093   3.085
  306   1HG1  VAL  37          1HG1      VAL  37  -2.669   6.992   1.134
  307   2HG1  VAL  37          2HG1      VAL  37  -2.446   5.285   1.521
  308   3HG1  VAL  37          3HG1      VAL  37  -1.126   6.205   0.799
  309   1HG2  VAL  37          1HG2      VAL  37  -0.607   8.426   2.065
  310   2HG2  VAL  37          2HG2      VAL  37  -0.655   8.379   3.826
  311   3HG2  VAL  37          3HG2      VAL  37  -2.134   8.673   2.913
  312    H    THR  38           H        THR  38  -0.901   5.236   5.583
  313    HA   THR  38           HA       THR  38  -0.575   7.591   7.288
  314    HB   THR  38           HB       THR  38  -1.457   5.237   8.868
  315    HG1  THR  38           HG1      THR  38  -3.046   5.196   7.317
  316   1HG2  THR  38          1HG2      THR  38  -2.238   8.157   9.026
  317   2HG2  THR  38          2HG2      THR  38  -0.779   7.502   9.770
  318   3HG2  THR  38          3HG2      THR  38  -2.365   6.942  10.299
  319    H    ASP  39           H        ASP  39   0.819   6.721   9.348
  320    HA   ASP  39           HA       ASP  39   2.594   4.499   8.503
  321   1HB   ASP  39          2HB       ASP  39   4.612   5.900   8.923
  322   2HB   ASP  39          1HB       ASP  39   3.659   6.499   7.564
  323    H    SER  40           H        SER  40   0.738   5.837  10.822
  324    HA   SER  40           HA       SER  40   2.435   4.772  13.041
  325   1HB   SER  40          2HB       SER  40   0.314   6.926  13.268
  326   2HB   SER  40          1HB       SER  40   1.442   6.410  14.517
  327    HG   SER  40           HG       SER  40   2.971   7.556  13.604
  328    H    VAL  41           H        VAL  41   1.010   3.947  14.895
  329    HA   VAL  41           HA       VAL  41  -1.589   2.905  13.867
  330    HB   VAL  41           HB       VAL  41  -1.116   0.710  14.810
  331   1HG1  VAL  41          1HG1      VAL  41  -0.224   1.546  12.468
  332   2HG1  VAL  41          2HG1      VAL  41   0.287  -0.021  13.086
  333   3HG1  VAL  41          3HG1      VAL  41   1.358   1.370  13.226
  334   1HG2  VAL  41          1HG2      VAL  41   0.298   1.058  16.655
  335   2HG2  VAL  41          2HG2      VAL  41   1.397   2.093  15.744
  336   3HG2  VAL  41          3HG2      VAL  41   1.397   0.351  15.471
  337    H    SER  42           H        SER  42  -3.220   3.090  15.305
  338    HA   SER  42           HA       SER  42  -2.685   3.137  18.192
  339   1HB   SER  42          2HB       SER  42  -3.889   5.528  16.764
  340   2HB   SER  42          1HB       SER  42  -3.840   5.319  18.512
  341    HG   SER  42           HG       SER  42  -1.881   6.087  16.768
  342    H    ARG  43           H        ARG  43  -4.863   3.042  15.462
  343    HA   ARG  43           HA       ARG  43  -6.674   1.206  16.503
  344   1HB   ARG  43          2HB       ARG  43  -7.041   3.793  17.744
  345   2HB   ARG  43          1HB       ARG  43  -8.455   3.403  16.769
  346   1HG   ARG  43          2HG       ARG  43  -8.848   1.375  17.938
  347   2HG   ARG  43          1HG       ARG  43  -7.243   1.391  18.669
  348   1HD   ARG  43          2HD       ARG  43  -8.965   3.750  19.232
  349   2HD   ARG  43          1HD       ARG  43  -9.454   2.229  19.979
  350    HE   ARG  43           HE       ARG  43  -6.613   2.909  20.312
  351   1HH1  ARG  43          1HH2      ARG  43  -8.674   1.282  22.036
  352   2HH1  ARG  43          2HH2      ARG  43  -8.711   2.277  23.453
  353   1HH2  ARG  43          1HH1      ARG  43  -7.151   4.971  21.922
  354   2HH2  ARG  43          2HH1      ARG  43  -7.844   4.366  23.390
  355    H    LYS  44           H        LYS  44  -6.856   4.390  14.896
  356    HA   LYS  44           HA       LYS  44  -8.848   3.689  12.986
  357   1HB   LYS  44          2HB       LYS  44  -6.584   5.670  12.593
  358   2HB   LYS  44          1HB       LYS  44  -8.140   5.663  11.760
  359   1HG   LYS  44          2HG       LYS  44  -9.142   5.785  14.178
  360   2HG   LYS  44          1HG       LYS  44  -7.534   6.355  14.626
  361   1HD   LYS  44          2HD       LYS  44  -8.083   7.844  12.363
  362   2HD   LYS  44          1HD       LYS  44  -9.663   7.735  13.136
  363   1HE   LYS  44          2HE       LYS  44  -7.114   8.624  14.527
  364   2HE   LYS  44          1HE       LYS  44  -8.364   9.711  13.922
  365   1HZ   LYS  44          1HZ       LYS  44  -8.579   9.186  16.311
  366   2HZ   LYS  44          2HZ       LYS  44  -8.842   7.556  15.907
  367   3HZ   LYS  44          3HZ       LYS  44  -9.946   8.746  15.407
  368    H    THR  45           H        THR  45  -5.463   2.931  13.132
  369    HA   THR  45           HA       THR  45  -5.283   2.191  10.283
  370    HB   THR  45           HB       THR  45  -3.331   3.107  11.598
  371    HG1  THR  45           HG1      THR  45  -3.359   1.370   9.770
  372   1HG2  THR  45          1HG2      THR  45  -3.439   2.151  13.720
  373   2HG2  THR  45          2HG2      THR  45  -2.183   1.175  12.960
  374   3HG2  THR  45          3HG2      THR  45  -3.821   0.549  13.096
  375    H    SER  46           H        SER  46  -4.195  -0.150  10.022
  376    HA   SER  46           HA       SER  46  -4.688  -2.310  11.691
  377   1HB   SER  46          2HB       SER  46  -6.902  -3.116  10.451
  378   2HB   SER  46          1HB       SER  46  -6.974  -2.130  11.906
  379    HG   SER  46           HG       SER  46  -7.667  -0.491  10.755
  380    H    TYR  47           H        TYR  47  -4.583  -1.032   8.461
  381    HA   TYR  47           HA       TYR  47  -3.757  -3.731   7.457
  382   1HB   TYR  47          2HB       TYR  47  -4.661  -1.487   5.664
  383   2HB   TYR  47          1HB       TYR  47  -4.627  -3.216   5.330
  384    HD1  TYR  47           HD1      TYR  47  -6.252  -4.743   6.539
  385    HD2  TYR  47           HD2      TYR  47  -6.564  -0.459   6.670
  386    HE1  TYR  47           HE1      TYR  47  -8.604  -4.936   7.305
  387    HE2  TYR  47           HE2      TYR  47  -8.915  -0.654   7.435
  388    HH   TYR  47           HH       TYR  47 -10.789  -2.649   7.120
  389    H    LEU  48           H        LEU  48  -1.705  -3.902   6.731
  390    HA   LEU  48           HA       LEU  48  -0.155  -1.373   6.283
  391   1HB   LEU  48          2HB       LEU  48   0.813  -2.329   8.221
  392   2HB   LEU  48          1HB       LEU  48   0.627  -3.973   7.616
  393    HG   LEU  48           HG       LEU  48   2.289  -2.229   5.914
  394   1HD1  LEU  48          1HD1      LEU  48   4.237  -2.295   7.389
  395   2HD1  LEU  48          2HD1      LEU  48   3.292  -3.107   8.637
  396   3HD1  LEU  48          3HD1      LEU  48   2.921  -1.440   8.193
  397   1HD2  LEU  48          1HD2      LEU  48   2.689  -4.973   7.147
  398   2HD2  LEU  48          2HD2      LEU  48   3.684  -4.264   5.875
  399   3HD2  LEU  48          3HD2      LEU  48   1.997  -4.661   5.557
  400    H    VAL  49           H        VAL  49   1.133  -1.331   4.417
  401    HA   VAL  49           HA       VAL  49   0.463  -3.335   2.366
  402    HB   VAL  49           HB       VAL  49   0.490  -0.888   1.856
  403   1HG1  VAL  49          1HG1      VAL  49   2.375   0.428   2.011
  404   2HG1  VAL  49          2HG1      VAL  49   3.477  -0.930   1.792
  405   3HG1  VAL  49          3HG1      VAL  49   2.685  -0.678   3.348
  406   1HG2  VAL  49          1HG2      VAL  49   0.754  -2.455   0.025
  407   2HG2  VAL  49          2HG2      VAL  49   2.474  -2.628   0.371
  408   3HG2  VAL  49          3HG2      VAL  49   1.848  -1.098  -0.242
  409    H    VAL  50           H        VAL  50   1.639  -5.212   2.492
  410    HA   VAL  50           HA       VAL  50   4.370  -5.233   3.548
  411    HB   VAL  50           HB       VAL  50   2.764  -7.432   2.203
  412   1HG1  VAL  50          1HG1      VAL  50   4.763  -8.137   4.240
  413   2HG1  VAL  50          2HG1      VAL  50   5.464  -7.379   2.813
  414   3HG1  VAL  50          3HG1      VAL  50   4.489  -8.837   2.647
  415   1HG2  VAL  50          1HG2      VAL  50   1.629  -6.515   4.203
  416   2HG2  VAL  50          2HG2      VAL  50   3.103  -6.747   5.145
  417   3HG2  VAL  50          3HG2      VAL  50   2.233  -8.143   4.511
  418    H    GLY  51           H        GLY  51   5.660  -4.026   2.023
  419   1HA   GLY  51          2HA       GLY  51   5.588  -4.873  -0.798
  420   2HA   GLY  51          1HA       GLY  51   6.520  -3.536  -0.135
  421    H    GLU  52           H        GLU  52   8.317  -4.308   1.469
  422    HA   GLU  52           HA       GLU  52   9.924  -6.252  -0.021
  423   1HB   GLU  52          2HB       GLU  52  10.424  -4.068   1.752
  424   2HB   GLU  52          1HB       GLU  52  11.188  -5.499   2.439
  425   1HG   GLU  52          2HG       GLU  52  11.740  -5.641  -0.315
  426   2HG   GLU  52          1HG       GLU  52  11.967  -3.944   0.108
  427    H    ASN  53           H        ASN  53  11.369  -7.199   2.335
  428    HA   ASN  53           HA       ASN  53   9.362  -9.131   3.435
  429   1HB   ASN  53          2HB       ASN  53  11.906  -9.637   2.034
  430   2HB   ASN  53          1HB       ASN  53  11.733 -10.521   3.551
  431   1HD2  ASN  53          1HD2      ASN  53  10.941 -10.640   0.260
  432   2HD2  ASN  53          2HD2      ASN  53   9.685 -11.776   0.348
  433    HA   PRO  54           HA       PRO  54  12.601  -8.594   6.924
  434   1HB   PRO  54          2HB       PRO  54  14.826  -7.071   6.457
  435   2HB   PRO  54          1HB       PRO  54  14.756  -8.813   6.129
  436   1HG   PRO  54          2HG       PRO  54  14.486  -6.521   4.245
  437   2HG   PRO  54          1HG       PRO  54  15.330  -8.065   4.032
  438   1HD   PRO  54          2HD       PRO  54  12.866  -7.572   2.962
  439   2HD   PRO  54          1HD       PRO  54  13.402  -9.195   3.444
  440    H    GLY  55           H        GLY  55  10.872  -6.415   5.381
  441   1HA   GLY  55          2HA       GLY  55  11.648  -3.870   6.430
  442   2HA   GLY  55          1HA       GLY  55  10.028  -4.290   5.882
  443    H    SER  56           H        SER  56  10.711  -2.698   8.200
  444    HA   SER  56           HA       SER  56  10.518  -4.172  10.641
  445   1HB   SER  56          2HB       SER  56   9.733  -1.341   9.910
  446   2HB   SER  56          1HB       SER  56   9.647  -1.966  11.555
  447    HG   SER  56           HG       SER  56  11.995  -2.229  10.019
  448    H    LYS  57           H        LYS  57   8.305  -3.885   8.150
  449    HA   LYS  57           HA       LYS  57   5.790  -3.551   9.345
  450   1HB   LYS  57          2HB       LYS  57   4.917  -4.998   7.526
  451   2HB   LYS  57          1HB       LYS  57   6.056  -3.797   6.929
  452   1HG   LYS  57          2HG       LYS  57   7.829  -5.427   6.797
  453   2HG   LYS  57          1HG       LYS  57   6.867  -6.625   7.659
  454   1HD   LYS  57          2HD       LYS  57   5.681  -7.202   5.805
  455   2HD   LYS  57          1HD       LYS  57   5.591  -5.542   5.221
  456   1HE   LYS  57          2HE       LYS  57   8.330  -6.491   5.133
  457   2HE   LYS  57          1HE       LYS  57   7.270  -7.590   4.254
  458   1HZ   LYS  57          1HZ       LYS  57   8.115  -4.961   3.559
  459   2HZ   LYS  57          2HZ       LYS  57   6.419  -5.077   3.559
  460   3HZ   LYS  57          3HZ       LYS  57   7.348  -6.131   2.602
  461    H    LEU  58           H        LEU  58   8.053  -6.118   9.797
  462    HA   LEU  58           HA       LEU  58   6.555  -8.371  10.351
  463   1HB   LEU  58          2HB       LEU  58   9.057  -8.074  10.657
  464   2HB   LEU  58          1HB       LEU  58   8.705  -7.353  12.227
  465    HG   LEU  58           HG       LEU  58   7.272  -9.871  11.836
  466   1HD1  LEU  58          1HD1      LEU  58   9.225 -10.468  10.488
  467   2HD1  LEU  58          2HD1      LEU  58   9.293 -11.312  12.037
  468   3HD1  LEU  58          3HD1      LEU  58  10.306  -9.895  11.761
  469   1HD2  LEU  58          1HD2      LEU  58   9.357  -9.054  13.884
  470   2HD2  LEU  58          2HD2      LEU  58   8.124 -10.302  14.063
  471   3HD2  LEU  58          3HD2      LEU  58   7.654  -8.604  13.987
  472    H    GLU  59           H        GLU  59   6.496  -5.352  12.098
  473    HA   GLU  59           HA       GLU  59   5.235  -6.383  14.493
  474   1HB   GLU  59          2HB       GLU  59   6.470  -4.164  14.270
  475   2HB   GLU  59          1HB       GLU  59   5.059  -3.561  13.403
  476   1HG   GLU  59          2HG       GLU  59   4.500  -2.927  15.559
  477   2HG   GLU  59          1HG       GLU  59   3.770  -4.531  15.518
  478    H    LYS  60           H        LYS  60   3.835  -4.314  11.875
  479    HA   LYS  60           HA       LYS  60   1.158  -5.231  12.685
  480   1HB   LYS  60          2HB       LYS  60   1.868  -2.871  11.732
  481   2HB   LYS  60          1HB       LYS  60   1.624  -3.662  10.175
  482   1HG   LYS  60          2HG       LYS  60  -0.552  -3.003  10.504
  483   2HG   LYS  60          1HG       LYS  60  -0.623  -4.488  11.451
  484   1HD   LYS  60          2HD       LYS  60  -0.338  -3.328  13.501
  485   2HD   LYS  60          1HD       LYS  60   0.204  -1.862  12.686
  486   1HE   LYS  60          2HE       LYS  60  -2.578  -3.032  12.417
  487   2HE   LYS  60          1HE       LYS  60  -2.158  -1.708  13.504
  488   1HZ   LYS  60          1HZ       LYS  60  -2.371  -1.735  10.595
  489   2HZ   LYS  60          2HZ       LYS  60  -1.144  -0.769  11.265
  490   3HZ   LYS  60          3HZ       LYS  60  -2.766  -0.511  11.700
  491    H    ALA  61           H        ALA  61   3.489  -5.955  10.156
  492    HA   ALA  61           HA       ALA  61   1.660  -7.284   8.379
  493   1HB   ALA  61          1HB       ALA  61   3.849  -6.663   7.564
  494   2HB   ALA  61          2HB       ALA  61   3.708  -8.418   7.491
  495   3HB   ALA  61          3HB       ALA  61   4.635  -7.661   8.785
  496    H    ARG  62           H        ARG  62   3.501  -8.391  11.241
  497    HA   ARG  62           HA       ARG  62   2.723 -11.169  10.854
  498   1HB   ARG  62          2HB       ARG  62   4.734 -10.457  12.196
  499   2HB   ARG  62          1HB       ARG  62   3.639  -9.759  13.389
  500   1HG   ARG  62          2HG       ARG  62   4.106 -11.906  14.254
  501   2HG   ARG  62          1HG       ARG  62   2.545 -12.110  13.463
  502   1HD   ARG  62          2HD       ARG  62   3.978 -13.963  12.820
  503   2HD   ARG  62          1HD       ARG  62   3.756 -12.920  11.415
  504    HE   ARG  62           HE       ARG  62   6.142 -12.299  13.003
  505   1HH1  ARG  62          1HH2      ARG  62   6.677 -15.056  12.216
  506   2HH1  ARG  62          2HH2      ARG  62   7.319 -14.906  10.613
  507   1HH2  ARG  62          1HH1      ARG  62   6.132 -11.679  10.157
  508   2HH2  ARG  62          2HH1      ARG  62   7.008 -12.993   9.446
  509    H    ALA  63           H        ALA  63   1.623  -8.370  12.712
  510    HA   ALA  63           HA       ALA  63  -0.281  -8.050  14.065
  511   1HB   ALA  63          1HB       ALA  63  -1.152  -9.039  11.375
  512   2HB   ALA  63          2HB       ALA  63  -1.213  -7.407  12.040
  513   3HB   ALA  63          3HB       ALA  63  -2.352  -8.629  12.599
  514    H    LEU  64           H        LEU  64  -0.804  -9.189  15.853
  515    HA   LEU  64           HA       LEU  64  -1.346 -12.076  15.687
  516   1HB   LEU  64          2HB       LEU  64  -0.045 -11.045  17.590
  517   2HB   LEU  64          1HB       LEU  64  -1.534 -10.243  18.097
  518    HG   LEU  64           HG       LEU  64  -2.446 -12.775  17.816
  519   1HD1  LEU  64          1HD1      LEU  64  -0.218 -13.660  17.243
  520   2HD1  LEU  64          2HD1      LEU  64  -0.765 -14.313  18.786
  521   3HD1  LEU  64          3HD1      LEU  64   0.433 -13.019  18.751
  522   1HD2  LEU  64          1HD2      LEU  64  -2.302 -12.936  20.255
  523   2HD2  LEU  64          2HD2      LEU  64  -2.656 -11.269  19.800
  524   3HD2  LEU  64          3HD2      LEU  64  -1.021 -11.723  20.286
  525    H    GLY  65           H        GLY  65  -3.191 -10.505  14.217
  526   1HA   GLY  65          2HA       GLY  65  -5.642 -11.453  14.572
  527   2HA   GLY  65          1HA       GLY  65  -5.604 -10.305  15.914
  528    H    VAL  66           H        VAL  66  -3.701  -8.654  14.193
  529    HA   VAL  66           HA       VAL  66  -5.786  -6.988  13.025
  530    HB   VAL  66           HB       VAL  66  -2.980  -6.334  12.362
  531   1HG1  VAL  66          1HG1      VAL  66  -4.333  -4.508  12.028
  532   2HG1  VAL  66          2HG1      VAL  66  -3.948  -4.225  13.725
  533   3HG1  VAL  66          3HG1      VAL  66  -5.476  -4.987  13.284
  534   1HG2  VAL  66          1HG2      VAL  66  -2.500  -7.325  14.498
  535   2HG2  VAL  66          2HG2      VAL  66  -3.938  -6.609  15.225
  536   3HG2  VAL  66          3HG2      VAL  66  -2.578  -5.585  14.764
  537    HA   PRO  67           HA       PRO  67  -5.469  -8.726   8.940
  538   1HB   PRO  67          2HB       PRO  67  -6.892  -6.829   7.588
  539   2HB   PRO  67          1HB       PRO  67  -7.647  -8.032   8.649
  540   1HG   PRO  67          2HG       PRO  67  -7.122  -5.162   9.121
  541   2HG   PRO  67          1HG       PRO  67  -8.430  -6.189   9.725
  542   1HD   PRO  67          2HD       PRO  67  -6.171  -5.403  11.185
  543   2HD   PRO  67          1HD       PRO  67  -7.264  -6.736  11.609
  544    H    THR  68           H        THR  68  -3.543  -8.620   7.839
  545    HA   THR  68           HA       THR  68  -2.384  -5.938   7.188
  546    HB   THR  68           HB       THR  68  -0.280  -6.988   7.042
  547    HG1  THR  68           HG1      THR  68  -1.783  -9.369   6.749
  548   1HG2  THR  68          1HG2      THR  68  -0.047  -8.165   9.124
  549   2HG2  THR  68          2HG2      THR  68  -1.736  -8.658   9.105
  550   3HG2  THR  68          3HG2      THR  68  -1.314  -6.963   9.349
  551    H    LEU  69           H        LEU  69  -2.221  -5.305   5.001
  552    HA   LEU  69           HA       LEU  69  -3.362  -7.241   3.041
  553   1HB   LEU  69          2HB       LEU  69  -3.814  -4.466   3.517
  554   2HB   LEU  69          1HB       LEU  69  -3.034  -4.612   1.944
  555    HG   LEU  69           HG       LEU  69  -4.755  -6.566   1.576
  556   1HD1  LEU  69          1HD1      LEU  69  -6.119  -4.893   3.711
  557   2HD1  LEU  69          2HD1      LEU  69  -5.601  -6.569   3.890
  558   3HD1  LEU  69          3HD1      LEU  69  -6.890  -6.162   2.758
  559   1HD2  LEU  69          1HD2      LEU  69  -6.453  -4.836   0.802
  560   2HD2  LEU  69          2HD2      LEU  69  -4.812  -4.599   0.203
  561   3HD2  LEU  69          3HD2      LEU  69  -5.417  -3.609   1.531
  562    H    THR  70           H        THR  70  -2.000  -8.148   1.626
  563    HA   THR  70           HA       THR  70   0.809  -7.623   1.601
  564    HB   THR  70           HB       THR  70  -0.676  -8.910  -0.678
  565    HG1  THR  70           HG1      THR  70  -0.550  -9.659   1.980
  566   1HG2  THR  70          1HG2      THR  70   1.299 -10.198  -0.930
  567   2HG2  THR  70          2HG2      THR  70   1.872  -9.786   0.687
  568   3HG2  THR  70          3HG2      THR  70   1.878  -8.569  -0.588
  569    H    GLU  71           H        GLU  71   2.092  -6.454   0.134
  570    HA   GLU  71           HA       GLU  71   0.882  -4.203  -1.199
  571   1HB   GLU  71          2HB       GLU  71   3.278  -4.318  -0.356
  572   2HB   GLU  71          1HB       GLU  71   3.638  -5.334  -1.752
  573   1HG   GLU  71          2HG       GLU  71   3.176  -3.598  -3.286
  574   2HG   GLU  71          1HG       GLU  71   2.287  -2.656  -2.088
  575    H    GLU  72           H        GLU  72   1.448  -7.487  -2.080
  576    HA   GLU  72           HA       GLU  72   1.748  -7.436  -4.860
  577   1HB   GLU  72          2HB       GLU  72   1.640  -9.519  -3.524
  578   2HB   GLU  72          1HB       GLU  72  -0.085  -9.260  -3.264
  579   1HG   GLU  72          2HG       GLU  72  -0.409  -9.313  -5.755
  580   2HG   GLU  72          1HG       GLU  72   1.296  -9.735  -5.923
  581    H    GLU  73           H        GLU  73  -1.369  -7.372  -3.086
  582    HA   GLU  73           HA       GLU  73  -3.023  -6.953  -5.364
  583   1HB   GLU  73          2HB       GLU  73  -3.314  -6.358  -2.425
  584   2HB   GLU  73          1HB       GLU  73  -4.540  -5.797  -3.562
  585   1HG   GLU  73          2HG       GLU  73  -3.609  -8.666  -3.594
  586   2HG   GLU  73          1HG       GLU  73  -4.862  -8.137  -2.472
  587    H    LEU  74           H        LEU  74  -1.102  -4.750  -3.420
  588    HA   LEU  74           HA       LEU  74  -2.217  -2.275  -4.249
  589   1HB   LEU  74          2HB       LEU  74  -0.166  -2.998  -2.603
  590   2HB   LEU  74          1HB       LEU  74   0.740  -2.396  -3.987
  591    HG   LEU  74           HG       LEU  74   0.324  -0.582  -2.392
  592   1HD1  LEU  74          1HD1      LEU  74   0.071  -0.372  -5.031
  593   2HD1  LEU  74          2HD1      LEU  74  -0.268   0.998  -3.976
  594   3HD1  LEU  74          3HD1      LEU  74  -1.595   0.025  -4.611
  595   1HD2  LEU  74          1HD2      LEU  74  -2.590  -0.499  -2.877
  596   2HD2  LEU  74          2HD2      LEU  74  -1.688  -0.205  -1.393
  597   3HD2  LEU  74          3HD2      LEU  74  -2.052  -1.857  -1.891
  598    H    TYR  75           H        TYR  75   0.568  -4.057  -5.633
  599    HA   TYR  75           HA       TYR  75   0.969  -2.346  -7.872
  600   1HB   TYR  75          2HB       TYR  75   1.522  -5.296  -7.463
  601   2HB   TYR  75          1HB       TYR  75   2.018  -4.424  -8.913
  602    HD1  TYR  75           HD1      TYR  75   3.243  -2.083  -8.393
  603    HD2  TYR  75           HD2      TYR  75   3.059  -5.442  -5.723
  604    HE1  TYR  75           HE1      TYR  75   5.254  -1.249  -7.208
  605    HE2  TYR  75           HE2      TYR  75   5.071  -4.611  -4.537
  606    HH   TYR  75           HH       TYR  75   7.164  -2.498  -5.728
  607    H    ARG  76           H        ARG  76  -1.169  -5.148  -7.422
  608    HA   ARG  76           HA       ARG  76  -2.007  -5.497 -10.094
  609   1HB   ARG  76          2HB       ARG  76  -2.552  -7.011  -8.176
  610   2HB   ARG  76          1HB       ARG  76  -3.714  -5.815  -7.608
  611   1HG   ARG  76          2HG       ARG  76  -4.916  -5.982  -9.780
  612   2HG   ARG  76          1HG       ARG  76  -3.783  -7.234 -10.289
  613   1HD   ARG  76          2HD       ARG  76  -4.466  -8.478  -8.136
  614   2HD   ARG  76          1HD       ARG  76  -5.819  -7.350  -8.062
  615    HE   ARG  76           HE       ARG  76  -5.730  -8.488 -10.677
  616   1HH1  ARG  76          1HH1      ARG  76  -5.216 -10.689  -8.464
  617   2HH1  ARG  76          2HH1      ARG  76  -6.813 -11.351  -8.361
  618   1HH2  ARG  76          1HH2      ARG  76  -8.296  -8.732 -10.079
  619   2HH2  ARG  76          2HH2      ARG  76  -8.556 -10.243  -9.272
  620    H    LEU  77           H        LEU  77  -4.295  -4.098  -7.758
  621    HA   LEU  77           HA       LEU  77  -5.909  -2.790  -9.578
  622   1HB   LEU  77          2HB       LEU  77  -5.195  -2.034  -6.741
  623   2HB   LEU  77          1HB       LEU  77  -6.394  -1.140  -7.665
  624    HG   LEU  77           HG       LEU  77  -7.517  -2.837  -6.327
  625   1HD1  LEU  77          1HD1      LEU  77  -8.939  -3.506  -7.986
  626   2HD1  LEU  77          2HD1      LEU  77  -7.639  -4.163  -8.979
  627   3HD1  LEU  77          3HD1      LEU  77  -7.951  -2.428  -8.970
  628   1HD2  LEU  77          1HD2      LEU  77  -5.412  -4.332  -6.300
  629   2HD2  LEU  77          2HD2      LEU  77  -6.004  -4.971  -7.833
  630   3HD2  LEU  77          3HD2      LEU  77  -6.976  -5.140  -6.373
  631    H    LEU  78           H        LEU  78  -2.715  -1.785  -8.588
  632    HA   LEU  78           HA       LEU  78  -3.037   0.955  -9.575
  633   1HB   LEU  78          2HB       LEU  78  -1.409   0.384  -7.775
  634   2HB   LEU  78          1HB       LEU  78  -0.500  -0.584  -8.934
  635    HG   LEU  78           HG       LEU  78  -0.365   1.542 -10.370
  636   1HD1  LEU  78          1HD1      LEU  78  -2.064   2.899  -9.350
  637   2HD1  LEU  78          2HD1      LEU  78  -0.521   3.653  -8.955
  638   3HD1  LEU  78          3HD1      LEU  78  -1.362   2.683  -7.746
  639   1HD2  LEU  78          1HD2      LEU  78   1.543   0.654  -9.082
  640   2HD2  LEU  78          2HD2      LEU  78   0.977   1.508  -7.646
  641   3HD2  LEU  78          3HD2      LEU  78   1.537   2.417  -9.050
  642    H    GLU  79           H        GLU  79  -1.025  -1.803 -10.649
  643    HA   GLU  79           HA       GLU  79  -0.169  -0.794 -13.105
  644   1HB   GLU  79          2HB       GLU  79   0.214  -3.137 -11.906
  645   2HB   GLU  79          1HB       GLU  79  -1.046  -3.654 -13.028
  646   1HG   GLU  79          2HG       GLU  79   0.276  -2.723 -14.913
  647   2HG   GLU  79          1HG       GLU  79   1.545  -2.263 -13.778
  648    H    ALA  80           H        ALA  80  -3.314  -2.282 -12.373
  649    HA   ALA  80           HA       ALA  80  -4.191  -2.175 -15.164
  650   1HB   ALA  80          1HB       ALA  80  -5.645  -2.665 -12.549
  651   2HB   ALA  80          2HB       ALA  80  -5.233  -3.849 -13.790
  652   3HB   ALA  80          3HB       ALA  80  -6.471  -2.633 -14.107
  653    H    ARG  81           H        ARG  81  -5.508  -0.572 -12.268
  654    HA   ARG  81           HA       ARG  81  -7.029   1.427 -13.370
  655   1HB   ARG  81          2HB       ARG  81  -6.545   1.112 -10.907
  656   2HB   ARG  81          1HB       ARG  81  -5.041   1.997 -11.152
  657   1HG   ARG  81          2HG       ARG  81  -7.561   3.247 -12.163
  658   2HG   ARG  81          1HG       ARG  81  -7.297   3.238 -10.421
  659   1HD   ARG  81          2HD       ARG  81  -5.979   5.046 -10.693
  660   2HD   ARG  81          1HD       ARG  81  -4.825   4.003 -11.521
  661    HE   ARG  81           HE       ARG  81  -5.891   4.662 -13.655
  662   1HH1  ARG  81          1HH1      ARG  81  -8.401   5.656 -12.075
  663   2HH1  ARG  81          2HH1      ARG  81  -8.265   7.360 -12.355
  664   1HH2  ARG  81          1HH2      ARG  81  -4.987   7.183 -13.473
  665   2HH2  ARG  81          2HH2      ARG  81  -6.332   8.225 -13.147
  666    H    THR  82           H        THR  82  -3.485   1.648 -12.921
  667    HA   THR  82           HA       THR  82  -3.205   4.181 -14.259
  668    HB   THR  82           HB       THR  82  -1.148   1.963 -13.999
  669    HG1  THR  82           HG1      THR  82  -1.528   2.386 -11.963
  670   1HG2  THR  82          1HG2      THR  82  -0.432   3.662 -15.561
  671   2HG2  THR  82          2HG2      THR  82   0.432   3.925 -14.046
  672   3HG2  THR  82          3HG2      THR  82  -0.941   4.949 -14.468
  673    H    GLY  83           H        GLY  83  -2.652   0.834 -15.348
  674   1HA   GLY  83          2HA       GLY  83  -3.246  -0.030 -17.514
  675   2HA   GLY  83          1HA       GLY  83  -3.437   1.625 -18.096
  676    H    LYS  84           H        LYS  84  -0.612   1.188 -16.256
  677    HA   LYS  84           HA       LYS  84   1.076   0.419 -18.556
  678   1HB   LYS  84          2HB       LYS  84   0.784   2.869 -18.808
  679   2HB   LYS  84          1HB       LYS  84   1.364   3.101 -17.160
  680   1HG   LYS  84          2HG       LYS  84   3.545   2.230 -17.725
  681   2HG   LYS  84          1HG       LYS  84   2.984   1.725 -19.318
  682   1HD   LYS  84          2HD       LYS  84   4.020   3.737 -19.848
  683   2HD   LYS  84          1HD       LYS  84   2.368   4.286 -19.568
  684   1HE   LYS  84          2HE       LYS  84   4.420   4.211 -17.348
  685   2HE   LYS  84          1HE       LYS  84   4.236   5.613 -18.401
  686   1HZ   LYS  84          1HZ       LYS  84   2.738   6.191 -16.840
  687   2HZ   LYS  84          2HZ       LYS  84   2.458   4.591 -16.339
  688   3HZ   LYS  84          3HZ       LYS  84   1.709   5.189 -17.742
  689    H    LYS  85           H        LYS  85   3.384   0.134 -17.825
  690    HA   LYS  85           HA       LYS  85   3.515  -1.285 -15.336
  691   1HB   LYS  85          2HB       LYS  85   5.698  -0.163 -17.123
  692   2HB   LYS  85          1HB       LYS  85   6.011  -1.200 -15.732
  693   1HG   LYS  85          2HG       LYS  85   5.328  -3.073 -16.819
  694   2HG   LYS  85          1HG       LYS  85   3.955  -2.254 -17.560
  695   1HD   LYS  85          2HD       LYS  85   5.396  -2.829 -19.370
  696   2HD   LYS  85          1HD       LYS  85   5.651  -1.106 -19.099
  697   1HE   LYS  85          2HE       LYS  85   7.399  -2.934 -17.538
  698   2HE   LYS  85          1HE       LYS  85   7.681  -2.894 -19.279
  699   1HZ   LYS  85          1HZ       LYS  85   7.605  -0.367 -18.979
  700   2HZ   LYS  85          2HZ       LYS  85   9.002  -1.193 -18.475
  701   3HZ   LYS  85          3HZ       LYS  85   7.852  -0.685 -17.333
  702    H    ALA  86           H        ALA  86   2.856   0.078 -13.626
  703    HA   ALA  86           HA       ALA  86   3.783   2.745 -13.215
  704   1HB   ALA  86          1HB       ALA  86   1.804   1.760 -12.073
  705   2HB   ALA  86          2HB       ALA  86   2.938   2.480 -10.931
  706   3HB   ALA  86          3HB       ALA  86   2.883   0.728 -11.134
  707    H    GLU  87           H        GLU  87   5.126  -0.392 -12.318
  708    HA   GLU  87           HA       GLU  87   7.092   0.580 -10.469
  709   1HB   GLU  87          2HB       GLU  87   7.359  -1.841 -12.271
  710   2HB   GLU  87          1HB       GLU  87   8.137  -1.577 -10.710
  711   1HG   GLU  87          2HG       GLU  87   5.788  -1.441  -9.713
  712   2HG   GLU  87          1HG       GLU  87   5.199  -2.052 -11.260
  713    H    GLU  88           H        GLU  88   7.309  -0.188 -13.955
  714    HA   GLU  88           HA       GLU  88   8.838   0.498 -15.584
  715   1HB   GLU  88          2HB       GLU  88   7.870   2.730 -14.618
  716   2HB   GLU  88          1HB       GLU  88   9.468   2.908 -13.895
  717   1HG   GLU  88          2HG       GLU  88  10.417   2.450 -16.230
  718   2HG   GLU  88          1HG       GLU  88   8.774   2.676 -16.830
  719    H    LEU  89           H        LEU  89  10.497   1.966 -12.801
  720    HA   LEU  89           HA       LEU  89  13.100   1.503 -13.284
  721   1HB   LEU  89          2HB       LEU  89  12.540   2.445 -11.179
  722   2HB   LEU  89          1HB       LEU  89  11.605   1.028 -10.704
  723    HG   LEU  89           HG       LEU  89  13.762  -0.305 -10.769
  724   1HD1  LEU  89          1HD1      LEU  89  14.893   2.490 -11.113
  725   2HD1  LEU  89          2HD1      LEU  89  15.111   1.112 -12.191
  726   3HD1  LEU  89          3HD1      LEU  89  15.855   1.106 -10.592
  727   1HD2  LEU  89          1HD2      LEU  89  14.614   0.671  -8.621
  728   2HD2  LEU  89          2HD2      LEU  89  12.864   0.457  -8.639
  729   3HD2  LEU  89          3HD2      LEU  89  13.558   2.060  -8.877
  730    H    VAL  90           H        VAL  90  10.914  -1.093 -12.171
  731    HA   VAL  90           HA       VAL  90  12.782  -3.154 -11.822
  732    HB   VAL  90           HB       VAL  90  10.928  -4.710 -12.548
  733   1HG1  VAL  90          1HG1      VAL  90  11.181  -3.768 -10.223
  734   2HG1  VAL  90          2HG1      VAL  90   9.526  -4.202 -10.649
  735   3HG1  VAL  90          3HG1      VAL  90  10.028  -2.512 -10.668
  736   1HG2  VAL  90          1HG2      VAL  90   8.677  -3.442 -12.822
  737   2HG2  VAL  90          2HG2      VAL  90   9.747  -3.523 -14.220
  738   3HG2  VAL  90          3HG2      VAL  90   9.672  -2.053 -13.251
  739    H    GLY  91           H        GLY  91  11.064  -2.372 -14.880
  740   1HA   GLY  91          2HA       GLY  91  13.480  -3.223 -16.372
  741   2HA   GLY  91          1HA       GLY  91  11.961  -4.041 -16.743
  742    H    SER  92           H        SER  92  13.842  -1.814 -18.038
  743    HA   SER  92           HA       SER  92  12.069   0.439 -18.450
  744   1HB   SER  92          2HB       SER  92  13.684   0.965 -20.333
  745   2HB   SER  92          1HB       SER  92  14.433   0.784 -18.750
  746    HG   SER  92           HG       SER  92  14.306  -1.110 -20.860
  Start of MODEL   10
    1    HA   MET   1           HA       MET   1 -14.414  12.497 -11.649
    2   1HB   MET   1          2HB       MET   1 -13.519   9.773 -12.652
    3   2HB   MET   1          1HB       MET   1 -14.405  10.955 -13.618
    4   1HG   MET   1          2HG       MET   1 -11.766  11.585 -12.273
    5   2HG   MET   1          1HG       MET   1 -11.878  10.977 -13.924
    6   1HE   MET   1          1HE       MET   1 -10.771  12.938 -15.084
    7   2HE   MET   1          2HE       MET   1 -10.380  13.507 -13.463
    8   3HE   MET   1          3HE       MET   1 -11.039  14.631 -14.648
    9    H    GLU   2           H        GLU   2 -16.181  12.300 -10.048
   10    HA   GLU   2           HA       GLU   2 -18.373  11.643  -9.542
   11   1HB   GLU   2          2HB       GLU   2 -18.331  11.271 -12.150
   12   2HB   GLU   2          1HB       GLU   2 -18.303   9.563 -11.713
   13   1HG   GLU   2          2HG       GLU   2 -20.340   9.856 -10.365
   14   2HG   GLU   2          1HG       GLU   2 -20.364  11.575 -10.760
   15    H    LYS   3           H        LYS   3 -16.820   8.630 -10.716
   16    HA   LYS   3           HA       LYS   3 -17.721   7.242  -8.271
   17   1HB   LYS   3          2HB       LYS   3 -16.698   6.459 -10.948
   18   2HB   LYS   3          1HB       LYS   3 -16.252   5.391  -9.618
   19   1HG   LYS   3          2HG       LYS   3 -18.321   4.533 -10.398
   20   2HG   LYS   3          1HG       LYS   3 -18.741   5.457  -8.956
   21   1HD   LYS   3          2HD       LYS   3 -19.432   7.357 -10.311
   22   2HD   LYS   3          1HD       LYS   3 -18.882   6.553 -11.782
   23   1HE   LYS   3          2HE       LYS   3 -20.528   4.715 -11.327
   24   2HE   LYS   3          1HE       LYS   3 -21.139   5.657  -9.967
   25   1HZ   LYS   3          1HZ       LYS   3 -21.861   7.356 -11.389
   26   2HZ   LYS   3          2HZ       LYS   3 -22.349   5.916 -12.146
   27   3HZ   LYS   3          3HZ       LYS   3 -20.985   6.757 -12.710
   28    H    GLY   4           H        GLY   4 -15.259   9.268  -8.820
   29   1HA   GLY   4          2HA       GLY   4 -13.226   9.635  -7.713
   30   2HA   GLY   4          1HA       GLY   4 -13.681   8.336  -6.608
   31    H    GLY   5           H        GLY   5 -12.848   6.274  -6.950
   32   1HA   GLY   5          2HA       GLY   5 -11.076   5.908  -9.331
   33   2HA   GLY   5          1HA       GLY   5 -10.533   5.455  -7.716
   34    H    GLU   6           H        GLU   6 -10.471   3.227  -7.802
   35    HA   GLU   6           HA       GLU   6 -12.837   1.693  -7.623
   36   1HB   GLU   6          2HB       GLU   6 -13.165   2.156 -10.015
   37   2HB   GLU   6          1HB       GLU   6 -11.523   1.618 -10.366
   38   1HG   GLU   6          2HG       GLU   6 -13.189  -0.149 -10.866
   39   2HG   GLU   6          1HG       GLU   6 -12.082  -0.647  -9.589
   40    H    ALA   7           H        ALA   7  -9.542   1.699  -8.890
   41    HA   ALA   7           HA       ALA   7  -8.436  -0.675  -8.757
   42   1HB   ALA   7          1HB       ALA   7  -6.541   0.314  -7.273
   43   2HB   ALA   7          2HB       ALA   7  -7.510   1.786  -7.306
   44   3HB   ALA   7          3HB       ALA   7  -6.904   1.096  -8.809
   45    H    LEU   8           H        LEU   8  -7.740   0.575  -5.599
   46    HA   LEU   8           HA       LEU   8  -9.161  -1.746  -4.359
   47   1HB   LEU   8          2HB       LEU   8  -7.159  -1.684  -2.695
   48   2HB   LEU   8          1HB       LEU   8  -6.914  -2.434  -4.269
   49    HG   LEU   8           HG       LEU   8  -6.031  -0.206  -5.090
   50   1HD1  LEU   8          1HD1      LEU   8  -6.805   1.409  -3.583
   51   2HD1  LEU   8          2HD1      LEU   8  -5.137   1.189  -3.057
   52   3HD1  LEU   8          3HD1      LEU   8  -6.450   0.407  -2.177
   53   1HD2  LEU   8          1HD2      LEU   8  -4.081  -1.271  -4.725
   54   2HD2  LEU   8          2HD2      LEU   8  -4.801  -2.195  -3.409
   55   3HD2  LEU   8          3HD2      LEU   8  -4.064  -0.627  -3.085
   56    H    LYS   9           H        LYS   9  -9.560   1.284  -4.711
   57    HA   LYS   9           HA       LYS   9  -9.319   2.745  -2.354
   58   1HB   LYS   9          2HB       LYS   9 -10.432   3.267  -4.716
   59   2HB   LYS   9          1HB       LYS   9 -11.915   2.899  -3.837
   60   1HG   LYS   9          2HG       LYS   9 -11.375   4.599  -2.156
   61   2HG   LYS   9          1HG       LYS   9  -9.839   4.926  -2.954
   62   1HD   LYS   9          2HD       LYS   9 -11.227   6.623  -3.795
   63   2HD   LYS   9          1HD       LYS   9 -11.305   5.395  -5.060
   64   1HE   LYS   9          2HE       LYS   9 -13.350   4.502  -3.643
   65   2HE   LYS   9          1HE       LYS   9 -13.377   6.154  -3.026
   66   1HZ   LYS   9          1HZ       LYS   9 -14.779   6.043  -4.929
   67   2HZ   LYS   9          2HZ       LYS   9 -13.572   5.294  -5.859
   68   3HZ   LYS   9          3HZ       LYS   9 -13.392   6.911  -5.372
   69    H    GLY  10           H        GLY  10 -11.246   3.366  -0.889
   70   1HA   GLY  10          2HA       GLY  10 -13.085   2.747   0.499
   71   2HA   GLY  10          1HA       GLY  10 -13.096   1.157  -0.264
   72    H    LEU  11           H        LEU  11 -10.069   1.060   0.203
   73    HA   LEU  11           HA       LEU  11 -10.225   0.278   3.092
   74   1HB   LEU  11          2HB       LEU  11  -8.626  -0.884   0.794
   75   2HB   LEU  11          1HB       LEU  11  -8.335  -1.302   2.483
   76    HG   LEU  11           HG       LEU  11 -11.062  -1.615   2.296
   77   1HD1  LEU  11          1HD1      LEU  11 -10.916  -1.251  -0.172
   78   2HD1  LEU  11          2HD1      LEU  11 -11.521  -2.853   0.246
   79   3HD1  LEU  11          3HD1      LEU  11  -9.851  -2.652  -0.285
   80   1HD2  LEU  11          1HD2      LEU  11  -8.877  -3.662   1.781
   81   2HD2  LEU  11          2HD2      LEU  11 -10.539  -4.054   2.222
   82   3HD2  LEU  11          3HD2      LEU  11  -9.506  -3.184   3.357
   83    H    THR  12           H        THR  12  -8.023   0.298   4.156
   84    HA   THR  12           HA       THR  12  -6.494   2.720   3.290
   85    HB   THR  12           HB       THR  12  -7.200   1.679   6.043
   86    HG1  THR  12           HG1      THR  12  -7.887   3.922   6.180
   87   1HG2  THR  12          1HG2      THR  12  -5.055   3.627   5.187
   88   2HG2  THR  12          2HG2      THR  12  -4.915   2.261   6.293
   89   3HG2  THR  12          3HG2      THR  12  -5.789   3.711   6.788
   90    H    PHE  13           H        PHE  13  -4.251   2.532   3.276
   91    HA   PHE  13           HA       PHE  13  -3.167  -0.211   3.795
   92   1HB   PHE  13          2HB       PHE  13  -2.528   1.893   1.728
   93   2HB   PHE  13          1HB       PHE  13  -1.320   0.694   2.174
   94    HD1  PHE  13           HD1      PHE  13  -5.038   0.644   1.548
   95    HD2  PHE  13           HD2      PHE  13  -1.207  -1.092   0.683
   96    HE1  PHE  13           HE1      PHE  13  -6.122  -1.015   0.057
   97    HE2  PHE  13           HE2      PHE  13  -2.292  -2.753  -0.807
   98    HZ   PHE  13           HZ       PHE  13  -4.756  -2.706  -1.125
   99    H    VAL  14           H        VAL  14  -1.778  -0.291   5.509
  100    HA   VAL  14           HA       VAL  14  -0.440   2.260   6.341
  101    HB   VAL  14           HB       VAL  14  -0.919  -0.006   8.257
  102   1HG1  VAL  14          1HG1      VAL  14   0.491   1.849   8.966
  103   2HG1  VAL  14          2HG1      VAL  14  -1.030   1.888   9.856
  104   3HG1  VAL  14          3HG1      VAL  14  -0.764   3.002   8.518
  105   1HG2  VAL  14          1HG2      VAL  14  -3.116   0.407   7.216
  106   2HG2  VAL  14          2HG2      VAL  14  -2.936   2.136   7.512
  107   3HG2  VAL  14          3HG2      VAL  14  -3.089   1.020   8.868
  108    H    ILE  15           H        ILE  15   1.691   2.099   7.129
  109    HA   ILE  15           HA       ILE  15   3.119  -0.441   6.432
  110    HB   ILE  15           HB       ILE  15   5.048   1.411   6.103
  111   1HG1  ILE  15          2HG1      ILE  15   2.443   2.804   5.394
  112   2HG1  ILE  15          1HG1      ILE  15   3.591   3.309   6.632
  113   1HG2  ILE  15          1HG2      ILE  15   3.079   1.054   3.864
  114   2HG2  ILE  15          2HG2      ILE  15   3.936  -0.347   4.504
  115   3HG2  ILE  15          3HG2      ILE  15   4.840   1.000   3.814
  116   1HD1  ILE  15          1HD1      ILE  15   5.322   3.565   4.842
  117   2HD1  ILE  15          2HD1      ILE  15   3.946   4.648   4.642
  118   3HD1  ILE  15          3HD1      ILE  15   4.080   3.201   3.645
  119    H    THR  16           H        THR  16   4.536  -1.193   8.065
  120    HA   THR  16           HA       THR  16   4.259  -0.139  10.683
  121    HB   THR  16           HB       THR  16   6.178  -2.023   9.348
  122    HG1  THR  16           HG1      THR  16   4.123  -2.786   9.816
  123   1HG2  THR  16          1HG2      THR  16   7.663  -1.345  10.962
  124   2HG2  THR  16          2HG2      THR  16   6.733  -2.494  11.922
  125   3HG2  THR  16          3HG2      THR  16   6.390  -0.769  12.040
  126    H    GLY  17           H        GLY  17   4.799   2.117  10.658
  127   1HA   GLY  17          2HA       GLY  17   6.241   3.994  10.409
  128   2HA   GLY  17          1HA       GLY  17   7.288   2.976  11.408
  129    H    GLU  18           H        GLU  18   6.187   2.421   8.075
  130    HA   GLU  18           HA       GLU  18   7.326   2.250   6.092
  131   1HB   GLU  18          2HB       GLU  18   9.669   3.526   7.535
  132   2HB   GLU  18          1HB       GLU  18   9.489   3.345   5.793
  133   1HG   GLU  18          2HG       GLU  18   8.460   5.347   5.767
  134   2HG   GLU  18          1HG       GLU  18   7.118   4.596   6.630
  135    H    LEU  19           H        LEU  19   7.617   0.160   5.656
  136    HA   LEU  19           HA       LEU  19   9.056  -1.677   7.303
  137   1HB   LEU  19          2HB       LEU  19   8.368  -1.829   4.338
  138   2HB   LEU  19          1HB       LEU  19   9.029  -3.164   5.276
  139    HG   LEU  19           HG       LEU  19   7.066  -3.032   6.812
  140   1HD1  LEU  19          1HD1      LEU  19   6.314  -0.822   4.908
  141   2HD1  LEU  19          2HD1      LEU  19   6.262  -0.828   6.670
  142   3HD1  LEU  19          3HD1      LEU  19   5.066  -1.737   5.750
  143   1HD2  LEU  19          1HD2      LEU  19   6.558  -3.416   3.848
  144   2HD2  LEU  19          2HD2      LEU  19   5.375  -3.840   5.085
  145   3HD2  LEU  19          3HD2      LEU  19   6.937  -4.655   5.043
  146    H    SER  20           H        SER  20  11.067  -2.931   6.092
  147    HA   SER  20           HA       SER  20  13.172  -0.934   5.833
  148   1HB   SER  20          2HB       SER  20  13.577  -3.188   6.813
  149   2HB   SER  20          1HB       SER  20  13.263  -3.910   5.236
  150    HG   SER  20           HG       SER  20  15.538  -3.006   6.134
  151    H    ARG  21           H        ARG  21  11.589  -0.072   3.974
  152    HA   ARG  21           HA       ARG  21  12.976  -0.632   1.429
  153   1HB   ARG  21          2HB       ARG  21  10.315  -1.697   2.081
  154   2HB   ARG  21          1HB       ARG  21  10.337  -0.766   0.587
  155   1HG   ARG  21          2HG       ARG  21  12.379  -2.131  -0.095
  156   2HG   ARG  21          1HG       ARG  21  12.035  -3.171   1.287
  157   1HD   ARG  21          2HD       ARG  21   9.833  -3.700   0.407
  158   2HD   ARG  21          1HD       ARG  21  10.048  -2.554  -0.916
  159    HE   ARG  21           HE       ARG  21  11.663  -5.057  -0.622
  160   1HH1  ARG  21          1HH1      ARG  21  12.049  -2.422  -2.434
  161   2HH1  ARG  21          2HH1      ARG  21  11.669  -3.126  -3.971
  162   1HH2  ARG  21          1HH2      ARG  21  10.362  -6.036  -2.614
  163   2HH2  ARG  21          2HH2      ARG  21  10.715  -5.172  -4.073
  164    HA   PRO  22           HA       PRO  22  11.911   3.569   0.492
  165   1HB   PRO  22          2HB       PRO  22  10.995   3.535  -2.091
  166   2HB   PRO  22          1HB       PRO  22  12.699   3.309  -1.659
  167   1HG   PRO  22          2HG       PRO  22  10.638   1.274  -2.355
  168   2HG   PRO  22          1HG       PRO  22  12.345   1.361  -2.825
  169   1HD   PRO  22          2HD       PRO  22  11.459  -0.281  -0.842
  170   2HD   PRO  22          1HD       PRO  22  13.084   0.433  -0.833
  171    H    ARG  23           H        ARG  23   9.754   1.922   1.677
  172    HA   ARG  23           HA       ARG  23   7.209   2.120   0.727
  173   1HB   ARG  23          2HB       ARG  23   8.045   2.797   3.555
  174   2HB   ARG  23          1HB       ARG  23   6.427   2.308   3.050
  175   1HG   ARG  23          2HG       ARG  23   8.924   0.625   2.680
  176   2HG   ARG  23          1HG       ARG  23   7.759   0.412   3.980
  177   1HD   ARG  23          2HD       ARG  23   6.799  -1.064   2.527
  178   2HD   ARG  23          1HD       ARG  23   6.087   0.394   1.838
  179    HE   ARG  23           HE       ARG  23   8.661  -0.072   0.657
  180   1HH1  ARG  23          1HH2      ARG  23   6.339  -2.409   0.960
  181   2HH1  ARG  23          2HH2      ARG  23   5.969  -2.541  -0.727
  182   1HH2  ARG  23          1HH1      ARG  23   7.796   0.266  -1.622
  183   2HH2  ARG  23          2HH1      ARG  23   6.793  -1.028  -2.187
  184    H    GLU  24           H        GLU  24   9.156   4.889   1.062
  185    HA   GLU  24           HA       GLU  24   6.947   6.746   1.650
  186   1HB   GLU  24          2HB       GLU  24   9.456   7.129   2.176
  187   2HB   GLU  24          1HB       GLU  24   9.630   7.476   0.456
  188   1HG   GLU  24          2HG       GLU  24   7.740   9.162   0.724
  189   2HG   GLU  24          1HG       GLU  24   7.902   8.938   2.467
  190    H    GLU  25           H        GLU  25   8.949   5.802  -1.104
  191    HA   GLU  25           HA       GLU  25   7.657   7.397  -3.097
  192   1HB   GLU  25          2HB       GLU  25   9.124   4.752  -3.313
  193   2HB   GLU  25          1HB       GLU  25   8.591   5.686  -4.711
  194   1HG   GLU  25          2HG       GLU  25  10.265   6.976  -2.561
  195   2HG   GLU  25          1HG       GLU  25  11.025   6.034  -3.843
  196    H    VAL  26           H        VAL  26   7.185   3.921  -2.329
  197    HA   VAL  26           HA       VAL  26   4.966   3.509  -4.045
  198    HB   VAL  26           HB       VAL  26   6.318   1.767  -2.698
  199   1HG1  VAL  26          1HG1      VAL  26   4.161   2.253  -0.636
  200   2HG1  VAL  26          2HG1      VAL  26   5.761   2.979  -0.501
  201   3HG1  VAL  26          3HG1      VAL  26   5.587   1.225  -0.501
  202   1HG2  VAL  26          1HG2      VAL  26   4.321   1.258  -4.107
  203   2HG2  VAL  26          2HG2      VAL  26   3.290   1.549  -2.707
  204   3HG2  VAL  26          3HG2      VAL  26   4.433   0.207  -2.696
  205    H    LYS  27           H        LYS  27   5.161   4.912  -0.815
  206    HA   LYS  27           HA       LYS  27   2.365   4.887  -0.215
  207   1HB   LYS  27          2HB       LYS  27   4.745   6.404   0.749
  208   2HB   LYS  27          1HB       LYS  27   3.159   7.090   1.099
  209   1HG   LYS  27          2HG       LYS  27   3.799   4.192   1.660
  210   2HG   LYS  27          1HG       LYS  27   4.123   5.463   2.837
  211   1HD   LYS  27          2HD       LYS  27   1.942   5.639   3.396
  212   2HD   LYS  27          1HD       LYS  27   1.440   5.682   1.707
  213   1HE   LYS  27          2HE       LYS  27   2.100   3.189   3.304
  214   2HE   LYS  27          1HE       LYS  27   0.492   3.709   2.811
  215   1HZ   LYS  27          1HZ       LYS  27   1.242   2.089   1.269
  216   2HZ   LYS  27          2HZ       LYS  27   2.729   2.880   1.051
  217   3HZ   LYS  27          3HZ       LYS  27   1.296   3.589   0.481
  218    H    ALA  28           H        ALA  28   4.363   7.006  -2.190
  219    HA   ALA  28           HA       ALA  28   2.401   9.111  -2.481
  220   1HB   ALA  28          1HB       ALA  28   3.805   9.936  -4.237
  221   2HB   ALA  28          2HB       ALA  28   4.507   8.343  -4.521
  222   3HB   ALA  28          3HB       ALA  28   4.903   9.232  -3.050
  223    H    LEU  29           H        LEU  29   3.100   6.076  -4.126
  224    HA   LEU  29           HA       LEU  29   1.045   6.528  -6.184
  225   1HB   LEU  29          2HB       LEU  29   3.227   4.644  -5.699
  226   2HB   LEU  29          1HB       LEU  29   1.753   3.825  -6.210
  227    HG   LEU  29           HG       LEU  29   1.594   5.493  -8.109
  228   1HD1  LEU  29          1HD1      LEU  29   2.993   7.264  -7.201
  229   2HD1  LEU  29          2HD1      LEU  29   3.742   6.662  -8.679
  230   3HD1  LEU  29          3HD1      LEU  29   4.376   6.174  -7.107
  231   1HD2  LEU  29          1HD2      LEU  29   2.397   3.353  -8.718
  232   2HD2  LEU  29          2HD2      LEU  29   3.906   3.570  -7.832
  233   3HD2  LEU  29          3HD2      LEU  29   3.631   4.451  -9.334
  234    H    LEU  30           H        LEU  30   1.317   5.091  -3.035
  235    HA   LEU  30           HA       LEU  30  -0.987   3.341  -3.211
  236   1HB   LEU  30          2HB       LEU  30   1.028   3.504  -1.453
  237   2HB   LEU  30          1HB       LEU  30  -0.124   4.519  -0.596
  238    HG   LEU  30           HG       LEU  30  -0.500   2.324   0.229
  239   1HD1  LEU  30          1HD1      LEU  30  -2.762   1.843  -0.423
  240   2HD1  LEU  30          2HD1      LEU  30  -2.536   2.599  -1.998
  241   3HD1  LEU  30          3HD1      LEU  30  -2.562   3.590  -0.538
  242   1HD2  LEU  30          1HD2      LEU  30  -1.089   0.532  -1.670
  243   2HD2  LEU  30          2HD2      LEU  30   0.570   0.805  -1.139
  244   3HD2  LEU  30          3HD2      LEU  30  -0.017   1.560  -2.619
  245    H    ARG  31           H        ARG  31  -0.473   6.568  -1.746
  246    HA   ARG  31           HA       ARG  31  -3.192   6.982  -0.971
  247   1HB   ARG  31          2HB       ARG  31  -0.876   8.356  -0.586
  248   2HB   ARG  31          1HB       ARG  31  -1.629   9.359  -1.825
  249   1HG   ARG  31          2HG       ARG  31  -3.211   8.447   0.573
  250   2HG   ARG  31          1HG       ARG  31  -2.166   9.864   0.674
  251   1HD   ARG  31          2HD       ARG  31  -3.376  10.649  -1.485
  252   2HD   ARG  31          1HD       ARG  31  -4.588   9.438  -1.070
  253    HE   ARG  31           HE       ARG  31  -5.224  10.765   0.808
  254   1HH1  ARG  31          1HH1      ARG  31  -4.802  13.074  -1.011
  255   2HH1  ARG  31          2HH1      ARG  31  -3.741  14.089  -0.094
  256   1HH2  ARG  31          1HH2      ARG  31  -2.807  11.575   2.105
  257   2HH2  ARG  31          2HH2      ARG  31  -2.610  13.241   1.670
  258    H    ARG  32           H        ARG  32  -1.410   7.859  -3.909
  259    HA   ARG  32           HA       ARG  32  -3.462   9.264  -5.268
  260   1HB   ARG  32          2HB       ARG  32  -0.987   8.819  -5.970
  261   2HB   ARG  32          1HB       ARG  32  -1.628   7.355  -6.716
  262   1HG   ARG  32          2HG       ARG  32  -1.835   8.840  -8.487
  263   2HG   ARG  32          1HG       ARG  32  -3.411   9.046  -7.722
  264   1HD   ARG  32          2HD       ARG  32  -2.483  10.975  -6.429
  265   2HD   ARG  32          1HD       ARG  32  -0.972  10.804  -7.321
  266    HE   ARG  32           HE       ARG  32  -3.581  11.510  -8.606
  267   1HH1  ARG  32          1HH1      ARG  32  -0.820  10.484  -9.871
  268   2HH1  ARG  32          2HH1      ARG  32  -0.302  11.973 -10.586
  269   1HH2  ARG  32          1HH2      ARG  32  -2.634  13.903  -8.892
  270   2HH2  ARG  32          2HH2      ARG  32  -1.331  13.910 -10.032
  271    H    LEU  33           H        LEU  33  -2.897   5.806  -4.885
  272    HA   LEU  33           HA       LEU  33  -4.871   4.906  -6.759
  273   1HB   LEU  33          2HB       LEU  33  -2.924   3.671  -5.372
  274   2HB   LEU  33          1HB       LEU  33  -4.296   3.257  -4.348
  275    HG   LEU  33           HG       LEU  33  -5.492   2.343  -6.302
  276   1HD1  LEU  33          1HD1      LEU  33  -3.810   1.985  -8.346
  277   2HD1  LEU  33          2HD1      LEU  33  -3.112   3.478  -7.718
  278   3HD1  LEU  33          3HD1      LEU  33  -4.802   3.436  -8.220
  279   1HD2  LEU  33          1HD2      LEU  33  -4.254   0.329  -6.454
  280   2HD2  LEU  33          2HD2      LEU  33  -3.769   1.011  -4.903
  281   3HD2  LEU  33          3HD2      LEU  33  -2.709   1.167  -6.302
  282    H    GLY  34           H        GLY  34  -5.650   6.937  -4.494
  283   1HA   GLY  34          2HA       GLY  34  -7.780   7.438  -3.612
  284   2HA   GLY  34          1HA       GLY  34  -8.346   5.867  -4.172
  285    H    ALA  35           H        ALA  35  -6.476   4.201  -2.815
  286    HA   ALA  35           HA       ALA  35  -7.718   3.887  -0.296
  287   1HB   ALA  35          1HB       ALA  35  -5.264   2.828  -1.596
  288   2HB   ALA  35          2HB       ALA  35  -6.596   1.963  -0.830
  289   3HB   ALA  35          3HB       ALA  35  -5.336   2.697   0.161
  290    H    LYS  36           H        LYS  36  -7.097   4.468   1.815
  291    HA   LYS  36           HA       LYS  36  -5.600   6.980   2.014
  292   1HB   LYS  36          2HB       LYS  36  -7.691   6.102   3.404
  293   2HB   LYS  36          1HB       LYS  36  -6.434   5.408   4.427
  294   1HG   LYS  36          2HG       LYS  36  -5.377   7.637   4.635
  295   2HG   LYS  36          1HG       LYS  36  -6.658   8.327   3.637
  296   1HD   LYS  36          2HD       LYS  36  -8.202   7.119   5.462
  297   2HD   LYS  36          1HD       LYS  36  -6.767   7.359   6.459
  298   1HE   LYS  36          2HE       LYS  36  -8.146   9.548   4.877
  299   2HE   LYS  36          1HE       LYS  36  -8.365   9.272   6.603
  300   1HZ   LYS  36          1HZ       LYS  36  -5.765   9.842   5.288
  301   2HZ   LYS  36          2HZ       LYS  36  -6.028   9.651   6.955
  302   3HZ   LYS  36          3HZ       LYS  36  -6.697  10.979   6.134
  303    H    VAL  37           H        VAL  37  -3.650   7.234   3.340
  304    HA   VAL  37           HA       VAL  37  -2.130   4.685   3.716
  305    HB   VAL  37           HB       VAL  37  -0.099   5.989   3.126
  306   1HG1  VAL  37          1HG1      VAL  37  -2.317   6.008   1.056
  307   2HG1  VAL  37          2HG1      VAL  37  -1.214   4.674   1.390
  308   3HG1  VAL  37          3HG1      VAL  37  -0.599   6.171   0.692
  309   1HG2  VAL  37          1HG2      VAL  37  -0.723   8.233   3.662
  310   2HG2  VAL  37          2HG2      VAL  37  -2.159   8.154   2.641
  311   3HG2  VAL  37          3HG2      VAL  37  -0.556   8.197   1.907
  312    H    THR  38           H        THR  38  -1.007   4.513   5.648
  313    HA   THR  38           HA       THR  38  -0.694   6.865   7.397
  314    HB   THR  38           HB       THR  38  -2.028   4.522   8.693
  315    HG1  THR  38           HG1      THR  38  -3.549   4.718   7.223
  316   1HG2  THR  38          1HG2      THR  38  -2.810   7.352   9.153
  317   2HG2  THR  38          2HG2      THR  38  -1.167   6.906   9.611
  318   3HG2  THR  38          3HG2      THR  38  -2.541   6.055  10.316
  319    H    ASP  39           H        ASP  39  -0.018   5.464   9.753
  320    HA   ASP  39           HA       ASP  39   1.864   3.332   9.042
  321   1HB   ASP  39          2HB       ASP  39   3.860   4.504   9.769
  322   2HB   ASP  39          1HB       ASP  39   3.085   5.451   8.499
  323    H    SER  40           H        SER  40  -0.166   4.858  11.277
  324    HA   SER  40           HA       SER  40   1.110   3.453  13.581
  325   1HB   SER  40          2HB       SER  40  -1.017   5.610  13.671
  326   2HB   SER  40          1HB       SER  40  -0.077   4.984  15.023
  327    HG   SER  40           HG       SER  40   0.545   7.045  13.713
  328    H    VAL  41           H        VAL  41  -1.146   3.292  15.233
  329    HA   VAL  41           HA       VAL  41  -3.166   1.761  13.676
  330    HB   VAL  41           HB       VAL  41  -3.033  -0.072  15.415
  331   1HG1  VAL  41          1HG1      VAL  41  -0.432   0.303  13.912
  332   2HG1  VAL  41          2HG1      VAL  41  -1.941  -0.117  13.104
  333   3HG1  VAL  41          3HG1      VAL  41  -1.248  -1.210  14.300
  334   1HG2  VAL  41          1HG2      VAL  41  -0.786  -0.199  16.600
  335   2HG2  VAL  41          2HG2      VAL  41  -1.871   1.052  17.202
  336   3HG2  VAL  41          3HG2      VAL  41  -0.531   1.483  16.139
  337    H    SER  42           H        SER  42  -5.189   2.244  14.370
  338    HA   SER  42           HA       SER  42  -5.618   3.039  17.199
  339   1HB   SER  42          2HB       SER  42  -5.292   5.122  15.796
  340   2HB   SER  42          1HB       SER  42  -6.698   4.639  14.853
  341    HG   SER  42           HG       SER  42  -6.639   5.051  17.666
  342    H    ARG  43           H        ARG  43  -6.276   0.665  16.570
  343    HA   ARG  43           HA       ARG  43  -7.928  -0.916  16.099
  344   1HB   ARG  43          2HB       ARG  43  -9.448   1.297  17.497
  345   2HB   ARG  43          1HB       ARG  43 -10.113  -0.313  17.217
  346   1HG   ARG  43          2HG       ARG  43  -8.249  -1.319  18.474
  347   2HG   ARG  43          1HG       ARG  43  -7.560   0.283  18.744
  348   1HD   ARG  43          2HD       ARG  43  -9.595   0.956  19.970
  349   2HD   ARG  43          1HD       ARG  43 -10.283  -0.648  19.704
  350    HE   ARG  43           HE       ARG  43  -8.835  -1.504  21.378
  351   1HH1  ARG  43          1HH2      ARG  43  -9.135   1.019  22.849
  352   2HH1  ARG  43          2HH2      ARG  43  -7.501   1.550  23.064
  353   1HH2  ARG  43          1HH1      ARG  43  -6.220  -0.530  20.605
  354   2HH2  ARG  43          2HH1      ARG  43  -5.851   0.674  21.795
  355    H    LYS  44           H        LYS  44  -7.668   1.491  14.068
  356    HA   LYS  44           HA       LYS  44  -9.976   0.598  12.450
  357   1HB   LYS  44          2HB       LYS  44  -9.469   3.491  13.204
  358   2HB   LYS  44          1HB       LYS  44 -10.546   2.993  11.900
  359   1HG   LYS  44          2HG       LYS  44 -11.757   1.554  13.633
  360   2HG   LYS  44          1HG       LYS  44 -10.826   2.417  14.858
  361   1HD   LYS  44          2HD       LYS  44 -11.700   4.577  13.851
  362   2HD   LYS  44          1HD       LYS  44 -12.791   3.593  12.875
  363   1HE   LYS  44          2HE       LYS  44 -12.663   3.618  15.908
  364   2HE   LYS  44          1HE       LYS  44 -13.924   4.361  14.922
  365   1HZ   LYS  44          1HZ       LYS  44 -13.432   1.545  15.503
  366   2HZ   LYS  44          2HZ       LYS  44 -13.988   1.919  13.941
  367   3HZ   LYS  44          3HZ       LYS  44 -14.900   2.371  15.302
  368    H    THR  45           H        THR  45  -6.760   1.126  12.639
  369    HA   THR  45           HA       THR  45  -6.467   1.225   9.718
  370    HB   THR  45           HB       THR  45  -5.158   3.337  11.471
  371    HG1  THR  45           HG1      THR  45  -7.204   3.561   9.521
  372   1HG2  THR  45          1HG2      THR  45  -4.906   2.514   8.609
  373   2HG2  THR  45          2HG2      THR  45  -3.668   3.094   9.723
  374   3HG2  THR  45          3HG2      THR  45  -4.798   4.232   8.991
  375    H    SER  46           H        SER  46  -5.669  -0.950  10.290
  376    HA   SER  46           HA       SER  46  -2.814  -0.850  11.130
  377   1HB   SER  46          2HB       SER  46  -4.841  -2.830  12.202
  378   2HB   SER  46          1HB       SER  46  -3.116  -2.822  12.556
  379    HG   SER  46           HG       SER  46  -3.894  -0.412  13.071
  380    H    TYR  47           H        TYR  47  -3.484  -1.019   8.528
  381    HA   TYR  47           HA       TYR  47  -3.385  -3.893   7.765
  382   1HB   TYR  47          2HB       TYR  47  -3.780  -1.444   6.011
  383   2HB   TYR  47          1HB       TYR  47  -3.938  -3.126   5.508
  384    HD1  TYR  47           HD1      TYR  47  -5.832  -4.501   6.263
  385    HD2  TYR  47           HD2      TYR  47  -5.488  -0.366   7.375
  386    HE1  TYR  47           HE1      TYR  47  -8.201  -4.500   6.990
  387    HE2  TYR  47           HE2      TYR  47  -7.858  -0.365   8.102
  388    HH   TYR  47           HH       TYR  47  -9.973  -3.083   7.471
  389    H    LEU  48           H        LEU  48  -1.410  -4.688   7.101
  390    HA   LEU  48           HA       LEU  48   0.788  -2.714   6.756
  391   1HB   LEU  48          2HB       LEU  48   1.172  -4.361   8.511
  392   2HB   LEU  48          1HB       LEU  48   0.858  -5.675   7.379
  393    HG   LEU  48           HG       LEU  48   2.794  -4.801   5.977
  394   1HD1  LEU  48          1HD1      LEU  48   3.141  -2.590   6.645
  395   2HD1  LEU  48          2HD1      LEU  48   4.421  -3.429   7.520
  396   3HD1  LEU  48          3HD1      LEU  48   2.940  -2.965   8.356
  397   1HD2  LEU  48          1HD2      LEU  48   4.273  -5.378   8.340
  398   2HD2  LEU  48          2HD2      LEU  48   3.849  -6.478   7.029
  399   3HD2  LEU  48          3HD2      LEU  48   2.777  -6.305   8.417
  400    H    VAL  49           H        VAL  49   1.225  -2.274   4.651
  401    HA   VAL  49           HA       VAL  49   0.546  -4.184   2.542
  402    HB   VAL  49           HB       VAL  49   2.343  -1.870   1.980
  403   1HG1  VAL  49          1HG1      VAL  49   0.896  -1.682   0.024
  404   2HG1  VAL  49          2HG1      VAL  49  -0.230  -2.853   0.709
  405   3HG1  VAL  49          3HG1      VAL  49   1.385  -3.364   0.227
  406   1HG2  VAL  49          1HG2      VAL  49  -0.526  -1.588   2.925
  407   2HG2  VAL  49          2HG2      VAL  49   0.322  -0.343   2.007
  408   3HG2  VAL  49          3HG2      VAL  49   0.906  -0.812   3.602
  409    H    VAL  50           H        VAL  50   1.873  -5.951   2.336
  410    HA   VAL  50           HA       VAL  50   4.427  -6.261   3.434
  411    HB   VAL  50           HB       VAL  50   3.322  -7.507   0.893
  412   1HG1  VAL  50          1HG1      VAL  50   5.732  -8.144   2.597
  413   2HG1  VAL  50          2HG1      VAL  50   5.648  -7.955   0.845
  414   3HG1  VAL  50          3HG1      VAL  50   4.949  -9.380   1.613
  415   1HG2  VAL  50          1HG2      VAL  50   2.002  -7.795   3.038
  416   2HG2  VAL  50          2HG2      VAL  50   3.413  -8.604   3.719
  417   3HG2  VAL  50          3HG2      VAL  50   2.581  -9.301   2.328
  418    H    GLY  51           H        GLY  51   6.535  -6.476   2.170
  419   1HA   GLY  51          2HA       GLY  51   6.820  -4.847  -0.235
  420   2HA   GLY  51          1HA       GLY  51   7.459  -4.051   1.201
  421    H    GLU  52           H        GLU  52   8.547  -6.238   2.561
  422    HA   GLU  52           HA       GLU  52  10.471  -7.448   0.640
  423   1HB   GLU  52          2HB       GLU  52  12.374  -6.708   1.967
  424   2HB   GLU  52          1HB       GLU  52  11.413  -5.301   1.528
  425   1HG   GLU  52          2HG       GLU  52  10.918  -6.718   4.137
  426   2HG   GLU  52          1HG       GLU  52  12.215  -5.531   3.991
  427    H    ASN  53           H        ASN  53  12.131  -8.266   2.971
  428    HA   ASN  53           HA       ASN  53  10.296 -10.330   4.124
  429   1HB   ASN  53          2HB       ASN  53  12.907 -10.597   2.774
  430   2HB   ASN  53          1HB       ASN  53  12.782 -11.484   4.294
  431   1HD2  ASN  53          1HD2      ASN  53  12.375 -13.618   3.611
  432   2HD2  ASN  53          2HD2      ASN  53  11.110 -14.063   2.571
  433    HA   PRO  54           HA       PRO  54  13.361  -9.337   7.649
  434   1HB   PRO  54          2HB       PRO  54  15.479  -7.675   7.183
  435   2HB   PRO  54          1HB       PRO  54  15.550  -9.427   6.918
  436   1HG   PRO  54          2HG       PRO  54  15.217  -7.227   4.950
  437   2HG   PRO  54          1HG       PRO  54  16.120  -8.744   4.809
  438   1HD   PRO  54          2HD       PRO  54  13.637  -8.334   3.689
  439   2HD   PRO  54          1HD       PRO  54  14.275  -9.932   4.129
  440    H    GLY  55           H        GLY  55  11.672  -7.286   5.801
  441   1HA   GLY  55          2HA       GLY  55  12.152  -4.674   6.785
  442   2HA   GLY  55          1HA       GLY  55  10.599  -5.244   6.181
  443    H    SER  56           H        SER  56  10.904  -3.459   8.397
  444    HA   SER  56           HA       SER  56  10.725  -4.790  10.930
  445   1HB   SER  56          2HB       SER  56  11.096  -2.351  10.711
  446   2HB   SER  56          1HB       SER  56   9.477  -2.165  10.043
  447    HG   SER  56           HG       SER  56   9.869  -3.451  12.517
  448    H    LYS  57           H        LYS  57   8.730  -4.930   8.267
  449    HA   LYS  57           HA       LYS  57   6.090  -4.871   9.214
  450   1HB   LYS  57          2HB       LYS  57   5.758  -6.757   7.452
  451   2HB   LYS  57          1HB       LYS  57   6.331  -5.188   6.896
  452   1HG   LYS  57          2HG       LYS  57   8.272  -6.080   6.166
  453   2HG   LYS  57          1HG       LYS  57   8.556  -6.866   7.716
  454   1HD   LYS  57          2HD       LYS  57   8.393  -8.594   6.037
  455   2HD   LYS  57          1HD       LYS  57   6.934  -8.662   7.026
  456   1HE   LYS  57          2HE       LYS  57   6.316  -8.827   4.670
  457   2HE   LYS  57          1HE       LYS  57   5.751  -7.284   5.310
  458   1HZ   LYS  57          1HZ       LYS  57   8.383  -6.984   4.374
  459   2HZ   LYS  57          2HZ       LYS  57   6.965  -6.236   3.808
  460   3HZ   LYS  57          3HZ       LYS  57   7.463  -7.724   3.156
  461    H    LEU  58           H        LEU  58   8.603  -7.202   9.852
  462    HA   LEU  58           HA       LEU  58   7.264  -9.540  10.497
  463   1HB   LEU  58          2HB       LEU  58   8.983  -9.921  12.224
  464   2HB   LEU  58          1HB       LEU  58   9.696  -9.257  10.757
  465    HG   LEU  58           HG       LEU  58   9.061  -6.974  12.166
  466   1HD1  LEU  58          1HD1      LEU  58  10.260  -8.873  14.187
  467   2HD1  LEU  58          2HD1      LEU  58   8.521  -8.591  14.104
  468   3HD1  LEU  58          3HD1      LEU  58   9.615  -7.254  14.456
  469   1HD2  LEU  58          1HD2      LEU  58  11.517  -6.913  12.678
  470   2HD2  LEU  58          2HD2      LEU  58  11.170  -7.357  11.007
  471   3HD2  LEU  58          3HD2      LEU  58  11.625  -8.600  12.174
  472    H    GLU  59           H        GLU  59   7.088  -6.488  12.162
  473    HA   GLU  59           HA       GLU  59   5.797  -7.611  14.543
  474   1HB   GLU  59          2HB       GLU  59   7.181  -5.609  14.748
  475   2HB   GLU  59          1HB       GLU  59   6.153  -4.754  13.599
  476   1HG   GLU  59          2HG       GLU  59   4.325  -4.688  15.104
  477   2HG   GLU  59          1HG       GLU  59   5.009  -5.954  16.123
  478    H    LYS  60           H        LYS  60   4.612  -5.209  12.117
  479    HA   LYS  60           HA       LYS  60   1.877  -5.705  12.901
  480   1HB   LYS  60          2HB       LYS  60   2.918  -3.661  11.624
  481   2HB   LYS  60          1HB       LYS  60   2.585  -4.629  10.187
  482   1HG   LYS  60          2HG       LYS  60   0.546  -3.563  10.355
  483   2HG   LYS  60          1HG       LYS  60   0.217  -4.924  11.427
  484   1HD   LYS  60          2HD       LYS  60  -0.437  -3.072  12.718
  485   2HD   LYS  60          1HD       LYS  60   1.198  -3.397  13.295
  486   1HE   LYS  60          2HE       LYS  60   1.765  -1.724  11.241
  487   2HE   LYS  60          1HE       LYS  60   0.175  -1.113  11.696
  488   1HZ   LYS  60          1HZ       LYS  60   1.092  -1.190  14.063
  489   2HZ   LYS  60          2HZ       LYS  60   1.631   0.057  13.043
  490   3HZ   LYS  60          3HZ       LYS  60   2.621  -1.292  13.336
  491    H    ALA  61           H        ALA  61   3.970  -7.014  10.367
  492    HA   ALA  61           HA       ALA  61   1.956  -8.403   8.907
  493   1HB   ALA  61          1HB       ALA  61   3.698  -9.635   7.896
  494   2HB   ALA  61          2HB       ALA  61   4.751  -9.457   9.300
  495   3HB   ALA  61          3HB       ALA  61   4.414  -8.069   8.267
  496    H    ARG  62           H        ARG  62   3.933  -9.457  11.752
  497    HA   ARG  62           HA       ARG  62   2.855 -12.090  11.887
  498   1HB   ARG  62          2HB       ARG  62   4.349 -10.298  13.650
  499   2HB   ARG  62          1HB       ARG  62   3.158 -11.238  14.545
  500   1HG   ARG  62          2HG       ARG  62   5.103 -12.603  14.518
  501   2HG   ARG  62          1HG       ARG  62   4.056 -13.285  13.274
  502   1HD   ARG  62          2HD       ARG  62   5.368 -11.548  11.729
  503   2HD   ARG  62          1HD       ARG  62   6.600 -11.744  12.976
  504    HE   ARG  62           HE       ARG  62   6.687 -14.133  12.426
  505   1HH1  ARG  62          1HH1      ARG  62   6.609 -12.223   9.851
  506   2HH1  ARG  62          2HH1      ARG  62   5.776 -13.292   8.771
  507   1HH2  ARG  62          1HH2      ARG  62   4.809 -15.492  11.272
  508   2HH2  ARG  62          2HH2      ARG  62   4.757 -15.143   9.576
  509    H    ALA  63           H        ALA  63   1.730  -8.944  13.022
  510    HA   ALA  63           HA       ALA  63  -0.291  -8.312  14.044
  511   1HB   ALA  63          1HB       ALA  63  -0.596  -9.442  11.421
  512   2HB   ALA  63          2HB       ALA  63  -1.475  -8.102  12.152
  513   3HB   ALA  63          3HB       ALA  63  -2.052  -9.754  12.360
  514    H    LEU  64           H        LEU  64  -0.239  -9.409  16.100
  515    HA   LEU  64           HA       LEU  64  -1.427 -12.096  16.275
  516   1HB   LEU  64          2HB       LEU  64  -1.113 -11.745  18.745
  517   2HB   LEU  64          1HB       LEU  64   0.377 -11.576  17.819
  518    HG   LEU  64           HG       LEU  64  -1.081  -9.046  18.037
  519   1HD1  LEU  64          1HD1      LEU  64  -1.784  -9.926  20.200
  520   2HD1  LEU  64          2HD1      LEU  64  -0.533  -8.709  20.452
  521   3HD1  LEU  64          3HD1      LEU  64  -0.132 -10.422  20.568
  522   1HD2  LEU  64          1HD2      LEU  64   1.326  -9.459  17.322
  523   2HD2  LEU  64          2HD2      LEU  64   1.685  -9.814  19.011
  524   3HD2  LEU  64          3HD2      LEU  64   1.117  -8.210  18.549
  525    H    GLY  65           H        GLY  65  -3.008  -9.784  15.209
  526   1HA   GLY  65          2HA       GLY  65  -5.530 -10.328  16.251
  527   2HA   GLY  65          1HA       GLY  65  -4.920  -8.984  17.220
  528    H    VAL  66           H        VAL  66  -3.347  -7.831  15.035
  529    HA   VAL  66           HA       VAL  66  -5.543  -6.398  13.709
  530    HB   VAL  66           HB       VAL  66  -3.414  -5.176  12.679
  531   1HG1  VAL  66          1HG1      VAL  66  -3.377  -3.729  14.709
  532   2HG1  VAL  66          2HG1      VAL  66  -4.301  -4.958  15.573
  533   3HG1  VAL  66          3HG1      VAL  66  -5.018  -4.124  14.194
  534   1HG2  VAL  66          1HG2      VAL  66  -1.414  -5.440  13.850
  535   2HG2  VAL  66          2HG2      VAL  66  -2.016  -7.096  13.840
  536   3HG2  VAL  66          3HG2      VAL  66  -2.214  -6.096  15.277
  537    HA   PRO  67           HA       PRO  67  -4.988  -8.494   9.833
  538   1HB   PRO  67          2HB       PRO  67  -6.112  -6.662   8.151
  539   2HB   PRO  67          1HB       PRO  67  -7.048  -7.616   9.313
  540   1HG   PRO  67          2HG       PRO  67  -6.385  -4.771   9.350
  541   2HG   PRO  67          1HG       PRO  67  -7.649  -5.646  10.223
  542   1HD   PRO  67          2HD       PRO  67  -5.083  -4.760  11.224
  543   2HD   PRO  67          1HD       PRO  67  -6.384  -5.584  12.109
  544    H    THR  68           H        THR  68  -3.630  -8.640   8.012
  545    HA   THR  68           HA       THR  68  -1.807  -6.313   7.487
  546    HB   THR  68           HB       THR  68  -0.055  -7.993   6.948
  547    HG1  THR  68           HG1      THR  68  -1.782  -9.900   8.107
  548   1HG2  THR  68          1HG2      THR  68   0.017  -8.960   9.395
  549   2HG2  THR  68          2HG2      THR  68  -1.358  -7.891   9.647
  550   3HG2  THR  68          3HG2      THR  68   0.191  -7.228   9.129
  551    H    LEU  69           H        LEU  69  -1.904  -5.631   5.292
  552    HA   LEU  69           HA       LEU  69  -3.395  -7.422   3.448
  553   1HB   LEU  69          2HB       LEU  69  -3.681  -4.738   4.021
  554   2HB   LEU  69          1HB       LEU  69  -2.742  -4.707   2.529
  555    HG   LEU  69           HG       LEU  69  -4.522  -6.539   1.777
  556   1HD1  LEU  69          1HD1      LEU  69  -6.734  -6.101   2.729
  557   2HD1  LEU  69          2HD1      LEU  69  -6.055  -4.877   3.801
  558   3HD1  LEU  69          3HD1      LEU  69  -5.623  -6.572   4.016
  559   1HD2  LEU  69          1HD2      LEU  69  -5.001  -3.545   1.907
  560   2HD2  LEU  69          2HD2      LEU  69  -5.936  -4.648   0.895
  561   3HD2  LEU  69          3HD2      LEU  69  -4.210  -4.437   0.608
  562    H    THR  70           H        THR  70  -2.249  -8.536   1.977
  563    HA   THR  70           HA       THR  70   0.552  -8.323   1.582
  564    HB   THR  70           HB       THR  70  -1.317  -9.353  -0.537
  565    HG1  THR  70           HG1      THR  70  -2.114 -10.098   1.441
  566   1HG2  THR  70          1HG2      THR  70   1.276 -10.449   0.587
  567   2HG2  THR  70          2HG2      THR  70   1.180  -9.408  -0.833
  568   3HG2  THR  70          3HG2      THR  70   0.430 -11.004  -0.857
  569    H    GLU  71           H        GLU  71   1.799  -7.231   0.068
  570    HA   GLU  71           HA       GLU  71   0.676  -4.875  -1.203
  571   1HB   GLU  71          2HB       GLU  71   3.175  -5.540  -0.396
  572   2HB   GLU  71          1HB       GLU  71   3.313  -5.913  -2.111
  573   1HG   GLU  71          2HG       GLU  71   1.976  -3.460  -2.064
  574   2HG   GLU  71          1HG       GLU  71   3.187  -3.310  -0.791
  575    H    GLU  72           H        GLU  72   1.189  -8.165  -2.133
  576    HA   GLU  72           HA       GLU  72   1.444  -8.064  -4.916
  577   1HB   GLU  72          2HB       GLU  72  -0.212  -9.930  -3.197
  578   2HB   GLU  72          1HB       GLU  72   0.006 -10.173  -4.930
  579   1HG   GLU  72          2HG       GLU  72   2.281  -9.938  -2.934
  580   2HG   GLU  72          1HG       GLU  72   1.651 -11.464  -3.551
  581    H    GLU  73           H        GLU  73  -1.593  -7.875  -3.036
  582    HA   GLU  73           HA       GLU  73  -3.338  -7.492  -5.253
  583   1HB   GLU  73          2HB       GLU  73  -3.447  -6.922  -2.321
  584   2HB   GLU  73          1HB       GLU  73  -4.621  -6.096  -3.345
  585   1HG   GLU  73          2HG       GLU  73  -4.153  -9.083  -3.488
  586   2HG   GLU  73          1HG       GLU  73  -5.359  -8.360  -2.425
  587    H    LEU  74           H        LEU  74  -1.392  -5.201  -3.364
  588    HA   LEU  74           HA       LEU  74  -2.418  -2.779  -4.432
  589   1HB   LEU  74          2HB       LEU  74  -0.825  -2.856  -2.539
  590   2HB   LEU  74          1HB       LEU  74   0.437  -3.435  -3.616
  591    HG   LEU  74           HG       LEU  74   0.420  -0.921  -3.059
  592   1HD1  LEU  74          1HD1      LEU  74   0.306  -1.093  -6.002
  593   2HD1  LEU  74          2HD1      LEU  74   1.321  -2.313  -5.234
  594   3HD1  LEU  74          3HD1      LEU  74   1.631  -0.602  -4.949
  595   1HD2  LEU  74          1HD2      LEU  74  -1.101   0.484  -4.278
  596   2HD2  LEU  74          2HD2      LEU  74  -2.078  -0.722  -3.445
  597   3HD2  LEU  74          3HD2      LEU  74  -1.754  -0.888  -5.169
  598    H    TYR  75           H        TYR  75   0.248  -4.858  -5.595
  599    HA   TYR  75           HA       TYR  75   0.873  -3.299  -7.908
  600   1HB   TYR  75          2HB       TYR  75   1.422  -6.052  -6.950
  601   2HB   TYR  75          1HB       TYR  75   1.476  -5.843  -8.700
  602    HD1  TYR  75           HD1      TYR  75   2.649  -3.429  -9.357
  603    HD2  TYR  75           HD2      TYR  75   3.474  -5.817  -5.881
  604    HE1  TYR  75           HE1      TYR  75   4.886  -2.377  -9.164
  605    HE2  TYR  75           HE2      TYR  75   5.710  -4.763  -5.690
  606    HH   TYR  75           HH       TYR  75   6.578  -2.064  -6.883
  607    H    ARG  76           H        ARG  76  -1.493  -5.875  -7.336
  608    HA   ARG  76           HA       ARG  76  -2.298  -6.244 -10.049
  609   1HB   ARG  76          2HB       ARG  76  -2.895  -7.734  -8.099
  610   2HB   ARG  76          1HB       ARG  76  -4.058  -6.510  -7.594
  611   1HG   ARG  76          2HG       ARG  76  -5.151  -6.686  -9.840
  612   2HG   ARG  76          1HG       ARG  76  -4.049  -8.006 -10.232
  613   1HD   ARG  76          2HD       ARG  76  -4.904  -9.116  -8.061
  614   2HD   ARG  76          1HD       ARG  76  -6.214  -7.937  -8.129
  615    HE   ARG  76           HE       ARG  76  -5.759  -9.534 -10.574
  616   1HH1  ARG  76          1HH2      ARG  76  -6.856 -10.646  -7.736
  617   2HH1  ARG  76          2HH2      ARG  76  -8.519 -10.832  -8.185
  618   1HH2  ARG  76          1HH1      ARG  76  -8.196  -9.044 -11.138
  619   2HH2  ARG  76          2HH1      ARG  76  -9.276  -9.924 -10.111
  620    H    LEU  77           H        LEU  77  -4.424  -4.708  -7.626
  621    HA   LEU  77           HA       LEU  77  -6.040  -3.315  -9.409
  622   1HB   LEU  77          2HB       LEU  77  -5.183  -2.655  -6.588
  623   2HB   LEU  77          1HB       LEU  77  -6.337  -1.652  -7.460
  624    HG   LEU  77           HG       LEU  77  -7.598  -3.248  -6.159
  625   1HD1  LEU  77          1HD1      LEU  77  -8.069  -2.849  -8.743
  626   2HD1  LEU  77          2HD1      LEU  77  -9.006  -4.025  -7.824
  627   3HD1  LEU  77          3HD1      LEU  77  -7.676  -4.566  -8.846
  628   1HD2  LEU  77          1HD2      LEU  77  -6.189  -5.515  -7.570
  629   2HD2  LEU  77          2HD2      LEU  77  -7.198  -5.579  -6.126
  630   3HD2  LEU  77          3HD2      LEU  77  -5.588  -4.865  -6.045
  631    H    LEU  78           H        LEU  78  -2.794  -2.438  -8.361
  632    HA   LEU  78           HA       LEU  78  -2.953   0.287  -9.388
  633   1HB   LEU  78          2HB       LEU  78  -1.344  -0.403  -7.604
  634   2HB   LEU  78          1HB       LEU  78  -0.491  -1.385  -8.794
  635    HG   LEU  78           HG       LEU  78  -0.909   1.298  -9.812
  636   1HD1  LEU  78          1HD1      LEU  78  -0.896   1.855  -7.374
  637   2HD1  LEU  78          2HD1      LEU  78   0.485   2.527  -8.238
  638   3HD1  LEU  78          3HD1      LEU  78   0.685   1.088  -7.239
  639   1HD2  LEU  78          1HD2      LEU  78   1.575  -0.295  -9.093
  640   2HD2  LEU  78          2HD2      LEU  78   1.553   1.162 -10.085
  641   3HD2  LEU  78          3HD2      LEU  78   0.761  -0.305 -10.657
  642    H    GLU  79           H        GLU  79  -1.057  -2.549 -10.479
  643    HA   GLU  79           HA       GLU  79  -0.203  -1.589 -12.955
  644   1HB   GLU  79          2HB       GLU  79  -1.064  -4.376 -12.152
  645   2HB   GLU  79          1HB       GLU  79  -0.339  -4.023 -13.721
  646   1HG   GLU  79          2HG       GLU  79   1.725  -3.440 -12.796
  647   2HG   GLU  79          1HG       GLU  79   1.028  -3.062 -11.223
  648    H    ALA  80           H        ALA  80  -3.423  -2.685 -12.060
  649    HA   ALA  80           HA       ALA  80  -4.397  -2.674 -14.834
  650   1HB   ALA  80          1HB       ALA  80  -5.926  -2.726 -12.205
  651   2HB   ALA  80          2HB       ALA  80  -5.445  -4.147 -13.133
  652   3HB   ALA  80          3HB       ALA  80  -6.619  -3.013 -13.801
  653    H    ARG  81           H        ARG  81  -5.367  -0.802 -11.957
  654    HA   ARG  81           HA       ARG  81  -6.715   1.313 -13.082
  655   1HB   ARG  81          2HB       ARG  81  -6.351   1.212 -10.681
  656   2HB   ARG  81          1HB       ARG  81  -4.622   1.468 -10.890
  657   1HG   ARG  81          2HG       ARG  81  -5.609   3.578 -10.241
  658   2HG   ARG  81          1HG       ARG  81  -5.156   3.700 -11.939
  659   1HD   ARG  81          2HD       ARG  81  -7.458   3.258 -12.626
  660   2HD   ARG  81          1HD       ARG  81  -7.937   3.006 -10.947
  661    HE   ARG  81           HE       ARG  81  -6.799   5.645 -11.711
  662   1HH1  ARG  81          1HH1      ARG  81  -9.754   4.164 -12.012
  663   2HH1  ARG  81          2HH1      ARG  81 -10.622   5.252 -10.980
  664   1HH2  ARG  81          1HH2      ARG  81  -7.770   6.845  -9.818
  665   2HH2  ARG  81          2HH2      ARG  81  -9.497   6.771  -9.737
  666    H    THR  82           H        THR  82  -3.153   1.144 -12.785
  667    HA   THR  82           HA       THR  82  -2.658   3.561 -14.278
  668    HB   THR  82           HB       THR  82  -0.803   1.173 -14.037
  669    HG1  THR  82           HG1      THR  82  -0.741   3.319 -12.255
  670   1HG2  THR  82          1HG2      THR  82  -0.051   2.922 -15.571
  671   2HG2  THR  82          2HG2      THR  82   0.934   2.953 -14.109
  672   3HG2  THR  82          3HG2      THR  82  -0.335   4.154 -14.341
  673    H    GLY  83           H        GLY  83  -2.622   0.118 -15.136
  674   1HA   GLY  83          2HA       GLY  83  -3.272  -0.865 -17.207
  675   2HA   GLY  83          1HA       GLY  83  -3.475   0.754 -17.879
  676    H    LYS  84           H        LYS  84  -0.531   0.169 -16.188
  677    HA   LYS  84           HA       LYS  84   0.951  -0.680 -18.580
  678   1HB   LYS  84          2HB       LYS  84   0.615   1.884 -18.666
  679   2HB   LYS  84          1HB       LYS  84   1.710   1.949 -17.286
  680   1HG   LYS  84          2HG       LYS  84   3.507   1.010 -18.532
  681   2HG   LYS  84          1HG       LYS  84   2.434   0.472 -19.824
  682   1HD   LYS  84          2HD       LYS  84   2.014   2.757 -20.510
  683   2HD   LYS  84          1HD       LYS  84   2.896   3.385 -19.118
  684   1HE   LYS  84          2HE       LYS  84   4.201   1.578 -21.162
  685   2HE   LYS  84          1HE       LYS  84   4.172   3.333 -21.343
  686   1HZ   LYS  84          1HZ       LYS  84   5.809   3.523 -19.885
  687   2HZ   LYS  84          2HZ       LYS  84   5.949   1.830 -19.851
  688   3HZ   LYS  84          3HZ       LYS  84   4.962   2.628 -18.721
  689    H    LYS  85           H        LYS  85   3.091   1.005 -16.756
  690    HA   LYS  85           HA       LYS  85   3.560  -1.296 -14.897
  691   1HB   LYS  85          2HB       LYS  85   5.457   0.337 -16.577
  692   2HB   LYS  85          1HB       LYS  85   6.025  -0.432 -15.094
  693   1HG   LYS  85          2HG       LYS  85   5.597  -2.599 -15.902
  694   2HG   LYS  85          1HG       LYS  85   4.482  -2.019 -17.140
  695   1HD   LYS  85          2HD       LYS  85   6.645  -2.702 -18.129
  696   2HD   LYS  85          1HD       LYS  85   6.353  -0.978 -18.356
  697   1HE   LYS  85          2HE       LYS  85   8.689  -1.490 -17.605
  698   2HE   LYS  85          1HE       LYS  85   7.820  -0.432 -16.493
  699   1HZ   LYS  85          1HZ       LYS  85   9.053  -2.313 -15.436
  700   2HZ   LYS  85          2HZ       LYS  85   7.949  -3.377 -16.169
  701   3HZ   LYS  85          3HZ       LYS  85   7.406  -2.231 -15.039
  702    H    ALA  86           H        ALA  86   4.308  -0.730 -12.791
  703    HA   ALA  86           HA       ALA  86   3.269   1.689 -11.697
  704   1HB   ALA  86          1HB       ALA  86   3.789  -0.434 -10.419
  705   2HB   ALA  86          2HB       ALA  86   4.363   1.040  -9.642
  706   3HB   ALA  86          3HB       ALA  86   5.494   0.004 -10.511
  707    H    GLU  87           H        GLU  87   6.330   0.923 -13.177
  708    HA   GLU  87           HA       GLU  87   7.663   3.350 -12.186
  709   1HB   GLU  87          2HB       GLU  87   8.500   1.380 -14.339
  710   2HB   GLU  87          1HB       GLU  87   9.521   2.634 -13.636
  711   1HG   GLU  87          2HG       GLU  87   8.246   0.363 -12.077
  712   2HG   GLU  87          1HG       GLU  87   9.928   0.403 -12.606
  713    H    GLU  88           H        GLU  88   5.634   2.424 -14.809
  714    HA   GLU  88           HA       GLU  88   4.794   3.624 -16.630
  715   1HB   GLU  88          2HB       GLU  88   6.079   6.033 -15.299
  716   2HB   GLU  88          1HB       GLU  88   4.791   6.053 -16.502
  717   1HG   GLU  88          2HG       GLU  88   3.227   5.067 -14.989
  718   2HG   GLU  88          1HG       GLU  88   4.497   4.642 -13.841
  719    H    LEU  89           H        LEU  89   6.924   6.183 -16.923
  720    HA   LEU  89           HA       LEU  89   8.719   4.618 -18.739
  721   1HB   LEU  89          2HB       LEU  89   8.742   6.608 -20.228
  722   2HB   LEU  89          1HB       LEU  89   7.123   5.928 -20.063
  723    HG   LEU  89           HG       LEU  89   7.363   7.773 -17.947
  724   1HD1  LEU  89          1HD1      LEU  89   8.066   9.835 -18.989
  725   2HD1  LEU  89          2HD1      LEU  89   8.270   9.037 -20.548
  726   3HD1  LEU  89          3HD1      LEU  89   9.360   8.658 -19.214
  727   1HD2  LEU  89          1HD2      LEU  89   5.336   7.259 -19.273
  728   2HD2  LEU  89          2HD2      LEU  89   6.040   8.085 -20.663
  729   3HD2  LEU  89          3HD2      LEU  89   5.632   8.996 -19.209
  730    H    VAL  90           H        VAL  90   8.430   6.866 -16.171
  731    HA   VAL  90           HA       VAL  90  10.001   8.113 -14.965
  732    HB   VAL  90           HB       VAL  90  11.943   6.070 -16.096
  733   1HG1  VAL  90          1HG1      VAL  90  12.582   6.659 -13.452
  734   2HG1  VAL  90          2HG1      VAL  90  12.121   8.224 -14.120
  735   3HG1  VAL  90          3HG1      VAL  90  13.411   7.287 -14.876
  736   1HG2  VAL  90          1HG2      VAL  90  11.395   4.878 -13.902
  737   2HG2  VAL  90          2HG2      VAL  90  10.134   4.831 -15.133
  738   3HG2  VAL  90          3HG2      VAL  90  10.000   5.950 -13.776
  739    H    GLY  91           H        GLY  91  12.799   7.483 -16.784
  740   1HA   GLY  91          2HA       GLY  91  13.317  10.150 -17.467
  741   2HA   GLY  91          1HA       GLY  91  14.041   8.775 -18.298
  742    H    SER  92           H        SER  92  12.454  11.496 -18.947
  743    HA   SER  92           HA       SER  92  10.271  10.816 -20.629
  744   1HB   SER  92          2HB       SER  92  10.791  13.008 -21.775
  745   2HB   SER  92          1HB       SER  92  10.640  13.124 -20.025
  746    HG   SER  92           HG       SER  92  13.161  12.498 -20.674